BindingDB Reactant_set_id Ligand SMILES Ligand InChI Ligand InChI Key BindingDB MonomerID BindingDB Ligand Name Target Name Target Source Organism According to Curator or DataSource Ki (nM) IC50 (nM) Kd (nM) EC50 (nM) kon (M-1-s-1) koff (s-1) pH Temp (C) Curation/DataSource Article DOI BindingDB Entry DOI PMID PubChem AID Patent Number Authors Institution Link to Ligand in BindingDB Link to Target in BindingDB Link to Ligand-Target Pair in BindingDB Ligand HET ID in PDB PDB ID(s) for Ligand-Target Complex PubChem CID of Ligand PubChem SID of Ligand ChEBI ID of Ligand ChEMBL ID of Ligand DrugBank ID of Ligand IUPHAR_GRAC ID of Ligand KEGG ID of Ligand ZINC ID of Ligand Number of Protein Chains in Target (>1 implies a multichain complex) BindingDB Target Chain Sequence PDB ID(s) of Target Chain UniProt (SwissProt) Recommended Name of Target Chain UniProt (SwissProt) Entry Name of Target Chain UniProt (SwissProt) Primary ID of Target Chain UniProt (SwissProt) Secondary ID(s) of Target Chain UniProt (SwissProt) Alternative ID(s) of Target Chain UniProt (TrEMBL) Submitted Name of Target Chain UniProt (TrEMBL) Entry Name of Target Chain UniProt (TrEMBL) Primary ID of Target Chain UniProt (TrEMBL) Secondary ID(s) of Target Chain UniProt (TrEMBL) Alternative ID(s) of Target Chain 51056115 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 22 ChEMBL 10.1016/j.ejmech.2013.01.039 10.7270/Q2C82BN6 23454517 Lu, C; Zhou, Q; Yan, J; Du, Z; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056116 COc1ccc(C[C@@H](C)N(CCCCCCNc2c3CCCCc3nc3ccccc23)CC#C)cc1 InChI=1S/C32H41N3O/c1-4-22-35(25(2)24-26-17-19-27(36-3)20-18-26)23-12-6-5-11-21-33-32-28-13-7-9-15-30(28)34-31-16-10-8-14-29(31)32/h1,7,9,13,15,17-20,25H,5-6,8,10-12,14,16,21-24H2,2-3H3,(H,33,34)/t25-/m1/s1 JBBGGNXIRLPBOK-RUZDIDTESA-N 50430725 CHEMBL2333931 Cholinesterase 29 ChEMBL 10.1016/j.ejmech.2013.01.039 10.7270/Q2C82BN6 23454517 Lu, C; Zhou, Q; Yan, J; Du, Z; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430725 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430725&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71654261 164159600 CHEMBL2333931 ZINC95587359 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056117 C[C@H](Cc1ccc(OCCCCCCCCNc2c3CCCCc3nc3cc(Cl)ccc23)cc1)N(C)CC#C InChI=1S/C34H44ClN3O/c1-4-22-38(3)26(2)24-27-15-18-29(19-16-27)39-23-12-8-6-5-7-11-21-36-34-30-13-9-10-14-32(30)37-33-25-28(35)17-20-31(33)34/h1,15-20,25-26H,5-14,21-24H2,2-3H3,(H,36,37)/t26-/m1/s1 NXNSSEKZKUPRMX-AREMUKBSSA-N 50430726 CHEMBL2333930 Cholinesterase 18 ChEMBL 10.1016/j.ejmech.2013.01.039 10.7270/Q2C82BN6 23454517 Lu, C; Zhou, Q; Yan, J; Du, Z; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430726 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430726&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71652419 164159601 CHEMBL2333930 ZINC95586535 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056118 C[C@H](Cc1ccc(OCCCCCCNc2c3CCCCc3nc3cc(Cl)ccc23)cc1)N(C)CC#C InChI=1S/C32H40ClN3O/c1-4-20-36(3)24(2)22-25-13-16-27(17-14-25)37-21-10-6-5-9-19-34-32-28-11-7-8-12-30(28)35-31-23-26(33)15-18-29(31)32/h1,13-18,23-24H,5-12,19-22H2,2-3H3,(H,34,35)/t24-/m1/s1 GHBNZZGMFQJJER-XMMPIXPASA-N 50430727 CHEMBL2333929 Cholinesterase 19 ChEMBL 10.1016/j.ejmech.2013.01.039 10.7270/Q2C82BN6 23454517 Lu, C; Zhou, Q; Yan, J; Du, Z; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430727 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430727&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71652418 164159602 CHEMBL2333929 ZINC95587176 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056119 C[C@H](Cc1ccc(OCCCCCNc2c3CCCCc3nc3cc(Cl)ccc23)cc1)N(C)CC#C InChI=1S/C31H38ClN3O/c1-4-19-35(3)23(2)21-24-12-15-26(16-13-24)36-20-9-5-8-18-33-31-27-10-6-7-11-29(27)34-30-22-25(32)14-17-28(30)31/h1,12-17,22-23H,5-11,18-21H2,2-3H3,(H,33,34)/t23-/m1/s1 NABJRKRPLBDFTB-HSZRJFAPSA-N 50430728 CHEMBL2333928 Cholinesterase 19 ChEMBL 10.1016/j.ejmech.2013.01.039 10.7270/Q2C82BN6 23454517 Lu, C; Zhou, Q; Yan, J; Du, Z; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430728 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430728&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71652417 164159603 CHEMBL2333928 ZINC95592836 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056120 C[C@H](Cc1ccc(OCCCNc2c3CCCCc3nc3cc(Cl)ccc23)cc1)N(C)CC#C InChI=1S/C29H34ClN3O/c1-4-17-33(3)21(2)19-22-10-13-24(14-11-22)34-18-7-16-31-29-25-8-5-6-9-27(25)32-28-20-23(30)12-15-26(28)29/h1,10-15,20-21H,5-9,16-19H2,2-3H3,(H,31,32)/t21-/m1/s1 KWHAMKBXTGKPOH-OAQYLSRUSA-N 50430729 CHEMBL2333927 Cholinesterase 66 ChEMBL 10.1016/j.ejmech.2013.01.039 10.7270/Q2C82BN6 23454517 Lu, C; Zhou, Q; Yan, J; Du, Z; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430729 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430729&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71652416 164159604 CHEMBL2333927 ZINC95588533 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056121 C[C@H](Cc1ccc(OCCCCCCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C InChI=1S/C36H49N3O/c1-4-26-39(3)29(2)28-30-21-23-31(24-22-30)40-27-16-10-8-6-5-7-9-15-25-37-36-32-17-11-13-19-34(32)38-35-20-14-12-18-33(35)36/h1,11,13,17,19,21-24,29H,5-10,12,14-16,18,20,25-28H2,2-3H3,(H,37,38)/t29-/m1/s1 WQOUNYVRWYXXHY-GDLZYMKVSA-N 50430730 CHEMBL2333926 Cholinesterase 2.0 ChEMBL 10.1016/j.ejmech.2013.01.039 10.7270/Q2C82BN6 23454517 Lu, C; Zhou, Q; Yan, J; Du, Z; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430730 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430730&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71654585 164159605 CHEMBL2333926 ZINC95590990 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056122 C[C@H](Cc1ccc(OCCCCCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C InChI=1S/C35H47N3O/c1-4-25-38(3)28(2)27-29-20-22-30(23-21-29)39-26-15-9-7-5-6-8-14-24-36-35-31-16-10-12-18-33(31)37-34-19-13-11-17-32(34)35/h1,10,12,16,18,20-23,28H,5-9,11,13-15,17,19,24-27H2,2-3H3,(H,36,37)/t28-/m1/s1 NQGQWZLZLZBCGY-MUUNZHRXSA-N 50430731 CHEMBL2333925 Cholinesterase 9.4 ChEMBL 10.1016/j.ejmech.2013.01.039 10.7270/Q2C82BN6 23454517 Lu, C; Zhou, Q; Yan, J; Du, Z; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430731 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430731&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71654584 164159606 CHEMBL2333925 ZINC95590623 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056123 C[C@H](Cc1ccc(OCCCCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C InChI=1S/C34H45N3O/c1-4-24-37(3)27(2)26-28-19-21-29(22-20-28)38-25-14-8-6-5-7-13-23-35-34-30-15-9-11-17-32(30)36-33-18-12-10-16-31(33)34/h1,9,11,15,17,19-22,27H,5-8,10,12-14,16,18,23-26H2,2-3H3,(H,35,36)/t27-/m1/s1 UHBQVRDIKUXATE-HHHXNRCGSA-N 50430732 CHEMBL2333937 Cholinesterase 36 ChEMBL 10.1016/j.ejmech.2013.01.039 10.7270/Q2C82BN6 23454517 Lu, C; Zhou, Q; Yan, J; Du, Z; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430732 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430732&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71654583 164159607 CHEMBL2333937 ZINC95591245 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056124 C[C@H](Cc1ccc(OCCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C InChI=1S/C32H41N3O/c1-4-22-35(3)25(2)24-26-17-19-27(20-18-26)36-23-12-6-5-11-21-33-32-28-13-7-9-15-30(28)34-31-16-10-8-14-29(31)32/h1,7,9,13,15,17-20,25H,5-6,8,10-12,14,16,21-24H2,2-3H3,(H,33,34)/t25-/m1/s1 JEELLCNUPDNAEM-RUZDIDTESA-N 50430733 CHEMBL2333936 Cholinesterase 16 ChEMBL 10.1016/j.ejmech.2013.01.039 10.7270/Q2C82BN6 23454517 Lu, C; Zhou, Q; Yan, J; Du, Z; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430733 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430733&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71654582 164159608 CHEMBL2333936 ZINC95589975 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056125 C[C@H](Cc1ccc(OCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C InChI=1S/C31H39N3O/c1-4-21-34(3)24(2)23-25-16-18-26(19-17-25)35-22-11-5-10-20-32-31-27-12-6-8-14-29(27)33-30-15-9-7-13-28(30)31/h1,6,8,12,14,16-19,24H,5,7,9-11,13,15,20-23H2,2-3H3,(H,32,33)/t24-/m1/s1 AJYBZZYANZLDFM-XMMPIXPASA-N 50430734 CHEMBL2333935 Cholinesterase 24 ChEMBL 10.1016/j.ejmech.2013.01.039 10.7270/Q2C82BN6 23454517 Lu, C; Zhou, Q; Yan, J; Du, Z; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430734 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430734&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71654581 164159609 CHEMBL2333935 ZINC95590434 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056126 C[C@H](Cc1ccc(OCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C InChI=1S/C30H37N3O/c1-4-20-33(3)23(2)22-24-15-17-25(18-16-24)34-21-10-9-19-31-30-26-11-5-7-13-28(26)32-29-14-8-6-12-27(29)30/h1,5,7,11,13,15-18,23H,6,8-10,12,14,19-22H2,2-3H3,(H,31,32)/t23-/m1/s1 QGMXFCSIUUOMFC-HSZRJFAPSA-N 50430735 CHEMBL2333934 Cholinesterase 40 ChEMBL 10.1016/j.ejmech.2013.01.039 10.7270/Q2C82BN6 23454517 Lu, C; Zhou, Q; Yan, J; Du, Z; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430735 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430735&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71654423 164159610 CHEMBL2333934 ZINC95590966 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056127 C[C@H](Cc1ccc(OCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C InChI=1S/C29H35N3O/c1-4-19-32(3)22(2)21-23-14-16-24(17-15-23)33-20-9-18-30-29-25-10-5-7-12-27(25)31-28-13-8-6-11-26(28)29/h1,5,7,10,12,14-17,22H,6,8-9,11,13,18-21H2,2-3H3,(H,30,31)/t22-/m1/s1 MJKWWKZMIZQQKV-JOCHJYFZSA-N 50430736 CHEMBL2333933 Cholinesterase 41 ChEMBL 10.1016/j.ejmech.2013.01.039 10.7270/Q2C82BN6 23454517 Lu, C; Zhou, Q; Yan, J; Du, Z; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430736 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430736&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71654422 164159611 CHEMBL2333933 ZINC95586612 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056128 C[C@H](Cc1ccc(OCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C InChI=1S/C28H33N3O/c1-4-18-31(3)21(2)20-22-13-15-23(16-14-22)32-19-17-29-28-24-9-5-7-11-26(24)30-27-12-8-6-10-25(27)28/h1,5,7,9,11,13-16,21H,6,8,10,12,17-20H2,2-3H3,(H,29,30)/t21-/m1/s1 NLIQKDYVOZKRKM-OAQYLSRUSA-N 50430737 CHEMBL2333932 Cholinesterase 51 ChEMBL 10.1016/j.ejmech.2013.01.039 10.7270/Q2C82BN6 23454517 Lu, C; Zhou, Q; Yan, J; Du, Z; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430737 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430737&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71654421 164159612 CHEMBL2333932 ZINC95592050 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056189 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 10620 (S)-3-(1-(dimethylamino)ethyl)phenyl ethyl(methyl)carbamate::3-((1S)-1-(Dimethylamino)ethyl)phenyl N-ethyl N-methyl carbamate::3-(1-(dimethylamino)ethyl)phenyl ethyl(methyl)carbamate::3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::CHEMBL636::ENA-713::Ethyl-methyl-carbamic acid 3-((R)-1-dimethylamino-ethyl)-phenyl ester::Ethyl-methyl-carbamic acid 3-((S)-1-dimethylamino-ethyl)-phenyl ester::Ethyl-methyl-carbamic acid 3-(1-dimethylamino-ethyl)-phenyl ester::Exelon::Rivastigmine::Rivastigmine (1)::SDZ-212-713::SDZ-ENA-713 Cholinesterase 19950 ChEMBL 10.1016/j.bmc.2013.01.052 10.7270/Q2V989F2 23462716 Imramovsky, A; Pejchal, V; Stepankova, Š; Vorcakova, K; Jampilek, J; Vanco, J; Simunek, P; Kralovec, K; Bruckova, L; Mandikova, J; Trejtnar, F University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10620 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10620&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46511221 8874 CHEMBL636 DB00989 6602 C11766 ZINC00004413 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056190 CC(C)[C@H](NC(=O)OCC(F)(F)C(F)(F)C(F)(F)F)C(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C19H19F8N3O3S/c1-8(2)13(30-16(32)33-7-17(21,22)18(23,24)19(25,26)27)14(31)28-9(3)15-29-11-5-4-10(20)6-12(11)34-15/h4-6,8-9,13H,7H2,1-3H3,(H,28,31)(H,30,32)/t9-,13+/m1/s1 YJJMOLSEKJHYBL-RNCFNFMXSA-N 50430760 CHEMBL2334728 Cholinesterase 83200 ChEMBL 10.1016/j.bmc.2013.01.052 10.7270/Q2V989F2 23462716 Imramovsky, A; Pejchal, V; Stepankova, Š; Vorcakova, K; Jampilek, J; Vanco, J; Simunek, P; Kralovec, K; Bruckova, L; Mandikova, J; Trejtnar, F University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430760 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430760&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71582958 164159635 CHEMBL2334728 ZINC95590617 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056191 CC(C)[C@H](NC(=O)OCC(F)(F)C(F)F)C(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C18H20F5N3O3S/c1-8(2)13(26-17(28)29-7-18(22,23)16(20)21)14(27)24-9(3)15-25-11-5-4-10(19)6-12(11)30-15/h4-6,8-9,13,16H,7H2,1-3H3,(H,24,27)(H,26,28)/t9-,13+/m1/s1 GUDXQQUKTMNTMV-RNCFNFMXSA-N 50430761 CHEMBL2334727 Cholinesterase 33800 ChEMBL 10.1016/j.bmc.2013.01.052 10.7270/Q2V989F2 23462716 Imramovsky, A; Pejchal, V; Stepankova, Š; Vorcakova, K; Jampilek, J; Vanco, J; Simunek, P; Kralovec, K; Bruckova, L; Mandikova, J; Trejtnar, F University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430761 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430761&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71582957 164159636 CHEMBL2334727 ZINC95588962 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056192 CC(C)[C@H](NC(=O)OCC(F)(F)F)C(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C17H19F4N3O3S/c1-8(2)13(24-16(26)27-7-17(19,20)21)14(25)22-9(3)15-23-11-5-4-10(18)6-12(11)28-15/h4-6,8-9,13H,7H2,1-3H3,(H,22,25)(H,24,26)/t9-,13+/m1/s1 ZRYJYMRLMPZWBS-RNCFNFMXSA-N 50430762 CHEMBL2334726 Cholinesterase 72000 ChEMBL 10.1016/j.bmc.2013.01.052 10.7270/Q2V989F2 23462716 Imramovsky, A; Pejchal, V; Stepankova, Š; Vorcakova, K; Jampilek, J; Vanco, J; Simunek, P; Kralovec, K; Bruckova, L; Mandikova, J; Trejtnar, F University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430762 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430762&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71582956 164159637 CHEMBL2334726 ZINC95591662 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056193 CC(C)[C@H](NC(=O)OCC(Cl)(Cl)Cl)C(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C17H19Cl3FN3O3S/c1-8(2)13(24-16(26)27-7-17(18,19)20)14(25)22-9(3)15-23-11-5-4-10(21)6-12(11)28-15/h4-6,8-9,13H,7H2,1-3H3,(H,22,25)(H,24,26)/t9-,13+/m1/s1 FAIBUIFXFHIPFJ-RNCFNFMXSA-N 50430763 CHEMBL2334725 Cholinesterase 26560 ChEMBL 10.1016/j.bmc.2013.01.052 10.7270/Q2V989F2 23462716 Imramovsky, A; Pejchal, V; Stepankova, Š; Vorcakova, K; Jampilek, J; Vanco, J; Simunek, P; Kralovec, K; Bruckova, L; Mandikova, J; Trejtnar, F University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430763 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430763&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71582955 164159638 CHEMBL2334725 ZINC95591884 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056194 CC(C)[C@H](NC(=O)OCCCl)C(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C17H21ClFN3O3S/c1-9(2)14(22-17(24)25-7-6-18)15(23)20-10(3)16-21-12-5-4-11(19)8-13(12)26-16/h4-5,8-10,14H,6-7H2,1-3H3,(H,20,23)(H,22,24)/t10-,14+/m1/s1 AWJYWKALDBWJAN-YGRLFVJLSA-N 50430764 CHEMBL2334746 Cholinesterase 54200 ChEMBL 10.1016/j.bmc.2013.01.052 10.7270/Q2V989F2 23462716 Imramovsky, A; Pejchal, V; Stepankova, Š; Vorcakova, K; Jampilek, J; Vanco, J; Simunek, P; Kralovec, K; Bruckova, L; Mandikova, J; Trejtnar, F University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430764 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430764&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71584687 164159639 CHEMBL2334746 ZINC95591530 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056195 CC(C)COC(=O)N[C@@H](C(C)C)C(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C19H26FN3O3S/c1-10(2)9-26-19(25)23-16(11(3)4)17(24)21-12(5)18-22-14-7-6-13(20)8-15(14)27-18/h6-8,10-12,16H,9H2,1-5H3,(H,21,24)(H,23,25)/t12-,16+/m1/s1 VFNRHHNWFRULDR-WBMJQRKESA-N 50430765 CHEMBL2334745 Cholinesterase 41100 ChEMBL 10.1016/j.bmc.2013.01.052 10.7270/Q2V989F2 23462716 Imramovsky, A; Pejchal, V; Stepankova, Š; Vorcakova, K; Jampilek, J; Vanco, J; Simunek, P; Kralovec, K; Bruckova, L; Mandikova, J; Trejtnar, F University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430765 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430765&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71584686 164159640 CHEMBL2334745 ZINC95590007 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056196 CCCCOC(=O)N[C@@H](C(C)C)C(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C19H26FN3O3S/c1-5-6-9-26-19(25)23-16(11(2)3)17(24)21-12(4)18-22-14-8-7-13(20)10-15(14)27-18/h7-8,10-12,16H,5-6,9H2,1-4H3,(H,21,24)(H,23,25)/t12-,16+/m1/s1 MEFRFYXPBNKFGY-WBMJQRKESA-N 50430766 CHEMBL2334744 Cholinesterase 62500 ChEMBL 10.1016/j.bmc.2013.01.052 10.7270/Q2V989F2 23462716 Imramovsky, A; Pejchal, V; Stepankova, Š; Vorcakova, K; Jampilek, J; Vanco, J; Simunek, P; Kralovec, K; Bruckova, L; Mandikova, J; Trejtnar, F University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430766 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430766&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71584685 164159641 CHEMBL2334744 ZINC95589027 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056197 CC(C)OC(=O)N[C@@H](C(C)C)C(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15+/m1/s1 USRKFGIXLGKMKU-ABAIWWIYSA-N 50430767 CHEMBL2334743 Cholinesterase 41100 ChEMBL 10.1016/j.bmc.2013.01.052 10.7270/Q2V989F2 23462716 Imramovsky, A; Pejchal, V; Stepankova, Š; Vorcakova, K; Jampilek, J; Vanco, J; Simunek, P; Kralovec, K; Bruckova, L; Mandikova, J; Trejtnar, F University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430767 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430767&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53297381 164159642 CHEMBL2334743 C18415 ZINC43065288 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056198 CCCOC(=O)N[C@@H](C(C)C)C(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C18H24FN3O3S/c1-5-8-25-18(24)22-15(10(2)3)16(23)20-11(4)17-21-13-7-6-12(19)9-14(13)26-17/h6-7,9-11,15H,5,8H2,1-4H3,(H,20,23)(H,22,24)/t11-,15+/m1/s1 BXHIGVVBSFGGHP-ABAIWWIYSA-N 50430768 CHEMBL2334742 Cholinesterase 70450 ChEMBL 10.1016/j.bmc.2013.01.052 10.7270/Q2V989F2 23462716 Imramovsky, A; Pejchal, V; Stepankova, Š; Vorcakova, K; Jampilek, J; Vanco, J; Simunek, P; Kralovec, K; Bruckova, L; Mandikova, J; Trejtnar, F University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430768 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430768&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71584684 164159643 CHEMBL2334742 ZINC95591679 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056199 CCOC(=O)N[C@@H](C(C)C)C(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C17H22FN3O3S/c1-5-24-17(23)21-14(9(2)3)15(22)19-10(4)16-20-12-7-6-11(18)8-13(12)25-16/h6-10,14H,5H2,1-4H3,(H,19,22)(H,21,23)/t10-,14+/m1/s1 OMYIHNIXCBBVJY-YGRLFVJLSA-N 50430769 CHEMBL2334741 Cholinesterase 35600 ChEMBL 10.1016/j.bmc.2013.01.052 10.7270/Q2V989F2 23462716 Imramovsky, A; Pejchal, V; Stepankova, Š; Vorcakova, K; Jampilek, J; Vanco, J; Simunek, P; Kralovec, K; Bruckova, L; Mandikova, J; Trejtnar, F University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430769 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430769&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71584683 164159644 CHEMBL2334741 ZINC95591825 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056200 COC(=O)N[C@@H](C(C)C)C(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C16H20FN3O3S/c1-8(2)13(20-16(22)23-4)14(21)18-9(3)15-19-11-6-5-10(17)7-12(11)24-15/h5-9,13H,1-4H3,(H,18,21)(H,20,22)/t9-,13+/m1/s1 PBLBSGAFSWVLCF-RNCFNFMXSA-N 50430770 CHEMBL2334740 Cholinesterase 32000 ChEMBL 10.1016/j.bmc.2013.01.052 10.7270/Q2V989F2 23462716 Imramovsky, A; Pejchal, V; Stepankova, Š; Vorcakova, K; Jampilek, J; Vanco, J; Simunek, P; Kralovec, K; Bruckova, L; Mandikova, J; Trejtnar, F University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430770 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430770&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71584682 164159645 CHEMBL2334740 ZINC95592009 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056201 CCC[C@H](NC(=O)OCC(F)(F)C(F)(F)C(F)(F)F)C(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C19H19F8N3O3S/c1-3-4-12(30-16(32)33-8-17(21,22)18(23,24)19(25,26)27)14(31)28-9(2)15-29-11-6-5-10(20)7-13(11)34-15/h5-7,9,12H,3-4,8H2,1-2H3,(H,28,31)(H,30,32)/t9-,12+/m1/s1 PYFYZUSHLLMSAX-SKDRFNHKSA-N 50430771 CHEMBL2334739 Cholinesterase 59750 ChEMBL 10.1016/j.bmc.2013.01.052 10.7270/Q2V989F2 23462716 Imramovsky, A; Pejchal, V; Stepankova, Š; Vorcakova, K; Jampilek, J; Vanco, J; Simunek, P; Kralovec, K; Bruckova, L; Mandikova, J; Trejtnar, F University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430771 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430771&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71584569 164159646 CHEMBL2334739 ZINC95587819 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056202 CCC[C@H](NC(=O)OCC(F)(F)C(F)F)C(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C18H20F5N3O3S/c1-3-4-12(26-17(28)29-8-18(22,23)16(20)21)14(27)24-9(2)15-25-11-6-5-10(19)7-13(11)30-15/h5-7,9,12,16H,3-4,8H2,1-2H3,(H,24,27)(H,26,28)/t9-,12+/m1/s1 XTDGCLNNPNBIKC-SKDRFNHKSA-N 50430772 CHEMBL2334738 Cholinesterase 43950 ChEMBL 10.1016/j.bmc.2013.01.052 10.7270/Q2V989F2 23462716 Imramovsky, A; Pejchal, V; Stepankova, Š; Vorcakova, K; Jampilek, J; Vanco, J; Simunek, P; Kralovec, K; Bruckova, L; Mandikova, J; Trejtnar, F University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430772 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430772&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71584568 164159647 CHEMBL2334738 ZINC95586708 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056203 CCC[C@H](NC(=O)OCC(F)(F)F)C(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C17H19F4N3O3S/c1-3-4-12(24-16(26)27-8-17(19,20)21)14(25)22-9(2)15-23-11-6-5-10(18)7-13(11)28-15/h5-7,9,12H,3-4,8H2,1-2H3,(H,22,25)(H,24,26)/t9-,12+/m1/s1 VCACKQYMSULRQF-SKDRFNHKSA-N 50430773 CHEMBL2334737 Cholinesterase 59000 ChEMBL 10.1016/j.bmc.2013.01.052 10.7270/Q2V989F2 23462716 Imramovsky, A; Pejchal, V; Stepankova, Š; Vorcakova, K; Jampilek, J; Vanco, J; Simunek, P; Kralovec, K; Bruckova, L; Mandikova, J; Trejtnar, F University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430773 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430773&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71584567 164159648 CHEMBL2334737 ZINC95591943 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056204 CCC[C@H](NC(=O)OCC(Cl)(Cl)Cl)C(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C17H19Cl3FN3O3S/c1-3-4-12(24-16(26)27-8-17(18,19)20)14(25)22-9(2)15-23-11-6-5-10(21)7-13(11)28-15/h5-7,9,12H,3-4,8H2,1-2H3,(H,22,25)(H,24,26)/t9-,12+/m1/s1 XJCAMXBMINHDOX-SKDRFNHKSA-N 50430774 CHEMBL2334736 Cholinesterase 62690 ChEMBL 10.1016/j.bmc.2013.01.052 10.7270/Q2V989F2 23462716 Imramovsky, A; Pejchal, V; Stepankova, Š; Vorcakova, K; Jampilek, J; Vanco, J; Simunek, P; Kralovec, K; Bruckova, L; Mandikova, J; Trejtnar, F University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430774 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430774&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71584566 164159649 CHEMBL2334736 ZINC95586942 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056205 CCC[C@H](NC(=O)OCCCl)C(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C17H21ClFN3O3S/c1-3-4-13(22-17(24)25-8-7-18)15(23)20-10(2)16-21-12-6-5-11(19)9-14(12)26-16/h5-6,9-10,13H,3-4,7-8H2,1-2H3,(H,20,23)(H,22,24)/t10-,13+/m1/s1 QZRMWUXMDSILAK-MFKMUULPSA-N 50430775 CHEMBL2334735 Cholinesterase 54110 ChEMBL 10.1016/j.bmc.2013.01.052 10.7270/Q2V989F2 23462716 Imramovsky, A; Pejchal, V; Stepankova, Š; Vorcakova, K; Jampilek, J; Vanco, J; Simunek, P; Kralovec, K; Bruckova, L; Mandikova, J; Trejtnar, F University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430775 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430775&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71584565 164159650 CHEMBL2334735 ZINC95591434 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056206 CCC[C@H](NC(=O)OCC(C)C)C(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C19H26FN3O3S/c1-5-6-15(23-19(25)26-10-11(2)3)17(24)21-12(4)18-22-14-8-7-13(20)9-16(14)27-18/h7-9,11-12,15H,5-6,10H2,1-4H3,(H,21,24)(H,23,25)/t12-,15+/m1/s1 FOENSCNFCWRCMI-DOMZBBRYSA-N 50430776 CHEMBL2334734 Cholinesterase 26130 ChEMBL 10.1016/j.bmc.2013.01.052 10.7270/Q2V989F2 23462716 Imramovsky, A; Pejchal, V; Stepankova, Š; Vorcakova, K; Jampilek, J; Vanco, J; Simunek, P; Kralovec, K; Bruckova, L; Mandikova, J; Trejtnar, F University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430776 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430776&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71584564 164159651 CHEMBL2334734 ZINC95587600 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056207 CCCCOC(=O)N[C@@H](CCC)C(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C19H26FN3O3S/c1-4-6-10-26-19(25)23-15(7-5-2)17(24)21-12(3)18-22-14-9-8-13(20)11-16(14)27-18/h8-9,11-12,15H,4-7,10H2,1-3H3,(H,21,24)(H,23,25)/t12-,15+/m1/s1 HDRATRCPKNYCCX-DOMZBBRYSA-N 50430777 CHEMBL2334733 Cholinesterase 19580 ChEMBL 10.1016/j.bmc.2013.01.052 10.7270/Q2V989F2 23462716 Imramovsky, A; Pejchal, V; Stepankova, Š; Vorcakova, K; Jampilek, J; Vanco, J; Simunek, P; Kralovec, K; Bruckova, L; Mandikova, J; Trejtnar, F University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430777 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430777&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71584441 164159652 CHEMBL2334733 ZINC95586409 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056208 CCC[C@H](NC(=O)OC(C)C)C(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C18H24FN3O3S/c1-5-6-14(22-18(24)25-10(2)3)16(23)20-11(4)17-21-13-8-7-12(19)9-15(13)26-17/h7-11,14H,5-6H2,1-4H3,(H,20,23)(H,22,24)/t11-,14+/m1/s1 SXAQXROVJCHIII-RISCZKNCSA-N 50430778 CHEMBL2334732 Cholinesterase 32200 ChEMBL 10.1016/j.bmc.2013.01.052 10.7270/Q2V989F2 23462716 Imramovsky, A; Pejchal, V; Stepankova, Š; Vorcakova, K; Jampilek, J; Vanco, J; Simunek, P; Kralovec, K; Bruckova, L; Mandikova, J; Trejtnar, F University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430778 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430778&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71584440 164159653 CHEMBL2334732 ZINC95591354 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056209 CCCOC(=O)N[C@@H](CCC)C(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C18H24FN3O3S/c1-4-6-14(22-18(24)25-9-5-2)16(23)20-11(3)17-21-13-8-7-12(19)10-15(13)26-17/h7-8,10-11,14H,4-6,9H2,1-3H3,(H,20,23)(H,22,24)/t11-,14+/m1/s1 UBSYYAJQQBGXEF-RISCZKNCSA-N 50430779 CHEMBL2334731 Cholinesterase 19250 ChEMBL 10.1016/j.bmc.2013.01.052 10.7270/Q2V989F2 23462716 Imramovsky, A; Pejchal, V; Stepankova, Š; Vorcakova, K; Jampilek, J; Vanco, J; Simunek, P; Kralovec, K; Bruckova, L; Mandikova, J; Trejtnar, F University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430779 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430779&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71584439 164159654 CHEMBL2334731 ZINC95591275 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056210 CCC[C@H](NC(=O)OCC)C(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C17H22FN3O3S/c1-4-6-13(21-17(23)24-5-2)15(22)19-10(3)16-20-12-8-7-11(18)9-14(12)25-16/h7-10,13H,4-6H2,1-3H3,(H,19,22)(H,21,23)/t10-,13+/m1/s1 RLIQCFVIBUBVIC-MFKMUULPSA-N 50430780 CHEMBL2334730 Cholinesterase 14100 ChEMBL 10.1016/j.bmc.2013.01.052 10.7270/Q2V989F2 23462716 Imramovsky, A; Pejchal, V; Stepankova, Š; Vorcakova, K; Jampilek, J; Vanco, J; Simunek, P; Kralovec, K; Bruckova, L; Mandikova, J; Trejtnar, F University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430780 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430780&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71584438 164159655 CHEMBL2334730 ZINC95588827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056211 CCC[C@H](NC(=O)OC)C(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C16H20FN3O3S/c1-4-5-12(20-16(22)23-3)14(21)18-9(2)15-19-11-7-6-10(17)8-13(11)24-15/h6-9,12H,4-5H2,1-3H3,(H,18,21)(H,20,22)/t9-,12+/m1/s1 YSCYMSMZXRNWTI-SKDRFNHKSA-N 50430781 CHEMBL2334729 Cholinesterase 20420 ChEMBL 10.1016/j.bmc.2013.01.052 10.7270/Q2V989F2 23462716 Imramovsky, A; Pejchal, V; Stepankova, Š; Vorcakova, K; Jampilek, J; Vanco, J; Simunek, P; Kralovec, K; Bruckova, L; Mandikova, J; Trejtnar, F University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430781 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430781&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71583857 164159656 CHEMBL2334729 ZINC95589347 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51056237 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 7960 ChEMBL 10.1016/j.bmc.2013.01.052 10.7270/Q2V989F2 23462716 Imramovsky, A; Pejchal, V; Stepankova, Š; Vorcakova, K; Jampilek, J; Vanco, J; Simunek, P; Kralovec, K; Bruckova, L; Mandikova, J; Trejtnar, F University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077064 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 5380 ChEMBL 10.1016/j.ejmech.2013.07.038 10.7270/Q2C24XT5 23988409 Khoobi, M; Alipour, M; Sakhteman, A; Nadri, H; Moradi, A; Ghandi, M; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077065 Fc1ccc(C[n+]2cccc(c2)C2C(C#N)C(=N)Oc3c2c(=O)oc2ccccc32)cc1 InChI=1S/C25H17FN3O3/c26-17-9-7-15(8-10-17)13-29-11-3-4-16(14-29)21-19(12-27)24(28)32-23-18-5-1-2-6-20(18)31-25(30)22(21)23/h1-11,14,19,21,28H,13H2/q+1 XDAALDZUGIMDRX-UHFFFAOYSA-N 50440426 CHEMBL2425831 Cholinesterase 2170 ChEMBL 10.1016/j.ejmech.2013.07.038 10.7270/Q2C24XT5 23988409 Khoobi, M; Alipour, M; Sakhteman, A; Nadri, H; Moradi, A; Ghandi, M; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440426 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440426&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898785 175452743 CHEMBL2425831 ZINC96284121 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077066 Cc1cccc(C[n+]2cccc(c2)C2C(C#N)C(=N)Oc3c2c(=O)oc2ccccc32)c1 InChI=1S/C26H20N3O3/c1-16-6-4-7-17(12-16)14-29-11-5-8-18(15-29)22-20(13-27)25(28)32-24-19-9-2-3-10-21(19)31-26(30)23(22)24/h2-12,15,20,22,28H,14H2,1H3/q+1 VJXOVFBXIHDTLB-UHFFFAOYSA-N 50440427 CHEMBL2425830 Cholinesterase 14300 ChEMBL 10.1016/j.ejmech.2013.07.038 10.7270/Q2C24XT5 23988409 Khoobi, M; Alipour, M; Sakhteman, A; Nadri, H; Moradi, A; Ghandi, M; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440427 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440427&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898786 175452744 CHEMBL2425830 ZINC96284123 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077067 Clc1cccc(C[n+]2cccc(c2)C2C(C#N)C(=N)Oc3c2c(=O)oc2ccccc32)c1 InChI=1S/C25H17ClN3O3/c26-17-7-3-5-15(11-17)13-29-10-4-6-16(14-29)21-19(12-27)24(28)32-23-18-8-1-2-9-20(18)31-25(30)22(21)23/h1-11,14,19,21,28H,13H2/q+1 JZJGOQKWLKRITH-UHFFFAOYSA-N 50440428 CHEMBL2425829 Cholinesterase 38400 ChEMBL 10.1016/j.ejmech.2013.07.038 10.7270/Q2C24XT5 23988409 Khoobi, M; Alipour, M; Sakhteman, A; Nadri, H; Moradi, A; Ghandi, M; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440428 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440428&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898787 175452745 CHEMBL2425829 ZINC96284125 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077068 Fc1cccc(C[n+]2cccc(c2)C2C(C#N)C(=N)Oc3c2c(=O)oc2ccccc32)c1 InChI=1S/C25H17FN3O3/c26-17-7-3-5-15(11-17)13-29-10-4-6-16(14-29)21-19(12-27)24(28)32-23-18-8-1-2-9-20(18)31-25(30)22(21)23/h1-11,14,19,21,28H,13H2/q+1 ZYCLOIGXBNXPMO-UHFFFAOYSA-N 50440429 CHEMBL2425828 Cholinesterase >50000 ChEMBL 10.1016/j.ejmech.2013.07.038 10.7270/Q2C24XT5 23988409 Khoobi, M; Alipour, M; Sakhteman, A; Nadri, H; Moradi, A; Ghandi, M; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440429 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440429&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898788 175452746 CHEMBL2425828 ZINC96284127 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077069 Clc1ccccc1C[n+]1cccc(c1)C1C(C#N)C(=N)Oc2c1c(=O)oc1ccccc21 InChI=1S/C25H17ClN3O3/c26-19-9-3-1-6-15(19)13-29-11-5-7-16(14-29)21-18(12-27)24(28)32-23-17-8-2-4-10-20(17)31-25(30)22(21)23/h1-11,14,18,21,28H,13H2/q+1 CMHPHYPBBFLEGW-UHFFFAOYSA-N 50440430 CHEMBL2425827 Cholinesterase 11200 ChEMBL 10.1016/j.ejmech.2013.07.038 10.7270/Q2C24XT5 23988409 Khoobi, M; Alipour, M; Sakhteman, A; Nadri, H; Moradi, A; Ghandi, M; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440430 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440430&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898789 175452747 CHEMBL2425827 ZINC96284129 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077070 Fc1ccccc1C[n+]1cccc(c1)C1C(C#N)C(=N)Oc2c1c(=O)oc1ccccc21 InChI=1S/C25H17FN3O3/c26-19-9-3-1-6-15(19)13-29-11-5-7-16(14-29)21-18(12-27)24(28)32-23-17-8-2-4-10-20(17)31-25(30)22(21)23/h1-11,14,18,21,28H,13H2/q+1 BJEYIPYWYHLHKE-UHFFFAOYSA-N 50440431 CHEMBL2425841 Cholinesterase 41000 ChEMBL 10.1016/j.ejmech.2013.07.038 10.7270/Q2C24XT5 23988409 Khoobi, M; Alipour, M; Sakhteman, A; Nadri, H; Moradi, A; Ghandi, M; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440431 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440431&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898790 175452748 CHEMBL2425841 ZINC96284131 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077071 Clc1ccc(C[n+]2ccc(cc2)C2C(C#N)C(=N)Oc3c2c(=O)oc2ccccc32)c(Cl)c1 InChI=1S/C25H16Cl2N3O3/c26-16-6-5-15(19(27)11-16)13-30-9-7-14(8-10-30)21-18(12-28)24(29)33-23-17-3-1-2-4-20(17)32-25(31)22(21)23/h1-11,18,21,29H,13H2/q+1 UDMCKYLSRMUTNW-UHFFFAOYSA-N 50440432 CHEMBL2425840 Cholinesterase 566 ChEMBL 10.1016/j.ejmech.2013.07.038 10.7270/Q2C24XT5 23988409 Khoobi, M; Alipour, M; Sakhteman, A; Nadri, H; Moradi, A; Ghandi, M; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440432 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440432&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898791 175452749 CHEMBL2425840 ZINC96284133 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077072 Clc1ccc(C[n+]2ccc(cc2)C2C(C#N)C(=N)Oc3c2c(=O)oc2ccccc32)cc1Cl InChI=1S/C25H16Cl2N3O3/c26-18-6-5-14(11-19(18)27)13-30-9-7-15(8-10-30)21-17(12-28)24(29)33-23-16-3-1-2-4-20(16)32-25(31)22(21)23/h1-11,17,21,29H,13H2/q+1 LAKUZJWKBAEULF-UHFFFAOYSA-N 50440433 CHEMBL2425839 Cholinesterase 1270 ChEMBL 10.1016/j.ejmech.2013.07.038 10.7270/Q2C24XT5 23988409 Khoobi, M; Alipour, M; Sakhteman, A; Nadri, H; Moradi, A; Ghandi, M; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440433 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440433&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898792 175452750 CHEMBL2425839 ZINC96284135 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077073 Fc1ccc(C[n+]2ccc(cc2)C2C(C#N)C(=N)Oc3c2c(=O)oc2ccccc32)cc1 InChI=1S/C25H17FN3O3/c26-17-7-5-15(6-8-17)14-29-11-9-16(10-12-29)21-19(13-27)24(28)32-23-18-3-1-2-4-20(18)31-25(30)22(21)23/h1-12,19,21,28H,14H2/q+1 LYWIOABBRWDQPW-UHFFFAOYSA-N 50440434 CHEMBL2425838 Cholinesterase 1840 ChEMBL 10.1016/j.ejmech.2013.07.038 10.7270/Q2C24XT5 23988409 Khoobi, M; Alipour, M; Sakhteman, A; Nadri, H; Moradi, A; Ghandi, M; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440434 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440434&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898793 175452751 CHEMBL2425838 ZINC96284137 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077074 Clc1cccc(C[n+]2ccc(cc2)C2C(C#N)C(=N)Oc3c2c(=O)oc2ccccc32)c1 InChI=1S/C25H17ClN3O3/c26-17-5-3-4-15(12-17)14-29-10-8-16(9-11-29)21-19(13-27)24(28)32-23-18-6-1-2-7-20(18)31-25(30)22(21)23/h1-12,19,21,28H,14H2/q+1 XVMYNTQLRSDDIW-UHFFFAOYSA-N 50440435 CHEMBL2425837 Cholinesterase 21800 ChEMBL 10.1016/j.ejmech.2013.07.038 10.7270/Q2C24XT5 23988409 Khoobi, M; Alipour, M; Sakhteman, A; Nadri, H; Moradi, A; Ghandi, M; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440435 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440435&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898794 175452752 CHEMBL2425837 ZINC96284139 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077075 Cc1cccc(C[n+]2ccc(cc2)C2C(C#N)C(=N)Oc3c2c(=O)oc2ccccc32)c1 InChI=1S/C26H20N3O3/c1-16-5-4-6-17(13-16)15-29-11-9-18(10-12-29)22-20(14-27)25(28)32-24-19-7-2-3-8-21(19)31-26(30)23(22)24/h2-13,20,22,28H,15H2,1H3/q+1 DFOOFDVGESGDRB-UHFFFAOYSA-N 50440436 CHEMBL2425836 Cholinesterase 5500 ChEMBL 10.1016/j.ejmech.2013.07.038 10.7270/Q2C24XT5 23988409 Khoobi, M; Alipour, M; Sakhteman, A; Nadri, H; Moradi, A; Ghandi, M; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440436 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440436&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898795 175452753 CHEMBL2425836 ZINC96284141 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077076 Fc1cccc(C[n+]2ccc(cc2)C2C(C#N)C(=N)Oc3c2c(=O)oc2ccccc32)c1 InChI=1S/C25H17FN3O3/c26-17-5-3-4-15(12-17)14-29-10-8-16(9-11-29)21-19(13-27)24(28)32-23-18-6-1-2-7-20(18)31-25(30)22(21)23/h1-12,19,21,28H,14H2/q+1 QGLOYLLBMWQQAJ-UHFFFAOYSA-N 50440437 CHEMBL2425835 Cholinesterase >50000 ChEMBL 10.1016/j.ejmech.2013.07.038 10.7270/Q2C24XT5 23988409 Khoobi, M; Alipour, M; Sakhteman, A; Nadri, H; Moradi, A; Ghandi, M; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440437 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440437&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898796 175452754 CHEMBL2425835 ZINC96284143 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077077 Cc1ccccc1C[n+]1ccc(cc1)C1C(C#N)C(=N)Oc2c1c(=O)oc1ccccc21 InChI=1S/C26H20N3O3/c1-16-6-2-3-7-18(16)15-29-12-10-17(11-13-29)22-20(14-27)25(28)32-24-19-8-4-5-9-21(19)31-26(30)23(22)24/h2-13,20,22,28H,15H2,1H3/q+1 KOAWHYBDBSIYMT-UHFFFAOYSA-N 50440438 CHEMBL2425834 Cholinesterase 17800 ChEMBL 10.1016/j.ejmech.2013.07.038 10.7270/Q2C24XT5 23988409 Khoobi, M; Alipour, M; Sakhteman, A; Nadri, H; Moradi, A; Ghandi, M; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440438 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440438&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898797 175452755 CHEMBL2425834 ZINC96284145 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077078 Clc1ccccc1C[n+]1ccc(cc1)C1C(C#N)C(=N)Oc2c1c(=O)oc1ccccc21 InChI=1S/C25H17ClN3O3/c26-19-7-3-1-5-16(19)14-29-11-9-15(10-12-29)21-18(13-27)24(28)32-23-17-6-2-4-8-20(17)31-25(30)22(21)23/h1-12,18,21,28H,14H2/q+1 JZDOBSJYAAFDPO-UHFFFAOYSA-N 50440439 CHEMBL2425833 Cholinesterase 4800 ChEMBL 10.1016/j.ejmech.2013.07.038 10.7270/Q2C24XT5 23988409 Khoobi, M; Alipour, M; Sakhteman, A; Nadri, H; Moradi, A; Ghandi, M; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440439 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440439&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898798 175452756 CHEMBL2425833 ZINC96284147 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077079 Fc1ccccc1C[n+]1ccc(cc1)C1C(C#N)C(=N)Oc2c1c(=O)oc1ccccc21 InChI=1S/C25H17FN3O3/c26-19-7-3-1-5-16(19)14-29-11-9-15(10-12-29)21-18(13-27)24(28)32-23-17-6-2-4-8-20(17)31-25(30)22(21)23/h1-12,18,21,28H,14H2/q+1 JRFJJVMFXCSXFE-UHFFFAOYSA-N 50440440 CHEMBL2425832 Cholinesterase 36000 ChEMBL 10.1016/j.ejmech.2013.07.038 10.7270/Q2C24XT5 23988409 Khoobi, M; Alipour, M; Sakhteman, A; Nadri, H; Moradi, A; Ghandi, M; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440440 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440440&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898799 175452757 CHEMBL2425832 ZINC96284149 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077097 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 32 ChEMBL 10.1016/j.ejmech.2013.07.045 10.7270/Q2794637 23988412 Khoobi, M; Alipour, M; Moradi, A; Sakhteman, A; Nadri, H; Razavi, SF; Ghandi, M; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077098 Nc1c2CCCCc2nc2Oc3c(C(c4cccs4)c12)c(=O)oc1ccccc31 InChI=1S/C23H18N2O3S/c24-20-12-6-1-3-8-14(12)25-22-18(20)17(16-10-5-11-29-16)19-21(28-22)13-7-2-4-9-15(13)27-23(19)26/h2,4-5,7,9-11,17H,1,3,6,8H2,(H2,24,25) PRYUGIMEVRSVAV-UHFFFAOYSA-N 50440442 CHEMBL2425858 Cholinesterase 6700 ChEMBL 10.1016/j.ejmech.2013.07.045 10.7270/Q2794637 23988412 Khoobi, M; Alipour, M; Moradi, A; Sakhteman, A; Nadri, H; Razavi, SF; Ghandi, M; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440442 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440442&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72708213 175452759 CHEMBL2425858 ZINC96284153 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077099 Nc1c2CCCCc2nc2Oc3c(C(c4ccncc4)c12)c(=O)oc1ccccc31 InChI=1S/C24H19N3O3/c25-21-14-5-1-3-7-16(14)27-23-19(21)18(13-9-11-26-12-10-13)20-22(30-23)15-6-2-4-8-17(15)29-24(20)28/h2,4,6,8-12,18H,1,3,5,7H2,(H2,25,27) JTSNOIBVMLQPFN-UHFFFAOYSA-N 50440443 CHEMBL2425857 Cholinesterase >30000 ChEMBL 10.1016/j.ejmech.2013.07.045 10.7270/Q2794637 23988412 Khoobi, M; Alipour, M; Moradi, A; Sakhteman, A; Nadri, H; Razavi, SF; Ghandi, M; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440443 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440443&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72708212 175452760 CHEMBL2425857 ZINC96284155 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077100 Nc1c2CCCCc2nc2Oc3c(C(c4ccc5OCOc5c4)c12)c(=O)oc1ccccc31 InChI=1S/C26H20N2O5/c27-23-14-5-1-3-7-16(14)28-25-21(23)20(13-9-10-18-19(11-13)31-12-30-18)22-24(33-25)15-6-2-4-8-17(15)32-26(22)29/h2,4,6,8-11,20H,1,3,5,7,12H2,(H2,27,28) YXYRFCNQLNNOST-UHFFFAOYSA-N 50440444 CHEMBL2425856 Cholinesterase 570 ChEMBL 10.1016/j.ejmech.2013.07.045 10.7270/Q2794637 23988412 Khoobi, M; Alipour, M; Moradi, A; Sakhteman, A; Nadri, H; Razavi, SF; Ghandi, M; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440444 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440444&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72708211 175452761 CHEMBL2425856 ZINC96284157 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077101 COc1cc(cc(OC)c1OC)C1c2c(N)c3CCCCc3nc2Oc2c1c(=O)oc1ccccc21 InChI=1S/C28H26N2O6/c1-32-19-12-14(13-20(33-2)26(19)34-3)21-22-24(29)15-8-4-6-10-17(15)30-27(22)36-25-16-9-5-7-11-18(16)35-28(31)23(21)25/h5,7,9,11-13,21H,4,6,8,10H2,1-3H3,(H2,29,30) ZUQNTNSEANZUTB-UHFFFAOYSA-N 50440445 CHEMBL2425855 Cholinesterase 3260 ChEMBL 10.1016/j.ejmech.2013.07.045 10.7270/Q2794637 23988412 Khoobi, M; Alipour, M; Moradi, A; Sakhteman, A; Nadri, H; Razavi, SF; Ghandi, M; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440445 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440445&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72708142 175452762 CHEMBL2425855 ZINC96284159 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077102 COc1ccc(cc1OC)C1c2c(N)c3CCCCc3nc2Oc2c1c(=O)oc1ccccc21 InChI=1S/C27H24N2O5/c1-31-19-12-11-14(13-20(19)32-2)21-22-24(28)15-7-3-5-9-17(15)29-26(22)34-25-16-8-4-6-10-18(16)33-27(30)23(21)25/h4,6,8,10-13,21H,3,5,7,9H2,1-2H3,(H2,28,29) VDZUTMLPMJJFJD-UHFFFAOYSA-N 50440446 CHEMBL2425854 Cholinesterase 2100 ChEMBL 10.1016/j.ejmech.2013.07.045 10.7270/Q2794637 23988412 Khoobi, M; Alipour, M; Moradi, A; Sakhteman, A; Nadri, H; Razavi, SF; Ghandi, M; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440446 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440446&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72708141 175452763 CHEMBL2425854 ZINC96284161 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077103 COc1ccc(cc1)C1c2c(N)c3CCCCc3nc2Oc2c1c(=O)oc1ccccc21 InChI=1S/C26H22N2O4/c1-30-15-12-10-14(11-13-15)20-21-23(27)16-6-2-4-8-18(16)28-25(21)32-24-17-7-3-5-9-19(17)31-26(29)22(20)24/h3,5,7,9-13,20H,2,4,6,8H2,1H3,(H2,27,28) RTUITKWAKPZDLQ-UHFFFAOYSA-N 50440447 CHEMBL2425853 Cholinesterase 840 ChEMBL 10.1016/j.ejmech.2013.07.045 10.7270/Q2794637 23988412 Khoobi, M; Alipour, M; Moradi, A; Sakhteman, A; Nadri, H; Razavi, SF; Ghandi, M; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440447 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440447&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72708140 175452764 CHEMBL2425853 ZINC96284163 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077104 Cc1ccc(cc1)C1c2c(Oc3c1c(=O)oc1ccccc31)nc1CCCCc1c2N InChI=1S/C26H22N2O3/c1-14-10-12-15(13-11-14)20-21-23(27)16-6-2-4-8-18(16)28-25(21)31-24-17-7-3-5-9-19(17)30-26(29)22(20)24/h3,5,7,9-13,20H,2,4,6,8H2,1H3,(H2,27,28) WDXBVMSYHHZRAR-UHFFFAOYSA-N 50440448 CHEMBL2425852 Cholinesterase >30000 ChEMBL 10.1016/j.ejmech.2013.07.045 10.7270/Q2794637 23988412 Khoobi, M; Alipour, M; Moradi, A; Sakhteman, A; Nadri, H; Razavi, SF; Ghandi, M; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440448 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440448&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72708139 175452765 CHEMBL2425852 ZINC96284165 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077105 Nc1c2CCCCc2nc2Oc3c(C(c4cccc(c4)[N+]([O-])=O)c12)c(=O)oc1ccccc31 InChI=1S/C25H19N3O5/c26-22-15-8-1-3-10-17(15)27-24-20(22)19(13-6-5-7-14(12-13)28(30)31)21-23(33-24)16-9-2-4-11-18(16)32-25(21)29/h2,4-7,9,11-12,19H,1,3,8,10H2,(H2,26,27) JBAXSCCUCJLJCH-UHFFFAOYSA-N 50440449 CHEMBL2425851 Cholinesterase 18300 ChEMBL 10.1016/j.ejmech.2013.07.045 10.7270/Q2794637 23988412 Khoobi, M; Alipour, M; Moradi, A; Sakhteman, A; Nadri, H; Razavi, SF; Ghandi, M; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440449 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440449&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72708138 175452766 CHEMBL2425851 ZINC96284167 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077106 Nc1c2CCCCc2nc2Oc3c(C(c4ccc(Cl)cc4Cl)c12)c(=O)oc1ccccc31 InChI=1S/C25H18Cl2N2O3/c26-12-9-10-13(16(27)11-12)19-20-22(28)14-5-1-3-7-17(14)29-24(20)32-23-15-6-2-4-8-18(15)31-25(30)21(19)23/h2,4,6,8-11,19H,1,3,5,7H2,(H2,28,29) ITQOMDDZMBJVCP-UHFFFAOYSA-N 50440450 CHEMBL2425850 Cholinesterase >30000 ChEMBL 10.1016/j.ejmech.2013.07.045 10.7270/Q2794637 23988412 Khoobi, M; Alipour, M; Moradi, A; Sakhteman, A; Nadri, H; Razavi, SF; Ghandi, M; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440450 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440450&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72708137 175452767 CHEMBL2425850 ZINC96284169 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077107 Nc1c2CCCCc2nc2Oc3c(C(c4ccc(Cl)cc4)c12)c(=O)oc1ccccc31 InChI=1S/C25H19ClN2O3/c26-14-11-9-13(10-12-14)19-20-22(27)15-5-1-3-7-17(15)28-24(20)31-23-16-6-2-4-8-18(16)30-25(29)21(19)23/h2,4,6,8-12,19H,1,3,5,7H2,(H2,27,28) RHARXOISERKWSN-UHFFFAOYSA-N 50440451 CHEMBL2425849 Cholinesterase >30000 ChEMBL 10.1016/j.ejmech.2013.07.045 10.7270/Q2794637 23988412 Khoobi, M; Alipour, M; Moradi, A; Sakhteman, A; Nadri, H; Razavi, SF; Ghandi, M; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440451 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440451&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72708071 175452768 CHEMBL2425849 ZINC96284171 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077108 Nc1c2CCCCc2nc2Oc3c(C(c4cccc(Cl)c4)c12)c(=O)oc1ccccc31 InChI=1S/C25H19ClN2O3/c26-14-7-5-6-13(12-14)19-20-22(27)15-8-1-3-10-17(15)28-24(20)31-23-16-9-2-4-11-18(16)30-25(29)21(19)23/h2,4-7,9,11-12,19H,1,3,8,10H2,(H2,27,28) KIPNZDMWXFZOHX-UHFFFAOYSA-N 50440452 CHEMBL2425848 Cholinesterase >30000 ChEMBL 10.1016/j.ejmech.2013.07.045 10.7270/Q2794637 23988412 Khoobi, M; Alipour, M; Moradi, A; Sakhteman, A; Nadri, H; Razavi, SF; Ghandi, M; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440452 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440452&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72708070 175452769 CHEMBL2425848 ZINC96284173 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077109 Nc1c2CCCCc2nc2Oc3c(C(c4ccccc4Cl)c12)c(=O)oc1ccccc31 InChI=1S/C25H19ClN2O3/c26-16-10-4-1-7-13(16)19-20-22(27)14-8-2-5-11-17(14)28-24(20)31-23-15-9-3-6-12-18(15)30-25(29)21(19)23/h1,3-4,6-7,9-10,12,19H,2,5,8,11H2,(H2,27,28) GGYOBJKJCOTCNG-UHFFFAOYSA-N 50440453 CHEMBL2425847 Cholinesterase 4900 ChEMBL 10.1016/j.ejmech.2013.07.045 10.7270/Q2794637 23988412 Khoobi, M; Alipour, M; Moradi, A; Sakhteman, A; Nadri, H; Razavi, SF; Ghandi, M; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440453 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440453&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72708069 175452770 CHEMBL2425847 ZINC96284175 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077110 Nc1c2CCCCc2nc2Oc3c(C(c4ccc(F)cc4)c12)c(=O)oc1ccccc31 InChI=1S/C25H19FN2O3/c26-14-11-9-13(10-12-14)19-20-22(27)15-5-1-3-7-17(15)28-24(20)31-23-16-6-2-4-8-18(16)30-25(29)21(19)23/h2,4,6,8-12,19H,1,3,5,7H2,(H2,27,28) DHAXWBWQDZCBTC-UHFFFAOYSA-N 50440441 CHEMBL2425846 Cholinesterase 15700 ChEMBL 10.1016/j.ejmech.2013.07.045 10.7270/Q2794637 23988412 Khoobi, M; Alipour, M; Moradi, A; Sakhteman, A; Nadri, H; Razavi, SF; Ghandi, M; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440441 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440441&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72708068 175452758 CHEMBL2425846 ZINC96284151 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077111 Nc1c2CCCCc2nc2Oc3c(C(c4cccc(F)c4)c12)c(=O)oc1ccccc31 InChI=1S/C25H19FN2O3/c26-14-7-5-6-13(12-14)19-20-22(27)15-8-1-3-10-17(15)28-24(20)31-23-16-9-2-4-11-18(16)30-25(29)21(19)23/h2,4-7,9,11-12,19H,1,3,8,10H2,(H2,27,28) JSMOJRVVJOBNCY-UHFFFAOYSA-N 50440454 CHEMBL2425845 Cholinesterase 890 ChEMBL 10.1016/j.ejmech.2013.07.045 10.7270/Q2794637 23988412 Khoobi, M; Alipour, M; Moradi, A; Sakhteman, A; Nadri, H; Razavi, SF; Ghandi, M; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440454 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440454&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72708067 175452771 CHEMBL2425845 ZINC96284177 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077112 Nc1c2CCCCc2nc2Oc3c(C(c4ccccc4)c12)c(=O)oc1ccccc31 InChI=1S/C25H20N2O3/c26-22-15-10-4-6-12-17(15)27-24-20(22)19(14-8-2-1-3-9-14)21-23(30-24)16-11-5-7-13-18(16)29-25(21)28/h1-3,5,7-9,11,13,19H,4,6,10,12H2,(H2,26,27) GMUOLTAXOQFSCB-UHFFFAOYSA-N 50440455 CHEMBL2425844 Cholinesterase 1700 ChEMBL 10.1016/j.ejmech.2013.07.045 10.7270/Q2794637 23988412 Khoobi, M; Alipour, M; Moradi, A; Sakhteman, A; Nadri, H; Razavi, SF; Ghandi, M; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440455 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440455&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72708066 175452772 CHEMBL2425844 ZINC96284179 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077113 CCCCC1c2c(N)c3CCCCc3nc2Oc2c1c(=O)oc1ccccc21 InChI=1S/C23H24N2O3/c1-2-3-8-15-18-20(24)13-9-4-6-11-16(13)25-22(18)28-21-14-10-5-7-12-17(14)27-23(26)19(15)21/h5,7,10,12,15H,2-4,6,8-9,11H2,1H3,(H2,24,25) XSENQSLYGBWOAD-UHFFFAOYSA-N 50440456 CHEMBL2425843 Cholinesterase 23000 ChEMBL 10.1016/j.ejmech.2013.07.045 10.7270/Q2794637 23988412 Khoobi, M; Alipour, M; Moradi, A; Sakhteman, A; Nadri, H; Razavi, SF; Ghandi, M; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440456 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440456&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72708003 175452773 CHEMBL2425843 ZINC96284181 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077114 CCC1c2c(N)c3CCCCc3nc2Oc2c1c(=O)oc1ccccc21 InChI=1S/C21H20N2O3/c1-2-11-16-18(22)12-7-3-5-9-14(12)23-20(16)26-19-13-8-4-6-10-15(13)25-21(24)17(11)19/h4,6,8,10-11H,2-3,5,7,9H2,1H3,(H2,22,23) RITQLPXGOBXXJX-UHFFFAOYSA-N 50440457 CHEMBL2425842 Cholinesterase 5600 ChEMBL 10.1016/j.ejmech.2013.07.045 10.7270/Q2794637 23988412 Khoobi, M; Alipour, M; Moradi, A; Sakhteman, A; Nadri, H; Razavi, SF; Ghandi, M; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440457 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440457&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72708002 175452774 CHEMBL2425842 ZINC96284183 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51077115 CC1c2c(Oc3c1c(=O)oc1ccccc31)nc1CCCCc1c2N InChI=1S/C20H18N2O3/c1-10-15-17(21)11-6-2-4-8-13(11)22-19(15)25-18-12-7-3-5-9-14(12)24-20(23)16(10)18/h3,5,7,9-10H,2,4,6,8H2,1H3,(H2,21,22) ZCIBDHUJBTVCMZ-UHFFFAOYSA-N 50440458 CHEMBL2425859 Cholinesterase 1220 ChEMBL 10.1016/j.ejmech.2013.07.045 10.7270/Q2794637 23988412 Khoobi, M; Alipour, M; Moradi, A; Sakhteman, A; Nadri, H; Razavi, SF; Ghandi, M; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50440458 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50440458&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72708001 175452775 CHEMBL2425859 ZINC96284185 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50859305 CN(CCCCCCN1C(=O)c2ccccc2C1=O)Cc1ccccc1 InChI=1S/C22H26N2O2/c1-23(17-18-11-5-4-6-12-18)15-9-2-3-10-16-24-21(25)19-13-7-8-14-20(19)22(24)26/h4-8,11-14H,2-3,9-10,15-17H2,1H3 NRAFVOCZEXVTPY-UHFFFAOYSA-N 50262775 CHEMBL3547058 Cholinesterase 17900 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262775 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262775&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729284 404341280 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50859322 COc1ccccc1CN(C)CCCN1C(=O)c2ccccc2C1=O InChI=1S/C20H22N2O3/c1-21(14-15-8-3-6-11-18(15)25-2)12-7-13-22-19(23)16-9-4-5-10-17(16)20(22)24/h3-6,8-11H,7,12-14H2,1-2H3 SEOXRGYGGLGOET-UHFFFAOYSA-N 50262857 CHEMBL4091015 Cholinesterase 3700 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262857 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262857&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 51223711 404341301 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51031490 OC1CCCN(Cc2ccc(cc2)C(=O)N\N=C\c2ccc(Cl)cc2)C1 InChI=1S/C20H22ClN3O2/c21-18-9-5-15(6-10-18)12-22-23-20(26)17-7-3-16(4-8-17)13-24-11-1-2-19(25)14-24/h3-10,12,19,25H,1-2,11,13-14H2,(H,23,26)/b22-12+ CTMODUMJWIENCS-WSDLNYQXSA-N 50292419 CHEMBL4163724 Cholinesterase 48220 ChEMBL 10.1016/j.ejmech.2018.01.066 10.7270/Q2K64MM0 29421570 Dias Viegas, FP; de Freitas Silva, M; Divino da Rocha, M; Castelli, MR; Riquiel, MM; Machado, RP; Vaz, SM; Simões de Lima, LM; Mancini, KC; Marques de Oliveira, PC; Morais, ÉP; Gontijo, VS; da Silva, FMR; D'Alincourt da Fonseca Peçanha, D; Castro, NG; Neves, GA; Giusti-Paiva, A; Vilela, FC; Orlandi, L; Camps, I; Veloso, MP; Leomil Coelho, LF; Ionta, M; Ferreira-Silva, GÁ; Pereira, RM; Dardenne, LE; Guedes, IA; de Oliveira Carneiro Junior, W; Quaglio Bellozi, PM; Pinheiro de Oliveira, AC; Ferreira, FF; Pruccoli, L; Tarozzi, A; Viegas, C Federal University of Alfenas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50292419 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50292419&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44559722 104133970 ZINC70622174 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51031491 OC1CCCN(Cc2ccc(cc2)C(=O)N\N=C\c2ccc(cc2)[N+]([O-])=O)C1 InChI=1S/C20H22N4O4/c25-19-2-1-11-23(14-19)13-16-3-7-17(8-4-16)20(26)22-21-12-15-5-9-18(10-6-15)24(27)28/h3-10,12,19,25H,1-2,11,13-14H2,(H,22,26)/b21-12+ SQLVYKIAHHIDJF-CIAFOILYSA-N 50292422 CHEMBL4175724 Cholinesterase 33860 ChEMBL 10.1016/j.ejmech.2018.01.066 10.7270/Q2K64MM0 29421570 Dias Viegas, FP; de Freitas Silva, M; Divino da Rocha, M; Castelli, MR; Riquiel, MM; Machado, RP; Vaz, SM; Simões de Lima, LM; Mancini, KC; Marques de Oliveira, PC; Morais, ÉP; Gontijo, VS; da Silva, FMR; D'Alincourt da Fonseca Peçanha, D; Castro, NG; Neves, GA; Giusti-Paiva, A; Vilela, FC; Orlandi, L; Camps, I; Veloso, MP; Leomil Coelho, LF; Ionta, M; Ferreira-Silva, GÁ; Pereira, RM; Dardenne, LE; Guedes, IA; de Oliveira Carneiro Junior, W; Quaglio Bellozi, PM; Pinheiro de Oliveira, AC; Ferreira, FF; Pruccoli, L; Tarozzi, A; Viegas, C Federal University of Alfenas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50292422 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50292422&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44559729 104133973 ZINC40934741 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51031493 COc1ccc(\C=N\NC(=O)c2ccc(CN3CCCC(O)C3)cc2)cc1 InChI=1S/C21H25N3O3/c1-27-20-10-6-16(7-11-20)13-22-23-21(26)18-8-4-17(5-9-18)14-24-12-2-3-19(25)15-24/h4-11,13,19,25H,2-3,12,14-15H2,1H3,(H,23,26)/b22-13+ XYXXAWXVRBTRBD-LPYMAVHISA-N 50292423 CHEMBL4167867 Cholinesterase 91850 ChEMBL 10.1016/j.ejmech.2018.01.066 10.7270/Q2K64MM0 29421570 Dias Viegas, FP; de Freitas Silva, M; Divino da Rocha, M; Castelli, MR; Riquiel, MM; Machado, RP; Vaz, SM; Simões de Lima, LM; Mancini, KC; Marques de Oliveira, PC; Morais, ÉP; Gontijo, VS; da Silva, FMR; D'Alincourt da Fonseca Peçanha, D; Castro, NG; Neves, GA; Giusti-Paiva, A; Vilela, FC; Orlandi, L; Camps, I; Veloso, MP; Leomil Coelho, LF; Ionta, M; Ferreira-Silva, GÁ; Pereira, RM; Dardenne, LE; Guedes, IA; de Oliveira Carneiro Junior, W; Quaglio Bellozi, PM; Pinheiro de Oliveira, AC; Ferreira, FF; Pruccoli, L; Tarozzi, A; Viegas, C Federal University of Alfenas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50292423 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50292423&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44559728 104133974 ZINC40934734 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51031494 OC1CCCN(Cc2ccc(cc2)C(=O)N\N=C\c2ccc(F)cc2)C1 InChI=1S/C20H22FN3O2/c21-18-9-5-15(6-10-18)12-22-23-20(26)17-7-3-16(4-8-17)13-24-11-1-2-19(25)14-24/h3-10,12,19,25H,1-2,11,13-14H2,(H,23,26)/b22-12+ CIBYXFRJRYQLIC-WSDLNYQXSA-N 50292442 CHEMBL4171226 Cholinesterase 39040 ChEMBL 10.1016/j.ejmech.2018.01.066 10.7270/Q2K64MM0 29421570 Dias Viegas, FP; de Freitas Silva, M; Divino da Rocha, M; Castelli, MR; Riquiel, MM; Machado, RP; Vaz, SM; Simões de Lima, LM; Mancini, KC; Marques de Oliveira, PC; Morais, ÉP; Gontijo, VS; da Silva, FMR; D'Alincourt da Fonseca Peçanha, D; Castro, NG; Neves, GA; Giusti-Paiva, A; Vilela, FC; Orlandi, L; Camps, I; Veloso, MP; Leomil Coelho, LF; Ionta, M; Ferreira-Silva, GÁ; Pereira, RM; Dardenne, LE; Guedes, IA; de Oliveira Carneiro Junior, W; Quaglio Bellozi, PM; Pinheiro de Oliveira, AC; Ferreira, FF; Pruccoli, L; Tarozzi, A; Viegas, C Federal University of Alfenas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50292442 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50292442&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44584162 104133993 ZINC49850660 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51031496 OC1CCCN(Cc2ccc(cc2)C(=O)N\N=C\c2ccc(cc2)-n2ccnc2)C1 InChI=1S/C23H25N5O2/c29-22-2-1-12-27(16-22)15-19-3-7-20(8-4-19)23(30)26-25-14-18-5-9-21(10-6-18)28-13-11-24-17-28/h3-11,13-14,17,22,29H,1-2,12,15-16H2,(H,26,30)/b25-14+ FWZDXKJQVHZWPV-AFUMVMLFSA-N 50292526 CHEMBL4164436 Cholinesterase 39620 ChEMBL 10.1016/j.ejmech.2018.01.066 10.7270/Q2K64MM0 29421570 Dias Viegas, FP; de Freitas Silva, M; Divino da Rocha, M; Castelli, MR; Riquiel, MM; Machado, RP; Vaz, SM; Simões de Lima, LM; Mancini, KC; Marques de Oliveira, PC; Morais, ÉP; Gontijo, VS; da Silva, FMR; D'Alincourt da Fonseca Peçanha, D; Castro, NG; Neves, GA; Giusti-Paiva, A; Vilela, FC; Orlandi, L; Camps, I; Veloso, MP; Leomil Coelho, LF; Ionta, M; Ferreira-Silva, GÁ; Pereira, RM; Dardenne, LE; Guedes, IA; de Oliveira Carneiro Junior, W; Quaglio Bellozi, PM; Pinheiro de Oliveira, AC; Ferreira, FF; Pruccoli, L; Tarozzi, A; Viegas, C Federal University of Alfenas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50292526 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50292526&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 6610277 104134077 ZINC00057526 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51031495 OC1CCCN(Cc2ccc(cc2)C(=O)N\N=C\c2ccc(cc2)N2CCCCC2)C1 InChI=1S/C25H32N4O2/c30-24-5-4-14-28(19-24)18-21-6-10-22(11-7-21)25(31)27-26-17-20-8-12-23(13-9-20)29-15-2-1-3-16-29/h6-13,17,24,30H,1-5,14-16,18-19H2,(H,27,31)/b26-17+ YFNXMXTXMLFSAL-YZSQISJMSA-N 50292510 CHEMBL4172314 Cholinesterase 58140 ChEMBL 10.1016/j.ejmech.2018.01.066 10.7270/Q2K64MM0 29421570 Dias Viegas, FP; de Freitas Silva, M; Divino da Rocha, M; Castelli, MR; Riquiel, MM; Machado, RP; Vaz, SM; Simões de Lima, LM; Mancini, KC; Marques de Oliveira, PC; Morais, ÉP; Gontijo, VS; da Silva, FMR; D'Alincourt da Fonseca Peçanha, D; Castro, NG; Neves, GA; Giusti-Paiva, A; Vilela, FC; Orlandi, L; Camps, I; Veloso, MP; Leomil Coelho, LF; Ionta, M; Ferreira-Silva, GÁ; Pereira, RM; Dardenne, LE; Guedes, IA; de Oliveira Carneiro Junior, W; Quaglio Bellozi, PM; Pinheiro de Oliveira, AC; Ferreira, FF; Pruccoli, L; Tarozzi, A; Viegas, C Federal University of Alfenas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50292510 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50292510&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 15598732 104134061 ZINC40939474 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50517941 O[C@H]1C=C2CCN3Cc4cc5OCOc5cc4[C@@H]([C@@H]23)[C@@H]1O InChI=1S/C16H17NO4/c18-11-3-8-1-2-17-6-9-4-12-13(21-7-20-12)5-10(9)14(15(8)17)16(11)19/h3-5,11,14-16,18-19H,1-2,6-7H2/t11-,14-,15+,16+/m0/s1 XGVJWXAYKUHDOO-DANNLKNASA-N 50221066 (-)-lycorine::9,10-(methylenedioxy)-3,12-didehydrogalanthan-1alpha,2beta-diol::Amarylline::CHEMBL400092::Galanthidine::Licorine::Lycorine::Narcissine Cholinesterase >200000 ChEMBL 10.1021/acs.jnatprod.5b00785 10.7270/Q2WM1GBJ 27096334 Ortiz, JE; Pigni, NB; Andujar, SA; Roitman, G; Suvire, FD; Enriz, RD; Tapia, A; Bastida, J; Feresin, GE Universidad Nacional de San Juan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50221066 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50221066&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3KD 4U4U 72378 104093755 6601 CHEMBL400092 C08532 ZINC03881372 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50517943 O[C@H]1C[C@@H]2N3C[C@H](C2=C[C@@H]1O)c1cc2OCOc2cc1C3 InChI=1S/C16H17NO4/c18-13-2-10-11-6-17(12(10)4-14(13)19)5-8-1-15-16(3-9(8)11)21-7-20-15/h1-3,11-14,18-19H,4-7H2/t11-,12-,13-,14-/m0/s1 JKZMYBLUKAMPKM-XUXIUFHCSA-N 50190647 CHEMBL3978970 Cholinesterase >200000 ChEMBL 10.1021/acs.jnatprod.5b00785 10.7270/Q2WM1GBJ 27096334 Ortiz, JE; Pigni, NB; Andujar, SA; Roitman, G; Suvire, FD; Enriz, RD; Tapia, A; Bastida, J; Feresin, GE Universidad Nacional de San Juan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50190647 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50190647&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 443688 375075562 CHEMBL3978970 C12186 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50517944 O[C@H]1CN2Cc3cc4CCCc4cc3[C@]11C=C[C@H](O)C[C@H]21 InChI=1S/C18H21NO2/c20-14-4-5-18-15-7-12-3-1-2-11(12)6-13(15)9-19(10-17(18)21)16(18)8-14/h4-7,14,16-17,20-21H,1-3,8-10H2/t14-,16-,17-,18-/m0/s1 IOTTUNXDZBJQGD-DKIMLUQUSA-N 50190648 CHEMBL3889595 Cholinesterase >200000 ChEMBL 10.1021/acs.jnatprod.5b00785 10.7270/Q2WM1GBJ 27096334 Ortiz, JE; Pigni, NB; Andujar, SA; Roitman, G; Suvire, FD; Enriz, RD; Tapia, A; Bastida, J; Feresin, GE Universidad Nacional de San Juan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50190648 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50190648&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134131229 375075563 CHEMBL3889595 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51031497 CSc1ccc(\C=N\NC(=O)c2ccc(CN3CCCC(O)C3)cc2)cc1 InChI=1S/C21H25N3O2S/c1-27-20-10-6-16(7-11-20)13-22-23-21(26)18-8-4-17(5-9-18)14-24-12-2-3-19(25)15-24/h4-11,13,19,25H,2-3,12,14-15H2,1H3,(H,23,26)/b22-13+ GKNNEWHUNQFSME-LPYMAVHISA-N 50292536 CHEMBL4170841 Cholinesterase 59300 ChEMBL 10.1016/j.ejmech.2018.01.066 10.7270/Q2K64MM0 29421570 Dias Viegas, FP; de Freitas Silva, M; Divino da Rocha, M; Castelli, MR; Riquiel, MM; Machado, RP; Vaz, SM; Simões de Lima, LM; Mancini, KC; Marques de Oliveira, PC; Morais, ÉP; Gontijo, VS; da Silva, FMR; D'Alincourt da Fonseca Peçanha, D; Castro, NG; Neves, GA; Giusti-Paiva, A; Vilela, FC; Orlandi, L; Camps, I; Veloso, MP; Leomil Coelho, LF; Ionta, M; Ferreira-Silva, GÁ; Pereira, RM; Dardenne, LE; Guedes, IA; de Oliveira Carneiro Junior, W; Quaglio Bellozi, PM; Pinheiro de Oliveira, AC; Ferreira, FF; Pruccoli, L; Tarozzi, A; Viegas, C Federal University of Alfenas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50292536 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50292536&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44559826 104134087 ZINC40422816 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51031498 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 4690 ChEMBL 10.1016/j.ejmech.2018.01.066 10.7270/Q2K64MM0 29421570 Dias Viegas, FP; de Freitas Silva, M; Divino da Rocha, M; Castelli, MR; Riquiel, MM; Machado, RP; Vaz, SM; Simões de Lima, LM; Mancini, KC; Marques de Oliveira, PC; Morais, ÉP; Gontijo, VS; da Silva, FMR; D'Alincourt da Fonseca Peçanha, D; Castro, NG; Neves, GA; Giusti-Paiva, A; Vilela, FC; Orlandi, L; Camps, I; Veloso, MP; Leomil Coelho, LF; Ionta, M; Ferreira-Silva, GÁ; Pereira, RM; Dardenne, LE; Guedes, IA; de Oliveira Carneiro Junior, W; Quaglio Bellozi, PM; Pinheiro de Oliveira, AC; Ferreira, FF; Pruccoli, L; Tarozzi, A; Viegas, C Federal University of Alfenas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 410432 COc1cc(CNCCCNCc2cc3OCOc3c(OC)c2)cc2OCOc12 InChI=1S/C21H26N2O6/c1-24-16-6-14(8-18-20(16)28-12-26-18)10-22-4-3-5-23-11-15-7-17(25-2)21-19(9-15)27-13-29-21/h6-9,22-23H,3-5,10-13H2,1-2H3 HCXASWJULMHYCF-UHFFFAOYSA-N 235647 N1,N3-bis((7-methoxybenzo[d][1,3]dioxol-5-yl)methyl)propane-1,3-diamine (5a) Cholinesterase 5.231e+4 8 37.00 C Curated from the literature by BindingDB 10.3109/14756366.2010.548329 10.7270/Q29022NH 21250822 aid1803029 Luo, W; Li, YP; Tan, JH; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=235647 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=235647&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134686709 375077295 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 410433 COc1cc(CNCCCCNCc2cc3OCOc3c(OC)c2)cc2OCOc12 InChI=1S/C22H28N2O6/c1-25-17-7-15(9-19-21(17)29-13-27-19)11-23-5-3-4-6-24-12-16-8-18(26-2)22-20(10-16)28-14-30-22/h7-10,23-24H,3-6,11-14H2,1-2H3 CFUJFROTVCYTOR-UHFFFAOYSA-N 235648 N1,N4-bis((7-methoxybenzo[d][1,3]dioxol-5-yl)methyl)butane-1,4-diamine (5b) Cholinesterase 1.213e+4 8 37.00 C Curated from the literature by BindingDB 10.3109/14756366.2010.548329 10.7270/Q29022NH 21250822 aid1803029 Luo, W; Li, YP; Tan, JH; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=235648 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=235648&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134686710 375077296 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 410434 COc1cc(CNCCCCCNCc2cc3OCOc3c(OC)c2)cc2OCOc12 InChI=1S/C23H30N2O6/c1-26-18-8-16(10-20-22(18)30-14-28-20)12-24-6-4-3-5-7-25-13-17-9-19(27-2)23-21(11-17)29-15-31-23/h8-11,24-25H,3-7,12-15H2,1-2H3 BJMZLJGPDOOYON-UHFFFAOYSA-N 235649 N1,N5-bis((7-methoxybenzo[d][1,3]dioxol-5-yl)methyl)pentane-1,5-diamine (5c) Cholinesterase 3.35e+3 8 37.00 C Curated from the literature by BindingDB 10.3109/14756366.2010.548329 10.7270/Q29022NH 21250822 aid1803029 Luo, W; Li, YP; Tan, JH; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=235649 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=235649&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134686711 375077297 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 410435 COc1cc(CNCCCCCCNCc2cc3OCOc3c(OC)c2)cc2OCOc12 InChI=1S/C24H32N2O6/c1-27-19-9-17(11-21-23(19)31-15-29-21)13-25-7-5-3-4-6-8-26-14-18-10-20(28-2)24-22(12-18)30-16-32-24/h9-12,25-26H,3-8,13-16H2,1-2H3 TZMDWCJQVQRVMY-UHFFFAOYSA-N 235650 N1,N6-bis((7-methoxybenzo[d][1,3]dioxol-5-yl)methyl)hexane-1,6-diamine (5d) Cholinesterase 2.07e+3 8 37.00 C Curated from the literature by BindingDB 10.3109/14756366.2010.548329 10.7270/Q29022NH 21250822 aid1803029 Luo, W; Li, YP; Tan, JH; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=235650 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=235650&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53484107 375077298 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 410436 COc1cc(CNCCCCCCCNCc2cc3OCOc3c(OC)c2)cc2OCOc12 InChI=1S/C25H34N2O6/c1-28-20-10-18(12-22-24(20)32-16-30-22)14-26-8-6-4-3-5-7-9-27-15-19-11-21(29-2)25-23(13-19)31-17-33-25/h10-13,26-27H,3-9,14-17H2,1-2H3 FSQWGCQSCBWZSL-UHFFFAOYSA-N 235651 N1,N7-bis((7-methoxybenzo[d][1,3]dioxol-5-yl)methyl)heptane-1,7-diamine (5e) Cholinesterase 3.02e+3 8 37.00 C Curated from the literature by BindingDB 10.3109/14756366.2010.548329 10.7270/Q29022NH 21250822 aid1803029 Luo, W; Li, YP; Tan, JH; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=235651 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=235651&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53484108 375077299 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 410437 COc1cc(CNCCCCCCCCNCc2cc3OCOc3c(OC)c2)cc2OCOc12 InChI=1S/C26H36N2O6/c1-29-21-11-19(13-23-25(21)33-17-31-23)15-27-9-7-5-3-4-6-8-10-28-16-20-12-22(30-2)26-24(14-20)32-18-34-26/h11-14,27-28H,3-10,15-18H2,1-2H3 HBFWQMXRCCOIBQ-UHFFFAOYSA-N 235652 N1, N8-bis((7-methoxybenzo[d][1,3]dioxol-5-yl)methyl)octane-1,8-diamine (5f) Cholinesterase 3.11e+3 8 37.00 C Curated from the literature by BindingDB 10.3109/14756366.2010.548329 10.7270/Q29022NH 21250822 aid1803029 Luo, W; Li, YP; Tan, JH; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=235652 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=235652&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53484125 375077301 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 410438 COc1cc(CNCCCCCCCCCNCc2cc3OCOc3c(OC)c2)cc2OCOc12 InChI=1S/C27H38N2O6/c1-30-22-12-20(14-24-26(22)34-18-32-24)16-28-10-8-6-4-3-5-7-9-11-29-17-21-13-23(31-2)27-25(15-21)33-19-35-27/h12-15,28-29H,3-11,16-19H2,1-2H3 XSHRVWOVUGATJH-UHFFFAOYSA-N 235653 N1,N9-bis((7-methoxybenzo[d][1,3]dioxol-5-yl)methyl)nonane-1,9-diamine (5g) Cholinesterase 5.14e+3 8 37.00 C Curated from the literature by BindingDB 10.3109/14756366.2010.548329 10.7270/Q29022NH 21250822 aid1803029 Luo, W; Li, YP; Tan, JH; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=235653 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=235653&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53484126 375077302 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 410439 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 10620 (S)-3-(1-(dimethylamino)ethyl)phenyl ethyl(methyl)carbamate::3-((1S)-1-(Dimethylamino)ethyl)phenyl N-ethyl N-methyl carbamate::3-(1-(dimethylamino)ethyl)phenyl ethyl(methyl)carbamate::3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::CHEMBL636::ENA-713::Ethyl-methyl-carbamic acid 3-((R)-1-dimethylamino-ethyl)-phenyl ester::Ethyl-methyl-carbamic acid 3-((S)-1-dimethylamino-ethyl)-phenyl ester::Ethyl-methyl-carbamic acid 3-(1-dimethylamino-ethyl)-phenyl ester::Exelon::Rivastigmine::Rivastigmine (1)::SDZ-212-713::SDZ-ENA-713 Cholinesterase 1.60e+3 8 37.00 C Curated from the literature by BindingDB 10.3109/14756366.2010.548329 10.7270/Q29022NH 21250822 aid1803029 Luo, W; Li, YP; Tan, JH; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10620 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10620&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46511221 8874 CHEMBL636 DB00989 6602 C11766 ZINC00004413 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50080440 Oc1c(C(=O)NC2CCN(Cc3ccccc3)CC2)c(=O)[nH]c2ccccc12 InChI=1S/C22H23N3O3/c26-20-17-8-4-5-9-18(17)24-22(28)19(20)21(27)23-16-10-12-25(13-11-16)14-15-6-2-1-3-7-15/h1-9,16H,10-14H2,(H,23,27)(H2,24,26,28) QNIZDRTWRUDVEG-UHFFFAOYSA-N 50002850 CHEMBL3233663 Cholinesterase >10000 ChEMBL 10.1016/j.bmc.2014.02.046 10.7270/Q28K7BMT 24657052 Pudlo, M; Luzet, V; Ismaïli, L; Tomassoli, I; Iutzeler, A; Refouvelet, B Universit£ de Franche Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002850 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002850&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654556 242056247 CHEMBL3233663 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50080441 Oc1c(C(=O)NCC2CCN(Cc3ccccc3)CC2)c(=O)[nH]c2ccccc12 InChI=1S/C23H25N3O3/c27-21-18-8-4-5-9-19(18)25-23(29)20(21)22(28)24-14-16-10-12-26(13-11-16)15-17-6-2-1-3-7-17/h1-9,16H,10-15H2,(H,24,28)(H2,25,27,29) REEKWTZFCFKUCQ-UHFFFAOYSA-N 50002851 CHEMBL3233664 Cholinesterase 6020 ChEMBL 10.1016/j.bmc.2014.02.046 10.7270/Q28K7BMT 24657052 Pudlo, M; Luzet, V; Ismaïli, L; Tomassoli, I; Iutzeler, A; Refouvelet, B Universit£ de Franche Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002851 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002851&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654557 242056248 CHEMBL3233664 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50080442 Cn1c2ccccc2c(O)c(C(=O)NC2CCN(Cc3ccccc3)CC2)c1=O InChI=1S/C23H25N3O3/c1-25-19-10-6-5-9-18(19)21(27)20(23(25)29)22(28)24-17-11-13-26(14-12-17)15-16-7-3-2-4-8-16/h2-10,17,27H,11-15H2,1H3,(H,24,28) AQCCNFXUETZHFK-UHFFFAOYSA-N 50002852 CHEMBL3233926 Cholinesterase >10000 ChEMBL 10.1016/j.bmc.2014.02.046 10.7270/Q28K7BMT 24657052 Pudlo, M; Luzet, V; Ismaïli, L; Tomassoli, I; Iutzeler, A; Refouvelet, B Universit£ de Franche Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002852 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002852&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654558 242056249 CHEMBL3233926 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50080443 Cn1c2ccccc2c(O)c(C(=O)NCC2CCN(Cc3ccccc3)CC2)c1=O InChI=1S/C24H27N3O3/c1-26-20-10-6-5-9-19(20)22(28)21(24(26)30)23(29)25-15-17-11-13-27(14-12-17)16-18-7-3-2-4-8-18/h2-10,17,28H,11-16H2,1H3,(H,25,29) RSCJWRHULWSVAD-UHFFFAOYSA-N 50002853 CHEMBL3233927 Cholinesterase 4260 ChEMBL 10.1016/j.bmc.2014.02.046 10.7270/Q28K7BMT 24657052 Pudlo, M; Luzet, V; Ismaïli, L; Tomassoli, I; Iutzeler, A; Refouvelet, B Universit£ de Franche Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002853 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002853&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654559 242056250 CHEMBL3233927 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50080444 Oc1c(C(=O)NC2CCN(Cc3ccccc3)CC2)c(=O)n(Cc2ccccc2)c2ccccc12 InChI=1S/C29H29N3O3/c33-27-24-13-7-8-14-25(24)32(20-22-11-5-2-6-12-22)29(35)26(27)28(34)30-23-15-17-31(18-16-23)19-21-9-3-1-4-10-21/h1-14,23,33H,15-20H2,(H,30,34) YDLFOIGNTJLJKH-UHFFFAOYSA-N 50002854 CHEMBL3233928 Cholinesterase >10000 ChEMBL 10.1016/j.bmc.2014.02.046 10.7270/Q28K7BMT 24657052 Pudlo, M; Luzet, V; Ismaïli, L; Tomassoli, I; Iutzeler, A; Refouvelet, B Universit£ de Franche Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002854 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002854&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654560 242056251 CHEMBL3233928 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50080445 Oc1c(C(=O)NCC2CCN(Cc3ccccc3)CC2)c(=O)n(Cc2ccccc2)c2ccccc12 InChI=1S/C30H31N3O3/c34-28-25-13-7-8-14-26(25)33(21-24-11-5-2-6-12-24)30(36)27(28)29(35)31-19-22-15-17-32(18-16-22)20-23-9-3-1-4-10-23/h1-14,22,34H,15-21H2,(H,31,35) ZMCIDQXTPIMGHC-UHFFFAOYSA-N 50002855 CHEMBL3233929 Cholinesterase >10000 ChEMBL 10.1016/j.bmc.2014.02.046 10.7270/Q28K7BMT 24657052 Pudlo, M; Luzet, V; Ismaïli, L; Tomassoli, I; Iutzeler, A; Refouvelet, B Universit£ de Franche Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002855 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002855&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654561 242056252 CHEMBL3233929 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50080446 Cc1c(C(=O)NC2CCN(Cc3ccccc3)CC2)c(=O)[nH]c2ccccc12 InChI=1S/C23H25N3O2/c1-16-19-9-5-6-10-20(19)25-23(28)21(16)22(27)24-18-11-13-26(14-12-18)15-17-7-3-2-4-8-17/h2-10,18H,11-15H2,1H3,(H,24,27)(H,25,28) XSTVCUZDNVVPSU-UHFFFAOYSA-N 50002837 CHEMBL3233930 Cholinesterase >10000 ChEMBL 10.1016/j.bmc.2014.02.046 10.7270/Q28K7BMT 24657052 Pudlo, M; Luzet, V; Ismaïli, L; Tomassoli, I; Iutzeler, A; Refouvelet, B Universit£ de Franche Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002837 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002837&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654544 242056235 CHEMBL3233930 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50080447 Cc1c(C(=O)NCC2CCN(Cc3ccccc3)CC2)c(=O)[nH]c2ccccc12 InChI=1S/C24H27N3O2/c1-17-20-9-5-6-10-21(20)26-24(29)22(17)23(28)25-15-18-11-13-27(14-12-18)16-19-7-3-2-4-8-19/h2-10,18H,11-16H2,1H3,(H,25,28)(H,26,29) SUWHBHPTLOJQSS-UHFFFAOYSA-N 50002839 CHEMBL3233931 Cholinesterase >10000 ChEMBL 10.1016/j.bmc.2014.02.046 10.7270/Q28K7BMT 24657052 Pudlo, M; Luzet, V; Ismaïli, L; Tomassoli, I; Iutzeler, A; Refouvelet, B Universit£ de Franche Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002839 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002839&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654545 242056236 CHEMBL3233931 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50080448 O=C(NC1CCN(Cc2ccccc2)CC1)c1c(-c2ccccc2)c2ccccc2[nH]c1=O InChI=1S/C28H27N3O2/c32-27(29-22-15-17-31(18-16-22)19-20-9-3-1-4-10-20)26-25(21-11-5-2-6-12-21)23-13-7-8-14-24(23)30-28(26)33/h1-14,22H,15-19H2,(H,29,32)(H,30,33) YNALSIRAHUPMGC-UHFFFAOYSA-N 50002840 CHEMBL3233932 Cholinesterase >10000 ChEMBL 10.1016/j.bmc.2014.02.046 10.7270/Q28K7BMT 24657052 Pudlo, M; Luzet, V; Ismaïli, L; Tomassoli, I; Iutzeler, A; Refouvelet, B Universit£ de Franche Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002840 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002840&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654546 242056237 CHEMBL3233932 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50080449 Cn1c2ccccc2c(N)c(C(=O)NCC2CCN(Cc3ccccc3)CC2)c1=O InChI=1S/C24H28N4O2/c1-27-20-10-6-5-9-19(20)22(25)21(24(27)30)23(29)26-15-17-11-13-28(14-12-17)16-18-7-3-2-4-8-18/h2-10,17H,11-16,25H2,1H3,(H,26,29) OGWLQWKNOZWLAF-UHFFFAOYSA-N 50002841 CHEMBL3233933 Cholinesterase 1140 ChEMBL 10.1016/j.bmc.2014.02.046 10.7270/Q28K7BMT 24657052 Pudlo, M; Luzet, V; Ismaïli, L; Tomassoli, I; Iutzeler, A; Refouvelet, B Universit£ de Franche Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002841 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002841&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654547 242056238 CHEMBL3233933 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50080450 COc1cc2[nH]c(=O)c(C(=O)NCC3CCN(Cc4ccccc4)CC3)c(O)c2cc1OC InChI=1S/C25H29N3O5/c1-32-20-12-18-19(13-21(20)33-2)27-25(31)22(23(18)29)24(30)26-14-16-8-10-28(11-9-16)15-17-6-4-3-5-7-17/h3-7,12-13,16H,8-11,14-15H2,1-2H3,(H,26,30)(H2,27,29,31) MPCFYBGGGLVQEC-UHFFFAOYSA-N 50002842 CHEMBL3233934 Cholinesterase >60000 ChEMBL 10.1016/j.bmc.2014.02.046 10.7270/Q28K7BMT 24657052 Pudlo, M; Luzet, V; Ismaïli, L; Tomassoli, I; Iutzeler, A; Refouvelet, B Universit£ de Franche Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002842 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002842&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 86279207 242056239 CHEMBL3233934 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50080451 Oc1cc2[nH]c(=O)c(C(=O)NCC3CCN(Cc4ccccc4)CC3)c(O)c2cc1O InChI=1S/C23H25N3O5/c27-18-10-16-17(11-19(18)28)25-23(31)20(21(16)29)22(30)24-12-14-6-8-26(9-7-14)13-15-4-2-1-3-5-15/h1-5,10-11,14,27-28H,6-9,12-13H2,(H,24,30)(H2,25,29,31) LANSNGGYDDMUGY-UHFFFAOYSA-N 50002843 CHEMBL3233935 Cholinesterase >10000 ChEMBL 10.1016/j.bmc.2014.02.046 10.7270/Q28K7BMT 24657052 Pudlo, M; Luzet, V; Ismaïli, L; Tomassoli, I; Iutzeler, A; Refouvelet, B Universit£ de Franche Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002843 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002843&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 86279208 242056240 CHEMBL3233935 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50080452 COc1cc2c(O)c(C(=O)NCC3CCN(Cc4ccccc4)CC3)c(=O)n(C)c2cc1OC InChI=1S/C26H31N3O5.ClH/c1-28-20-14-22(34-3)21(33-2)13-19(20)24(30)23(26(28)32)25(31)27-15-17-9-11-29(12-10-17)16-18-7-5-4-6-8-18;/h4-8,13-14,17,30H,9-12,15-16H2,1-3H3,(H,27,31);1H UMSZBFQYTWROFY-UHFFFAOYSA-N 50002844 CHEMBL3233936 Cholinesterase >10000 ChEMBL 10.1016/j.bmc.2014.02.046 10.7270/Q28K7BMT 24657052 Pudlo, M; Luzet, V; Ismaïli, L; Tomassoli, I; Iutzeler, A; Refouvelet, B Universit£ de Franche Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002844 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002844&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654548 242056241 CHEMBL3233936 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50080453 Cn1c2cc(O)c(O)cc2c(O)c(C(=O)NCC2CCN(Cc3ccccc3)CC2)c1=O InChI=1S/C24H27N3O5/c1-26-18-12-20(29)19(28)11-17(18)22(30)21(24(26)32)23(31)25-13-15-7-9-27(10-8-15)14-16-5-3-2-4-6-16/h2-6,11-12,15,28-30H,7-10,13-14H2,1H3,(H,25,31) FLPROBFPVXCIRQ-UHFFFAOYSA-N 50002845 CHEMBL3233937 Cholinesterase >10000 ChEMBL 10.1016/j.bmc.2014.02.046 10.7270/Q28K7BMT 24657052 Pudlo, M; Luzet, V; Ismaïli, L; Tomassoli, I; Iutzeler, A; Refouvelet, B Universit£ de Franche Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002845 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002845&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654550 242056242 CHEMBL3233937 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50080454 COc1cc2c(O)c(C(=O)NCC3CCN(Cc4ccccc4)CC3)c(=O)n(Cc3ccccc3)c2cc1OC InChI=1S/C32H35N3O5/c1-39-27-17-25-26(18-28(27)40-2)35(21-24-11-7-4-8-12-24)32(38)29(30(25)36)31(37)33-19-22-13-15-34(16-14-22)20-23-9-5-3-6-10-23/h3-12,17-18,22,36H,13-16,19-21H2,1-2H3,(H,33,37) WORHDPUHGADSMT-UHFFFAOYSA-N 50002846 CHEMBL3233938 Cholinesterase >60000 ChEMBL 10.1016/j.bmc.2014.02.046 10.7270/Q28K7BMT 24657052 Pudlo, M; Luzet, V; Ismaïli, L; Tomassoli, I; Iutzeler, A; Refouvelet, B Universit£ de Franche Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002846 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002846&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654551 242056243 CHEMBL3233938 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50080455 Oc1cc2c(O)c(C(=O)NCC3CCN(Cc4ccccc4)CC3)c(=O)n(Cc3ccccc3)c2cc1O InChI=1S/C30H31N3O5.ClH/c34-25-15-23-24(16-26(25)35)33(19-22-9-5-2-6-10-22)30(38)27(28(23)36)29(37)31-17-20-11-13-32(14-12-20)18-21-7-3-1-4-8-21;/h1-10,15-16,20,34-36H,11-14,17-19H2,(H,31,37);1H ARBJOLLKLZASHO-UHFFFAOYSA-N 50002847 CHEMBL3233939 Cholinesterase >10000 ChEMBL 10.1016/j.bmc.2014.02.046 10.7270/Q28K7BMT 24657052 Pudlo, M; Luzet, V; Ismaïli, L; Tomassoli, I; Iutzeler, A; Refouvelet, B Universit£ de Franche Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002847 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002847&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654552 242056244 CHEMBL3233939 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50080456 COc1cc(Cn2c3ccccc3c(O)c(C(=O)NCC3CCN(Cc4ccccc4)CC3)c2=O)cc(OC)c1O InChI=1S/C32H35N3O6/c1-40-26-16-23(17-27(41-2)30(26)37)20-35-25-11-7-6-10-24(25)29(36)28(32(35)39)31(38)33-18-21-12-14-34(15-13-21)19-22-8-4-3-5-9-22/h3-11,16-17,21,36-37H,12-15,18-20H2,1-2H3,(H,33,38) VRHSEGDRDZYKQN-UHFFFAOYSA-N 50002848 CHEMBL3233940 Cholinesterase 330 ChEMBL 10.1016/j.bmc.2014.02.046 10.7270/Q28K7BMT 24657052 Pudlo, M; Luzet, V; Ismaïli, L; Tomassoli, I; Iutzeler, A; Refouvelet, B Universit£ de Franche Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002848 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002848&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654554 242056245 CHEMBL3233940 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50080457 Oc1cc(Cn2c3ccccc3c(O)c(C(=O)NCC3CCN(Cc4ccccc4)CC3)c2=O)cc(O)c1O InChI=1S/C30H31N3O6/c34-24-14-21(15-25(35)28(24)37)18-33-23-9-5-4-8-22(23)27(36)26(30(33)39)29(38)31-16-19-10-12-32(13-11-19)17-20-6-2-1-3-7-20/h1-9,14-15,19,34-37H,10-13,16-18H2,(H,31,38) XVKJCTWYDZVTND-UHFFFAOYSA-N 50002849 CHEMBL3233941 Cholinesterase >10000 ChEMBL 10.1016/j.bmc.2014.02.046 10.7270/Q28K7BMT 24657052 Pudlo, M; Luzet, V; Ismaïli, L; Tomassoli, I; Iutzeler, A; Refouvelet, B Universit£ de Franche Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50002849 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50002849&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654555 242056246 CHEMBL3233941 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50080458 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 1820 ChEMBL 10.1016/j.bmc.2014.02.046 10.7270/Q28K7BMT 24657052 Pudlo, M; Luzet, V; Ismaïli, L; Tomassoli, I; Iutzeler, A; Refouvelet, B Universit£ de Franche Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50080459 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 3.3 ChEMBL 10.1016/j.bmc.2014.02.046 10.7270/Q28K7BMT 24657052 Pudlo, M; Luzet, V; Ismaïli, L; Tomassoli, I; Iutzeler, A; Refouvelet, B Universit£ de Franche Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50081983 CN1c2c(C)n(nc2-c2ccccc2S1(=O)=O)-c1ccc(cc1)-c1nc2cc(ccc2[nH]1)C(O)=O InChI=1S/C25H19N5O4S/c1-14-23-22(18-5-3-4-6-21(18)35(33,34)29(23)2)28-30(14)17-10-7-15(8-11-17)24-26-19-12-9-16(25(31)32)13-20(19)27-24/h3-13H,1-2H3,(H,26,27)(H,31,32) SNFQMRCPTPDWBU-UHFFFAOYSA-N 50004238 CHEMBL3237453 Cholinesterase 26 ChEMBL 10.1016/j.ejmech.2014.03.035 10.7270/Q2TD9ZVD 24681070 Aslam, S; Zaib, S; Ahmad, M; Gardiner, JM; Ahmad, A; Hameed, A; Furtmann, N; Gütschow, M; Bajorath, J; Iqbal, J Government College Women University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50004238 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50004238&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654774 242056699 CHEMBL3237453 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50081984 CN1c2c(C)n(nc2-c2ccccc2S1(=O)=O)-c1ccc(cc1)-c1nc2cc(Br)ccc2[nH]1 InChI=1S/C24H18BrN5O2S/c1-14-23-22(18-5-3-4-6-21(18)33(31,32)29(23)2)28-30(14)17-10-7-15(8-11-17)24-26-19-12-9-16(25)13-20(19)27-24/h3-13H,1-2H3,(H,26,27) TXEINIIWMUILEH-UHFFFAOYSA-N 50004239 CHEMBL3237455 Cholinesterase 49 ChEMBL 10.1016/j.ejmech.2014.03.035 10.7270/Q2TD9ZVD 24681070 Aslam, S; Zaib, S; Ahmad, M; Gardiner, JM; Ahmad, A; Hameed, A; Furtmann, N; Gütschow, M; Bajorath, J; Iqbal, J Government College Women University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50004239 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50004239&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654775 242056700 CHEMBL3237455 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50081985 CN1c2c(C)n(nc2-c2ccccc2S1(=O)=O)-c1ccc(cc1)-c1nc2ccccc2[nH]1 InChI=1S/C24H19N5O2S/c1-15-23-22(18-7-3-6-10-21(18)32(30,31)28(23)2)27-29(15)17-13-11-16(12-14-17)24-25-19-8-4-5-9-20(19)26-24/h3-14H,1-2H3,(H,25,26) JFCFEUHUOLGWLT-UHFFFAOYSA-N 50004240 CHEMBL3237456 Cholinesterase 43 ChEMBL 10.1016/j.ejmech.2014.03.035 10.7270/Q2TD9ZVD 24681070 Aslam, S; Zaib, S; Ahmad, M; Gardiner, JM; Ahmad, A; Hameed, A; Furtmann, N; Gütschow, M; Bajorath, J; Iqbal, J Government College Women University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50004240 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50004240&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654776 103917940 CHEMBL3237456 ZINC13731353 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50081987 CN1c2c(C)n(nc2-c2ccccc2S1(=O)=O)-c1ccc(cc1)-c1nc2cc(C)ccc2[nH]1 InChI=1S/C25H21N5O2S/c1-15-8-13-20-21(14-15)27-25(26-20)17-9-11-18(12-10-17)30-16(2)24-23(28-30)19-6-4-5-7-22(19)33(31,32)29(24)3/h4-14H,1-3H3,(H,26,27) HNEYIXBHCQDLFD-UHFFFAOYSA-N 50004241 CHEMBL3233057 Cholinesterase 41 ChEMBL 10.1016/j.ejmech.2014.03.035 10.7270/Q2TD9ZVD 24681070 Aslam, S; Zaib, S; Ahmad, M; Gardiner, JM; Ahmad, A; Hameed, A; Furtmann, N; Gütschow, M; Bajorath, J; Iqbal, J Government College Women University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50004241 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50004241&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654777 242056701 CHEMBL3233057 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50081989 CN1c2c(C)n(nc2-c2ccccc2S1(=O)=O)-c1ccc(cc1)-c1nc2cc(C)c(C)cc2[nH]1 InChI=1S/C26H23N5O2S/c1-15-13-21-22(14-16(15)2)28-26(27-21)18-9-11-19(12-10-18)31-17(3)25-24(29-31)20-7-5-6-8-23(20)34(32,33)30(25)4/h5-14H,1-4H3,(H,27,28) PSHGYERFYLKBNT-UHFFFAOYSA-N 50004242 CHEMBL3237457 Cholinesterase 273 ChEMBL 10.1016/j.ejmech.2014.03.035 10.7270/Q2TD9ZVD 24681070 Aslam, S; Zaib, S; Ahmad, M; Gardiner, JM; Ahmad, A; Hameed, A; Furtmann, N; Gütschow, M; Bajorath, J; Iqbal, J Government College Women University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50004242 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50004242&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654778 103917941 CHEMBL3237457 ZINC13731347 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50081990 COc1ccc2[nH]c(nc2c1)-c1ccc(cc1)-n1nc-2c(N(C)S(=O)(=O)c3ccccc-23)c1C InChI=1S/C25H21N5O3S/c1-15-24-23(19-6-4-5-7-22(19)34(31,32)29(24)2)28-30(15)17-10-8-16(9-11-17)25-26-20-13-12-18(33-3)14-21(20)27-25/h4-14H,1-3H3,(H,26,27) AWSXQDQGHHBFOB-UHFFFAOYSA-N 50004243 CHEMBL3237459 Cholinesterase 6920 ChEMBL 10.1016/j.ejmech.2014.03.035 10.7270/Q2TD9ZVD 24681070 Aslam, S; Zaib, S; Ahmad, M; Gardiner, JM; Ahmad, A; Hameed, A; Furtmann, N; Gütschow, M; Bajorath, J; Iqbal, J Government College Women University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50004243 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50004243&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654779 242056702 CHEMBL3237459 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50081992 CN1c2c(C)n(nc2-c2ccccc2S1(=O)=O)-c1ccc(cc1)-c1nc2ccccc2o1 InChI=1S/C24H18N4O3S/c1-15-23-22(18-7-3-6-10-21(18)32(29,30)27(23)2)26-28(15)17-13-11-16(12-14-17)24-25-19-8-4-5-9-20(19)31-24/h3-14H,1-2H3 GRKOTSRAIASLDD-UHFFFAOYSA-N 50004244 CHEMBL3237461 Cholinesterase 17 ChEMBL 10.1016/j.ejmech.2014.03.035 10.7270/Q2TD9ZVD 24681070 Aslam, S; Zaib, S; Ahmad, M; Gardiner, JM; Ahmad, A; Hameed, A; Furtmann, N; Gütschow, M; Bajorath, J; Iqbal, J Government College Women University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50004244 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50004244&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 86287777 103917942 CHEMBL3237461 ZINC13731339 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50081993 CN1c2c(nn(c2-c2ccccc2)-c2ccc(cc2)-c2nc3cc(ccc3[nH]2)C(O)=O)-c2ccccc2S1(=O)=O InChI=1S/C30H21N5O4S/c1-34-28-26(22-9-5-6-10-25(22)40(34,38)39)33-35(27(28)18-7-3-2-4-8-18)21-14-11-19(12-15-21)29-31-23-16-13-20(30(36)37)17-24(23)32-29/h2-17H,1H3,(H,31,32)(H,36,37) VRRLYCAQIWGAJI-UHFFFAOYSA-N 50004245 CHEMBL3237463 Cholinesterase 4620 ChEMBL 10.1016/j.ejmech.2014.03.035 10.7270/Q2TD9ZVD 24681070 Aslam, S; Zaib, S; Ahmad, M; Gardiner, JM; Ahmad, A; Hameed, A; Furtmann, N; Gütschow, M; Bajorath, J; Iqbal, J Government College Women University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50004245 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50004245&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654780 242056703 CHEMBL3237463 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50081994 CN1c2c(nn(c2-c2ccccc2)-c2ccc(cc2)-c2nc3cc(Cl)ccc3[nH]2)-c2ccccc2S1(=O)=O InChI=1S/C29H20ClN5O2S/c1-34-28-26(22-9-5-6-10-25(22)38(34,36)37)33-35(27(28)18-7-3-2-4-8-18)21-14-11-19(12-15-21)29-31-23-16-13-20(30)17-24(23)32-29/h2-17H,1H3,(H,31,32) NUNKRQUDKAJLCJ-UHFFFAOYSA-N 50004246 CHEMBL3237464 Cholinesterase 9940 ChEMBL 10.1016/j.ejmech.2014.03.035 10.7270/Q2TD9ZVD 24681070 Aslam, S; Zaib, S; Ahmad, M; Gardiner, JM; Ahmad, A; Hameed, A; Furtmann, N; Gütschow, M; Bajorath, J; Iqbal, J Government College Women University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50004246 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50004246&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654781 103917943 CHEMBL3237464 ZINC13731356 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50081996 CN1c2c(nn(c2-c2ccccc2)-c2ccc(cc2)-c2nc3cc(Br)ccc3[nH]2)-c2ccccc2S1(=O)=O InChI=1S/C29H20BrN5O2S/c1-34-28-26(22-9-5-6-10-25(22)38(34,36)37)33-35(27(28)18-7-3-2-4-8-18)21-14-11-19(12-15-21)29-31-23-16-13-20(30)17-24(23)32-29/h2-17H,1H3,(H,31,32) PZLXDLZHJDFPLP-UHFFFAOYSA-N 50004247 CHEMBL3237465 Cholinesterase 3230 ChEMBL 10.1016/j.ejmech.2014.03.035 10.7270/Q2TD9ZVD 24681070 Aslam, S; Zaib, S; Ahmad, M; Gardiner, JM; Ahmad, A; Hameed, A; Furtmann, N; Gütschow, M; Bajorath, J; Iqbal, J Government College Women University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50004247 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50004247&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654782 242056704 CHEMBL3237465 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50081997 CN1c2c(nn(c2-c2ccccc2)-c2ccc(cc2)-c2nc3ccccc3[nH]2)-c2ccccc2S1(=O)=O InChI=1S/C29H21N5O2S/c1-33-28-26(22-11-5-8-14-25(22)37(33,35)36)32-34(27(28)19-9-3-2-4-10-19)21-17-15-20(16-18-21)29-30-23-12-6-7-13-24(23)31-29/h2-18H,1H3,(H,30,31) VHNDEGIKHUJVBH-UHFFFAOYSA-N 50004248 CHEMBL3237466 Cholinesterase 43 ChEMBL 10.1016/j.ejmech.2014.03.035 10.7270/Q2TD9ZVD 24681070 Aslam, S; Zaib, S; Ahmad, M; Gardiner, JM; Ahmad, A; Hameed, A; Furtmann, N; Gütschow, M; Bajorath, J; Iqbal, J Government College Women University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50004248 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50004248&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 86288791 242056705 CHEMBL3237466 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50081999 CN1c2c(nn(c2-c2ccccc2)-c2ccc(cc2)-c2nc3cncnc3[nH]2)-c2ccccc2S1(=O)=O InChI=1S/C27H19N7O2S/c1-33-25-23(20-9-5-6-10-22(20)37(33,35)36)32-34(24(25)17-7-3-2-4-8-17)19-13-11-18(12-14-19)26-30-21-15-28-16-29-27(21)31-26/h2-16H,1H3,(H,28,29,30,31) LTNJPLUZUFEYSP-UHFFFAOYSA-N 50004249 CHEMBL3237471 Cholinesterase 1330 ChEMBL 10.1016/j.ejmech.2014.03.035 10.7270/Q2TD9ZVD 24681070 Aslam, S; Zaib, S; Ahmad, M; Gardiner, JM; Ahmad, A; Hameed, A; Furtmann, N; Gütschow, M; Bajorath, J; Iqbal, J Government College Women University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50004249 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50004249&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654783 103917944 CHEMBL3237471 ZINC13731350 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50082000 CCOC(=O)c1ccc2[nH]c(nc2c1)-c1ccc(cc1)-n1nc-2c(N(C)S(=O)(=O)c3ccccc-23)c1-c1ccccc1 InChI=1S/C32H25N5O4S/c1-3-41-32(38)22-15-18-25-26(19-22)34-31(33-25)21-13-16-23(17-14-21)37-29(20-9-5-4-6-10-20)30-28(35-37)24-11-7-8-12-27(24)42(39,40)36(30)2/h4-19H,3H2,1-2H3,(H,33,34) IFVONWLVMPHCMV-UHFFFAOYSA-N 50004250 CHEMBL3237473 Cholinesterase 180 ChEMBL 10.1016/j.ejmech.2014.03.035 10.7270/Q2TD9ZVD 24681070 Aslam, S; Zaib, S; Ahmad, M; Gardiner, JM; Ahmad, A; Hameed, A; Furtmann, N; Gütschow, M; Bajorath, J; Iqbal, J Government College Women University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50004250 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50004250&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90654784 242056706 CHEMBL3237473 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50082002 CN(C)C(=O)Oc1cccc(c1)[N+](C)(C)C InChI=1S/C12H19N2O2/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5/h6-9H,1-5H3/q+1 ALWKGYPQUAPLQC-UHFFFAOYSA-N 50022775 (m-Hydroxyphenyl)trimethylammonium dimethylcarbamate::3-Trimethylammoniumphenyl N,N-dimethylcarbamate::3-[(dimethylcarbamoyl)oxy]-N,N,N-trimethylanilinium::CHEMBL211471::CHEMBL278020::Eustigmin::Eustigmine::NEOSTIGMINE::Neostigmine (2)::Prostigmine::Vagostigmine::m-Trimethylammoniumphenyldimethylcarbamate Cholinesterase 49600 ChEMBL 10.1016/j.ejmech.2014.03.035 10.7270/Q2TD9ZVD 24681070 Aslam, S; Zaib, S; Ahmad, M; Gardiner, JM; Ahmad, A; Hameed, A; Furtmann, N; Gütschow, M; Bajorath, J; Iqbal, J Government College Women University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50022775 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50022775&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 4456 103933337 7514 CHEMBL278020CHEMBL211471 DB01400 C08200 ZINC00001792 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50082003 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 6410 ChEMBL 10.1016/j.ejmech.2014.03.035 10.7270/Q2TD9ZVD 24681070 Aslam, S; Zaib, S; Ahmad, M; Gardiner, JM; Ahmad, A; Hameed, A; Furtmann, N; Gütschow, M; Bajorath, J; Iqbal, J Government College Women University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50086587 C=CC(=O)N1C\C(=C/c2ccccc2)C(=O)C2(C1)C(C(NC21C(=O)Nc2ccccc12)c1ccccc1)c1ccccc1 InChI=1S/C37H31N3O3/c1-2-31(41)40-23-28(22-25-14-6-3-7-15-25)34(42)36(24-40)32(26-16-8-4-9-17-26)33(27-18-10-5-11-19-27)39-37(36)29-20-12-13-21-30(29)38-35(37)43/h2-22,32-33,39H,1,23-24H2,(H,38,43)/b28-22+ IKSKRQXHVURXBT-XAYXJRQQSA-N 50008526 CHEMBL3235937 Cholinesterase 12320 ChEMBL 10.1016/j.bmcl.2014.02.019 10.7270/Q2S46TH2 24594354 Kia, Y; Osman, H; Suresh Kumar, R; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008526 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008526&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90655337 242057274 CHEMBL3235937 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50086588 Cc1ccccc1\C=C1/CN(CC2(C(C(NC22C(=O)Nc3ccccc23)c2ccccc2)c2ccccc2C)C1=O)C(=O)C=C InChI=1S/C39H35N3O3/c1-4-33(43)42-23-29(22-28-18-10-8-14-25(28)2)36(44)38(24-42)34(30-19-11-9-15-26(30)3)35(27-16-6-5-7-17-27)41-39(38)31-20-12-13-21-32(31)40-37(39)45/h4-22,34-35,41H,1,23-24H2,2-3H3,(H,40,45)/b29-22+ GZHWOWUNUOKQRR-QUPMIFSKSA-N 50008527 CHEMBL3235938 Cholinesterase 21780 ChEMBL 10.1016/j.bmcl.2014.02.019 10.7270/Q2S46TH2 24594354 Kia, Y; Osman, H; Suresh Kumar, R; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008527 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008527&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90655338 242057275 CHEMBL3235938 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50086589 COc1ccccc1\C=C1/CN(CC2(C(C(NC22C(=O)Nc3ccccc23)c2ccccc2)c2ccccc2OC)C1=O)C(=O)C=C InChI=1S/C39H35N3O5/c1-4-33(43)42-23-27(22-26-16-8-12-20-31(26)46-2)36(44)38(24-42)34(28-17-9-13-21-32(28)47-3)35(25-14-6-5-7-15-25)41-39(38)29-18-10-11-19-30(29)40-37(39)45/h4-22,34-35,41H,1,23-24H2,2-3H3,(H,40,45)/b27-22+ ZEHIRYNFPGYZQO-HPNDGRJYSA-N 50008528 CHEMBL3235939 Cholinesterase 17520 ChEMBL 10.1016/j.bmcl.2014.02.019 10.7270/Q2S46TH2 24594354 Kia, Y; Osman, H; Suresh Kumar, R; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008528 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008528&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90655339 242057276 CHEMBL3235939 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50086590 Clc1ccccc1\C=C1/CN(CC2(C(C(NC22C(=O)Nc3ccccc23)c2ccccc2)c2ccccc2Cl)C1=O)C(=O)C=C InChI=1S/C37H29Cl2N3O3/c1-2-31(43)42-21-25(20-24-14-6-9-17-28(24)38)34(44)36(22-42)32(26-15-7-10-18-29(26)39)33(23-12-4-3-5-13-23)41-37(36)27-16-8-11-19-30(27)40-35(37)45/h2-20,32-33,41H,1,21-22H2,(H,40,45)/b25-20+ JQSUUSZHKMMGBH-LKUDQCMESA-N 50008529 CHEMBL3235940 Cholinesterase 22190 ChEMBL 10.1016/j.bmcl.2014.02.019 10.7270/Q2S46TH2 24594354 Kia, Y; Osman, H; Suresh Kumar, R; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008529 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008529&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90655340 242057277 CHEMBL3235940 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50086591 Fc1ccccc1\C=C1/CN(CC2(C(C(NC22C(=O)Nc3ccccc23)c2ccccc2)c2ccccc2F)C1=O)C(=O)C=C InChI=1S/C37H29F2N3O3/c1-2-31(43)42-21-25(20-24-14-6-9-17-28(24)38)34(44)36(22-42)32(26-15-7-10-18-29(26)39)33(23-12-4-3-5-13-23)41-37(36)27-16-8-11-19-30(27)40-35(37)45/h2-20,32-33,41H,1,21-22H2,(H,40,45)/b25-20+ WKRARQQHTGIAMB-LKUDQCMESA-N 50008530 CHEMBL3235941 Cholinesterase 11760 ChEMBL 10.1016/j.bmcl.2014.02.019 10.7270/Q2S46TH2 24594354 Kia, Y; Osman, H; Suresh Kumar, R; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008530 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008530&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90655341 242057278 CHEMBL3235941 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50086592 [O-][N+](=O)c1cccc(\C=C2/CN(CC3(C(C(NC33C(=O)Nc4ccccc34)c3ccccc3)c3cccc(c3)[N+]([O-])=O)C2=O)C(=O)C=C)c1 InChI=1S/C37H29N5O7/c1-2-31(43)40-21-26(18-23-10-8-14-27(19-23)41(46)47)34(44)36(22-40)32(25-13-9-15-28(20-25)42(48)49)33(24-11-4-3-5-12-24)39-37(36)29-16-6-7-17-30(29)38-35(37)45/h2-20,32-33,39H,1,21-22H2,(H,38,45)/b26-18+ DDTRRIBPIFQHCW-NLRVBDNBSA-N 50008531 CHEMBL3235942 Cholinesterase 10610 ChEMBL 10.1016/j.bmcl.2014.02.019 10.7270/Q2S46TH2 24594354 Kia, Y; Osman, H; Suresh Kumar, R; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008531 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008531&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90655342 242057279 CHEMBL3235942 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50086593 Clc1ccc(\C=C2/CN(CC3(C(C(NC33C(=O)Nc4ccccc34)c3ccccc3)c3ccc(Cl)cc3Cl)C2=O)C(=O)C=C)c(Cl)c1 InChI=1S/C37H27Cl4N3O3/c1-2-31(45)44-19-23(16-22-12-13-24(38)17-28(22)40)34(46)36(20-44)32(26-15-14-25(39)18-29(26)41)33(21-8-4-3-5-9-21)43-37(36)27-10-6-7-11-30(27)42-35(37)47/h2-18,32-33,43H,1,19-20H2,(H,42,47)/b23-16+ ANQOWMBQGIMWKJ-XQNSMLJCSA-N 50008532 CHEMBL3235943 Cholinesterase 27120 ChEMBL 10.1016/j.bmcl.2014.02.019 10.7270/Q2S46TH2 24594354 Kia, Y; Osman, H; Suresh Kumar, R; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008532 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008532&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90655343 242057280 CHEMBL3235943 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50086594 Cc1ccc(\C=C2/CN(CC3(C(C(NC33C(=O)Nc4ccccc34)c3ccccc3)c3ccc(C)cc3)C2=O)C(=O)C=C)cc1 InChI=1S/C39H35N3O3/c1-4-33(43)42-23-30(22-27-18-14-25(2)15-19-27)36(44)38(24-42)34(28-20-16-26(3)17-21-28)35(29-10-6-5-7-11-29)41-39(38)31-12-8-9-13-32(31)40-37(39)45/h4-22,34-35,41H,1,23-24H2,2-3H3,(H,40,45)/b30-22+ MSMAJQJDHZWCFA-JBASAIQMSA-N 50008533 CHEMBL3235944 Cholinesterase 5870 ChEMBL 10.1016/j.bmcl.2014.02.019 10.7270/Q2S46TH2 24594354 Kia, Y; Osman, H; Suresh Kumar, R; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008533 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008533&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90655344 242057281 CHEMBL3235944 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50086595 Clc1ccc(\C=C2/CN(CC3(C(C(NC33C(=O)Nc4ccccc34)c3ccccc3)c3ccc(Cl)cc3)C2=O)C(=O)C=C)cc1 InChI=1S/C37H29Cl2N3O3/c1-2-31(43)42-21-26(20-23-12-16-27(38)17-13-23)34(44)36(22-42)32(24-14-18-28(39)19-15-24)33(25-8-4-3-5-9-25)41-37(36)29-10-6-7-11-30(29)40-35(37)45/h2-20,32-33,41H,1,21-22H2,(H,40,45)/b26-20+ DXSGFFLMHZSWHH-LHLOQNFPSA-N 50008534 CHEMBL3235945 Cholinesterase 8750 ChEMBL 10.1016/j.bmcl.2014.02.019 10.7270/Q2S46TH2 24594354 Kia, Y; Osman, H; Suresh Kumar, R; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008534 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008534&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90655345 242057282 CHEMBL3235945 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50086596 Fc1ccc(\C=C2/CN(CC3(C(C(NC33C(=O)Nc4ccccc34)c3ccccc3)c3ccc(F)cc3)C2=O)C(=O)C=C)cc1 InChI=1S/C37H29F2N3O3/c1-2-31(43)42-21-26(20-23-12-16-27(38)17-13-23)34(44)36(22-42)32(24-14-18-28(39)19-15-24)33(25-8-4-3-5-9-25)41-37(36)29-10-6-7-11-30(29)40-35(37)45/h2-20,32-33,41H,1,21-22H2,(H,40,45)/b26-20+ FPZCWCYCRZUEPX-LHLOQNFPSA-N 50008674 CHEMBL3235946 Cholinesterase 2750 ChEMBL 10.1016/j.bmcl.2014.02.019 10.7270/Q2S46TH2 24594354 Kia, Y; Osman, H; Suresh Kumar, R; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008674 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008674&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90655346 103921805 CHEMBL3235946 ZINC36273184 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50086597 C=CC(=O)N1C\C(=C/c2cccc3ccccc23)C(=O)C2(C1)C(C(NC21C(=O)Nc2ccccc12)c1ccccc1)c1cccc2ccccc12 InChI=1S/C45H35N3O3/c1-2-39(49)48-27-33(26-32-20-12-18-29-14-6-8-21-34(29)32)42(50)44(28-48)40(36-23-13-19-30-15-7-9-22-35(30)36)41(31-16-4-3-5-17-31)47-45(44)37-24-10-11-25-38(37)46-43(45)51/h2-26,40-41,47H,1,27-28H2,(H,46,51)/b33-26+ KTHVQFJATFNEQU-MHTZHOPKSA-N 50008675 CHEMBL3235947 Cholinesterase 13770 ChEMBL 10.1016/j.bmcl.2014.02.019 10.7270/Q2S46TH2 24594354 Kia, Y; Osman, H; Suresh Kumar, R; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008675 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008675&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90655347 103921806 CHEMBL3235947 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50086598 O=C(C1CC(NC11C(=O)Nc2ccccc12)c1ccccc1)N1C\C(=C/c2ccccc2)C(=O)C2(C1)C(C(NC21C(=O)Nc2ccccc12)c1ccccc1)c1ccccc1 InChI=1S/C52H43N5O4/c58-46-37(29-33-17-5-1-6-18-33)31-57(47(59)40-30-43(34-19-7-2-8-20-34)55-51(40)38-25-13-15-27-41(38)53-48(51)60)32-50(46)44(35-21-9-3-10-22-35)45(36-23-11-4-12-24-36)56-52(50)39-26-14-16-28-42(39)54-49(52)61/h1-29,40,43-45,55-56H,30-32H2,(H,53,60)(H,54,61)/b37-29+ UGWIFDJHTAMVLO-SMTCOIIISA-N 50008676 CHEMBL3235948 Cholinesterase 26300 ChEMBL 10.1016/j.bmcl.2014.02.019 10.7270/Q2S46TH2 24594354 Kia, Y; Osman, H; Suresh Kumar, R; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008676 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008676&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90655348 103921807 CHEMBL3235948 ZINC36273177 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50086599 Cc1ccccc1\C=C1/CN(CC2(C(C(NC22C(=O)Nc3ccccc23)c2ccccc2)c2ccccc2C)C1=O)C(=O)C1CC(NC11C(=O)Nc2ccccc12)c1ccccc1 InChI=1S/C54H47N5O4/c1-33-17-9-11-23-37(33)29-38-31-59(49(61)42-30-45(35-19-5-3-6-20-35)57-53(42)40-25-13-15-27-43(40)55-50(53)62)32-52(48(38)60)46(39-24-12-10-18-34(39)2)47(36-21-7-4-8-22-36)58-54(52)41-26-14-16-28-44(41)56-51(54)63/h3-29,42,45-47,57-58H,30-32H2,1-2H3,(H,55,62)(H,56,63)/b38-29+ AYADTTYOFUSCDL-DMFHDPHMSA-N 50008677 CHEMBL3235949 Cholinesterase 29070 ChEMBL 10.1016/j.bmcl.2014.02.019 10.7270/Q2S46TH2 24594354 Kia, Y; Osman, H; Suresh Kumar, R; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008677 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008677&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90655349 103921808 CHEMBL3235949 ZINC36273180 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50086600 COc1ccccc1\C=C1/CN(CC2(C(C(NC22C(=O)Nc3ccccc23)c2ccccc2)c2ccccc2OC)C1=O)C(=O)C1CC(NC11C(=O)Nc2ccccc12)c1ccccc1 InChI=1S/C54H47N5O6/c1-64-44-27-15-9-21-35(44)29-36-31-59(49(61)40-30-43(33-17-5-3-6-18-33)57-53(40)38-23-11-13-25-41(38)55-50(53)62)32-52(48(36)60)46(37-22-10-16-28-45(37)65-2)47(34-19-7-4-8-20-34)58-54(52)39-24-12-14-26-42(39)56-51(54)63/h3-29,40,43,46-47,57-58H,30-32H2,1-2H3,(H,55,62)(H,56,63)/b36-29+ MCNQVYIDZMVRIJ-ZONNCAFXSA-N 50008678 CHEMBL3235950 Cholinesterase 32120 ChEMBL 10.1016/j.bmcl.2014.02.019 10.7270/Q2S46TH2 24594354 Kia, Y; Osman, H; Suresh Kumar, R; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008678 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008678&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90655350 103921809 CHEMBL3235950 ZINC14952306 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50086601 Clc1ccccc1\C=C1/CN(CC2(C(C(NC22C(=O)Nc3ccccc23)c2ccccc2)c2ccccc2Cl)C1=O)C(=O)C1CC(NC11C(=O)Nc2ccccc12)c1ccccc1 InChI=1S/C52H41Cl2N5O4/c53-39-23-11-7-19-33(39)27-34-29-59(47(61)38-28-43(31-15-3-1-4-16-31)57-51(38)36-21-9-13-25-41(36)55-48(51)62)30-50(46(34)60)44(35-20-8-12-24-40(35)54)45(32-17-5-2-6-18-32)58-52(50)37-22-10-14-26-42(37)56-49(52)63/h1-27,38,43-45,57-58H,28-30H2,(H,55,62)(H,56,63)/b34-27+ STPXXOQSUOETSH-DNGXXSEMSA-N 50008682 CHEMBL3235951 Cholinesterase 17630 ChEMBL 10.1016/j.bmcl.2014.02.019 10.7270/Q2S46TH2 24594354 Kia, Y; Osman, H; Suresh Kumar, R; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90655351 103921813 CHEMBL3235951 ZINC96178785 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50086602 Fc1ccccc1\C=C1/CN(CC2(C(C(NC22C(=O)Nc3ccccc23)c2ccccc2)c2ccccc2F)C1=O)C(=O)C1CC(NC11C(=O)Nc2ccccc12)c1ccccc1 InChI=1S/C52H41F2N5O4/c53-39-23-11-7-19-33(39)27-34-29-59(47(61)38-28-43(31-15-3-1-4-16-31)57-51(38)36-21-9-13-25-41(36)55-48(51)62)30-50(46(34)60)44(35-20-8-12-24-40(35)54)45(32-17-5-2-6-18-32)58-52(50)37-22-10-14-26-42(37)56-49(52)63/h1-27,38,43-45,57-58H,28-30H2,(H,55,62)(H,56,63)/b34-27+ AZVZGCOKTVXECR-DNGXXSEMSA-N 50008683 CHEMBL3235952 Cholinesterase 35860 ChEMBL 10.1016/j.bmcl.2014.02.019 10.7270/Q2S46TH2 24594354 Kia, Y; Osman, H; Suresh Kumar, R; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008683 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008683&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90655352 103921814 CHEMBL3235952 ZINC96178787 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50086603 [O-][N+](=O)c1cccc(\C=C2/CN(CC3(C(C(NC33C(=O)Nc4ccccc34)c3ccccc3)c3cccc(c3)[N+]([O-])=O)C2=O)C(=O)C2CC(NC22C(=O)Nc3ccccc23)c2ccccc2)c1 InChI=1S/C52H41N7O8/c60-46-35(25-31-13-11-19-36(26-31)58(64)65)29-57(47(61)40-28-43(32-14-3-1-4-15-32)55-51(40)38-21-7-9-23-41(38)53-48(51)62)30-50(46)44(34-18-12-20-37(27-34)59(66)67)45(33-16-5-2-6-17-33)56-52(50)39-22-8-10-24-42(39)54-49(52)63/h1-27,40,43-45,55-56H,28-30H2,(H,53,62)(H,54,63)/b35-25+ RHRYTRGQUDIGNO-KVQDIILNSA-N 50008686 CHEMBL3235953 Cholinesterase 17630 ChEMBL 10.1016/j.bmcl.2014.02.019 10.7270/Q2S46TH2 24594354 Kia, Y; Osman, H; Suresh Kumar, R; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008686 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008686&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90655353 103921817 CHEMBL3235953 ZINC19796050 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50086604 Clc1ccc(\C=C2/CN(CC3(C(C(NC33C(=O)Nc4ccccc34)c3ccccc3)c3ccc(Cl)cc3Cl)C2=O)C(=O)C2CC(NC22C(=O)Nc3ccccc23)c2ccccc2)c(Cl)c1 InChI=1S/C52H39Cl4N5O4/c53-33-20-19-31(39(55)24-33)23-32-27-61(47(63)38-26-43(29-11-3-1-4-12-29)59-51(38)36-15-7-9-17-41(36)57-48(51)64)28-50(46(32)62)44(35-22-21-34(54)25-40(35)56)45(30-13-5-2-6-14-30)60-52(50)37-16-8-10-18-42(37)58-49(52)65/h1-25,38,43-45,59-60H,26-28H2,(H,57,64)(H,58,65)/b32-23+ PJKINVIECVJFHX-AWSUPERCSA-N 50008690 CHEMBL3235954 Cholinesterase 26300 ChEMBL 10.1016/j.bmcl.2014.02.019 10.7270/Q2S46TH2 24594354 Kia, Y; Osman, H; Suresh Kumar, R; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008690 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008690&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90655354 242057283 CHEMBL3235954 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50086605 Cc1ccc(\C=C2/CN(CC3(C(C(NC33C(=O)Nc4ccccc34)c3ccccc3)c3ccc(C)cc3)C2=O)C(=O)C2CC(NC22C(=O)Nc3ccccc23)c2ccccc2)cc1 InChI=1S/C54H47N5O4/c1-33-21-25-35(26-22-33)29-39-31-59(49(61)42-30-45(36-13-5-3-6-14-36)57-53(42)40-17-9-11-19-43(40)55-50(53)62)32-52(48(39)60)46(37-27-23-34(2)24-28-37)47(38-15-7-4-8-16-38)58-54(52)41-18-10-12-20-44(41)56-51(54)63/h3-29,42,45-47,57-58H,30-32H2,1-2H3,(H,55,62)(H,56,63)/b39-29+ ZLBOAMOMRMHKAC-YWIBTEMISA-N 50008691 CHEMBL3235955 Cholinesterase 19810 ChEMBL 10.1016/j.bmcl.2014.02.019 10.7270/Q2S46TH2 24594354 Kia, Y; Osman, H; Suresh Kumar, R; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008691 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008691&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90655355 103921821 29067 CHEMBL3235955 ZINC13860820 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50086606 Clc1ccc(\C=C2/CN(CC3(C(C(NC33C(=O)Nc4ccccc34)c3ccccc3)c3ccc(Cl)cc3)C2=O)C(=O)C2CC(NC22C(=O)Nc3ccccc23)c2ccccc2)cc1 InChI=1S/C52H41Cl2N5O4/c53-36-23-19-31(20-24-36)27-35-29-59(47(61)40-28-43(32-11-3-1-4-12-32)57-51(40)38-15-7-9-17-41(38)55-48(51)62)30-50(46(35)60)44(33-21-25-37(54)26-22-33)45(34-13-5-2-6-14-34)58-52(50)39-16-8-10-18-42(39)56-49(52)63/h1-27,40,43-45,57-58H,28-30H2,(H,55,62)(H,56,63)/b35-27+ HJVFNWKBWKSMHE-ROMHNNFLSA-N 50008693 CHEMBL3235956 Cholinesterase 27810 ChEMBL 10.1016/j.bmcl.2014.02.019 10.7270/Q2S46TH2 24594354 Kia, Y; Osman, H; Suresh Kumar, R; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008693 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008693&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90655356 103921823 29067 CHEMBL3235956 ZINC19850502 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50086607 Fc1ccc(\C=C2/CN(CC3(C(C(NC33C(=O)Nc4ccccc34)c3ccccc3)c3ccc(F)cc3)C2=O)C(=O)C2CC(NC22C(=O)Nc3ccccc23)c2ccccc2)cc1 InChI=1S/C52H41F2N5O4/c53-36-23-19-31(20-24-36)27-35-29-59(47(61)40-28-43(32-11-3-1-4-12-32)57-51(40)38-15-7-9-17-41(38)55-48(51)62)30-50(46(35)60)44(33-21-25-37(54)26-22-33)45(34-13-5-2-6-14-34)58-52(50)39-16-8-10-18-42(39)56-49(52)63/h1-27,40,43-45,57-58H,28-30H2,(H,55,62)(H,56,63)/b35-27+ AYFLZIUKYLFHRJ-ROMHNNFLSA-N 50008694 CHEMBL3235957 Cholinesterase 14420 ChEMBL 10.1016/j.bmcl.2014.02.019 10.7270/Q2S46TH2 24594354 Kia, Y; Osman, H; Suresh Kumar, R; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008694 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008694&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90655357 103921824 CHEMBL3235957 ZINC13860956 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50086608 O=C(C1CC(NC11C(=O)Nc2ccccc12)c1ccccc1)N1C\C(=C/c2cccc3ccccc23)C(=O)C2(C1)C(C(NC21C(=O)Nc2ccccc12)c1ccccc1)c1cccc2ccccc12 InChI=1S/C60H47N5O4/c66-54-42(33-41-25-15-23-37-17-7-9-26-43(37)41)35-65(55(67)48-34-51(39-19-3-1-4-20-39)63-59(48)46-29-11-13-31-49(46)61-56(59)68)36-58(54)52(45-28-16-24-38-18-8-10-27-44(38)45)53(40-21-5-2-6-22-40)64-60(58)47-30-12-14-32-50(47)62-57(60)69/h1-33,48,51-53,63-64H,34-36H2,(H,61,68)(H,62,69)/b42-33+ JYQQDFZGMIWZQV-JBXJJHIASA-N 50008695 CHEMBL3235958 Cholinesterase 19220 ChEMBL 10.1016/j.bmcl.2014.02.019 10.7270/Q2S46TH2 24594354 Kia, Y; Osman, H; Suresh Kumar, R; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50008695 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50008695&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90655358 103921825 CHEMBL3235958 ZINC12356142 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50086609 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 19340 ChEMBL 10.1016/j.bmcl.2014.02.019 10.7270/Q2S46TH2 24594354 Kia, Y; Osman, H; Suresh Kumar, R; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094312 COc1cc2CCNC(Cc3ccc(OCCCCCCN4CCC(O)CC4)cc3)c2cc1OC InChI=1S/C29H42N2O4/c1-33-28-20-23-11-14-30-27(26(23)21-29(28)34-2)19-22-7-9-25(10-8-22)35-18-6-4-3-5-15-31-16-12-24(32)13-17-31/h7-10,20-21,24,27,30,32H,3-6,11-19H2,1-2H3 SWHJODKSCKXUAX-UHFFFAOYSA-N 50013276 CHEMBL3262668 Cholinesterase 14160 ChEMBL 10.1016/j.bmcl.2014.03.058 10.7270/Q2F47QPB 24726809 Xu, ZC; Wang, XB; Yu, WY; Xie, SS; Li, SY; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013276 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013276&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90656307 103925491 CHEMBL3262668 ZINC27633198 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094316 COc1cc2CCNC(Cc3ccc(OCCCCCCN4CCOCC4)cc3)c2cc1OC InChI=1S/C28H40N2O4/c1-31-27-20-23-11-12-29-26(25(23)21-28(27)32-2)19-22-7-9-24(10-8-22)34-16-6-4-3-5-13-30-14-17-33-18-15-30/h7-10,20-21,26,29H,3-6,11-19H2,1-2H3 CGEXLUGJCRHUDI-UHFFFAOYSA-N 50013277 CHEMBL3262669 Cholinesterase 13010 ChEMBL 10.1016/j.bmcl.2014.03.058 10.7270/Q2F47QPB 24726809 Xu, ZC; Wang, XB; Yu, WY; Xie, SS; Li, SY; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013277 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013277&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90656308 103925492 CHEMBL3262669 ZINC27630651 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094317 COc1cc2CCNC(Cc3ccc(OCCCCCCN4CCC(O)(Cc5ccccc5)CC4)cc3)c2cc1OC InChI=1S/C36H48N2O4/c1-40-34-25-30-16-19-37-33(32(30)26-35(34)41-2)24-28-12-14-31(15-13-28)42-23-9-4-3-8-20-38-21-17-36(39,18-22-38)27-29-10-6-5-7-11-29/h5-7,10-15,25-26,33,37,39H,3-4,8-9,16-24,27H2,1-2H3 MQRDMBHMFXHDQV-UHFFFAOYSA-N 50013281 CHEMBL3262670 Cholinesterase 12830 ChEMBL 10.1016/j.bmcl.2014.03.058 10.7270/Q2F47QPB 24726809 Xu, ZC; Wang, XB; Yu, WY; Xie, SS; Li, SY; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013281 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013281&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90656309 103925496 CHEMBL3262670 ZINC27633983 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094321 COc1cc2CCNC(Cc3ccc(OCCCCCCN4CCN(CC4)c4ccccc4)cc3)c2cc1OC InChI=1S/C34H45N3O3/c1-38-33-25-28-16-17-35-32(31(28)26-34(33)39-2)24-27-12-14-30(15-13-27)40-23-9-4-3-8-18-36-19-21-37(22-20-36)29-10-6-5-7-11-29/h5-7,10-15,25-26,32,35H,3-4,8-9,16-24H2,1-2H3 MJOOYKDRCXTTQQ-UHFFFAOYSA-N 50013282 CHEMBL3262671 Cholinesterase 8780 ChEMBL 10.1016/j.bmcl.2014.03.058 10.7270/Q2F47QPB 24726809 Xu, ZC; Wang, XB; Yu, WY; Xie, SS; Li, SY; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013282 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013282&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90656310 103925497 CHEMBL3262671 ZINC27630632 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094327 COc1cc2CCNC(Cc3ccc(OCCCCCCN4CCN(Cc5ccccc5)CC4)cc3)c2cc1OC InChI=1S/C35H47N3O3/c1-39-34-25-30-16-17-36-33(32(30)26-35(34)40-2)24-28-12-14-31(15-13-28)41-23-9-4-3-8-18-37-19-21-38(22-20-37)27-29-10-6-5-7-11-29/h5-7,10-15,25-26,33,36H,3-4,8-9,16-24,27H2,1-2H3 IRDZLYUVTZHASS-UHFFFAOYSA-N 50013283 CHEMBL3262672 Cholinesterase 10530 ChEMBL 10.1016/j.bmcl.2014.03.058 10.7270/Q2F47QPB 24726809 Xu, ZC; Wang, XB; Yu, WY; Xie, SS; Li, SY; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013283 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013283&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90656311 103925498 CHEMBL3262672 ZINC27631267 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094328 COc1cc2CCNC(Cc3ccc(OCCCCCCN4CCC(CC4)c4ccccc4)cc3)c2cc1OC InChI=1S/C35H46N2O3/c1-38-34-25-30-16-19-36-33(32(30)26-35(34)39-2)24-27-12-14-31(15-13-27)40-23-9-4-3-8-20-37-21-17-29(18-22-37)28-10-6-5-7-11-28/h5-7,10-15,25-26,29,33,36H,3-4,8-9,16-24H2,1-2H3 ZZODKRWBFJJHGV-UHFFFAOYSA-N 50013285 CHEMBL3262673 Cholinesterase 7990 ChEMBL 10.1016/j.bmcl.2014.03.058 10.7270/Q2F47QPB 24726809 Xu, ZC; Wang, XB; Yu, WY; Xie, SS; Li, SY; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013285 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013285&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90656312 103925500 CHEMBL3262673 ZINC27629939 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094329 COc1cc2CCNC(Cc3ccc(O)cc3)c2cc1OC InChI=1S/C18H21NO3/c1-21-17-10-13-7-8-19-16(15(13)11-18(17)22-2)9-12-3-5-14(20)6-4-12/h3-6,10-11,16,19-20H,7-9H2,1-2H3 NKBBUUNAVOMVER-UHFFFAOYSA-N 50013286 CHEMBL510363::DL-N-Norarmepavine Cholinesterase 39700 ChEMBL 10.1016/j.bmcl.2014.03.058 10.7270/Q2F47QPB 24726809 Xu, ZC; Wang, XB; Yu, WY; Xie, SS; Li, SY; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013286 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013286&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 317405 103925501 CHEMBL510363 ZINC27635726 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094330 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 12700 ChEMBL 10.1016/j.bmcl.2014.03.058 10.7270/Q2F47QPB 24726809 Xu, ZC; Wang, XB; Yu, WY; Xie, SS; Li, SY; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094421 CCN(CC)CCCOc1ccc(CC2NCCc3cc(OC)c(OC)cc23)cc1 InChI=1S/C25H36N2O3/c1-5-27(6-2)14-7-15-30-21-10-8-19(9-11-21)16-23-22-18-25(29-4)24(28-3)17-20(22)12-13-26-23/h8-11,17-18,23,26H,5-7,12-16H2,1-4H3 VDJWQPUIGRSGSM-UHFFFAOYSA-N 50013296 CHEMBL3262655 Cholinesterase 20810 ChEMBL 10.1016/j.bmcl.2014.03.058 10.7270/Q2F47QPB 24726809 Xu, ZC; Wang, XB; Yu, WY; Xie, SS; Li, SY; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013296 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013296&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90656320 103925511 CHEMBL3262655 ZINC27635199 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094422 CCN(CC)CCCCOc1ccc(CC2NCCc3cc(OC)c(OC)cc23)cc1 InChI=1S/C26H38N2O3/c1-5-28(6-2)15-7-8-16-31-22-11-9-20(10-12-22)17-24-23-19-26(30-4)25(29-3)18-21(23)13-14-27-24/h9-12,18-19,24,27H,5-8,13-17H2,1-4H3 OAKAYEJFOALZCQ-UHFFFAOYSA-N 50013298 CHEMBL3262656 Cholinesterase 15290 ChEMBL 10.1016/j.bmcl.2014.03.058 10.7270/Q2F47QPB 24726809 Xu, ZC; Wang, XB; Yu, WY; Xie, SS; Li, SY; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013298 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013298&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90656321 103925513 CHEMBL3262656 ZINC27628454 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094423 CCN(CC)CCCCCOc1ccc(CC2NCCc3cc(OC)c(OC)cc23)cc1 InChI=1S/C27H40N2O3/c1-5-29(6-2)16-8-7-9-17-32-23-12-10-21(11-13-23)18-25-24-20-27(31-4)26(30-3)19-22(24)14-15-28-25/h10-13,19-20,25,28H,5-9,14-18H2,1-4H3 YDCKXZGCHIHWFC-UHFFFAOYSA-N 50013300 CHEMBL3262657 Cholinesterase 10280 ChEMBL 10.1016/j.bmcl.2014.03.058 10.7270/Q2F47QPB 24726809 Xu, ZC; Wang, XB; Yu, WY; Xie, SS; Li, SY; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013300 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013300&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90656322 103925515 CHEMBL3262657 ZINC27630451 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094424 CCN(CC)CCCCCCOc1ccc(CC2NCCc3cc(OC)c(OC)cc23)cc1 InChI=1S/C28H42N2O3/c1-5-30(6-2)17-9-7-8-10-18-33-24-13-11-22(12-14-24)19-26-25-21-28(32-4)27(31-3)20-23(25)15-16-29-26/h11-14,20-21,26,29H,5-10,15-19H2,1-4H3 BPECKLWRCAONGX-UHFFFAOYSA-N 50013287 CHEMBL3262658 Cholinesterase 4950 ChEMBL 10.1016/j.bmcl.2014.03.058 10.7270/Q2F47QPB 24726809 Xu, ZC; Wang, XB; Yu, WY; Xie, SS; Li, SY; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013287 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013287&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90656313 103925502 CHEMBL3262658 ZINC27628449 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094425 CCN(CC)CCCCCCCOc1ccc(CC2NCCc3cc(OC)c(OC)cc23)cc1 InChI=1S/C29H44N2O3/c1-5-31(6-2)18-10-8-7-9-11-19-34-25-14-12-23(13-15-25)20-27-26-22-29(33-4)28(32-3)21-24(26)16-17-30-27/h12-15,21-22,27,30H,5-11,16-20H2,1-4H3 IBNUPQRPYIGIJX-UHFFFAOYSA-N 50013301 CHEMBL3262659 Cholinesterase 9130 ChEMBL 10.1016/j.bmcl.2014.03.058 10.7270/Q2F47QPB 24726809 Xu, ZC; Wang, XB; Yu, WY; Xie, SS; Li, SY; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013301 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013301&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90656323 103925516 CHEMBL3262659 ZINC27632586 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094427 CCN(CC)CCCCCCCCOc1ccc(CC2NCCc3cc(OC)c(OC)cc23)cc1 InChI=1S/C30H46N2O3/c1-5-32(6-2)19-11-9-7-8-10-12-20-35-26-15-13-24(14-16-26)21-28-27-23-30(34-4)29(33-3)22-25(27)17-18-31-28/h13-16,22-23,28,31H,5-12,17-21H2,1-4H3 RGPQRACGWSQAQV-UHFFFAOYSA-N 50013303 CHEMBL3262660 Cholinesterase 20060 ChEMBL 10.1016/j.bmcl.2014.03.058 10.7270/Q2F47QPB 24726809 Xu, ZC; Wang, XB; Yu, WY; Xie, SS; Li, SY; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013303 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013303&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90656324 103925518 CHEMBL3262660 ZINC27633331 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094428 COc1cc2CCNC(Cc3ccc(OCCCCCCN(C)C)cc3)c2cc1OC InChI=1S/C26H38N2O3/c1-28(2)15-7-5-6-8-16-31-22-11-9-20(10-12-22)17-24-23-19-26(30-4)25(29-3)18-21(23)13-14-27-24/h9-12,18-19,24,27H,5-8,13-17H2,1-4H3 BYRLMUHGBXCVOH-UHFFFAOYSA-N 50013288 CHEMBL3262661 Cholinesterase 8650 ChEMBL 10.1016/j.bmcl.2014.03.058 10.7270/Q2F47QPB 24726809 Xu, ZC; Wang, XB; Yu, WY; Xie, SS; Li, SY; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013288 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013288&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90656314 103925503 CHEMBL3262661 ZINC27631789 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094429 CCCN(CCC)CCCCCCOc1ccc(CC2NCCc3cc(OC)c(OC)cc23)cc1 InChI=1S/C30H46N2O3/c1-5-17-32(18-6-2)19-9-7-8-10-20-35-26-13-11-24(12-14-26)21-28-27-23-30(34-4)29(33-3)22-25(27)15-16-31-28/h11-14,22-23,28,31H,5-10,15-21H2,1-4H3 QRPYZNBZKALWQQ-UHFFFAOYSA-N 50013289 CHEMBL3262662 Cholinesterase 4320 ChEMBL 10.1016/j.bmcl.2014.03.058 10.7270/Q2F47QPB 24726809 Xu, ZC; Wang, XB; Yu, WY; Xie, SS; Li, SY; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013289 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013289&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90656315 103925504 CHEMBL3262662 ZINC27634460 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094431 CCCCN(CCCC)CCCCCCOc1ccc(CC2NCCc3cc(OC)c(OC)cc23)cc1 InChI=1S/C32H50N2O3/c1-5-7-19-34(20-8-6-2)21-11-9-10-12-22-37-28-15-13-26(14-16-28)23-30-29-25-32(36-4)31(35-3)24-27(29)17-18-33-30/h13-16,24-25,30,33H,5-12,17-23H2,1-4H3 FQFUKTCPJFQACE-UHFFFAOYSA-N 50013290 CHEMBL3262663 Cholinesterase 3460 ChEMBL 10.1016/j.bmcl.2014.03.058 10.7270/Q2F47QPB 24726809 Xu, ZC; Wang, XB; Yu, WY; Xie, SS; Li, SY; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013290 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013290&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90656316 103925505 CHEMBL3262663 ZINC27629194 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094432 COc1cc2CCNC(Cc3ccc(OCCCCCCN4CCCC4C)cc3)c2cc1OC InChI=1S/C29H42N2O3/c1-22-9-8-17-31(22)16-6-4-5-7-18-34-25-12-10-23(11-13-25)19-27-26-21-29(33-3)28(32-2)20-24(26)14-15-30-27/h10-13,20-22,27,30H,4-9,14-19H2,1-3H3 AGSNRWKROFLBLI-UHFFFAOYSA-N 50013291 CHEMBL3262664 Cholinesterase 3350 ChEMBL 10.1016/j.bmcl.2014.03.058 10.7270/Q2F47QPB 24726809 Xu, ZC; Wang, XB; Yu, WY; Xie, SS; Li, SY; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013291 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013291&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90656317 103925506 CHEMBL3262664 ZINC27630617 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094433 COc1cc2CCNC(Cc3ccc(OCCCCCCN4CCCCC4C)cc3)c2cc1OC InChI=1S/C30H44N2O3/c1-23-10-6-8-18-32(23)17-7-4-5-9-19-35-26-13-11-24(12-14-26)20-28-27-22-30(34-3)29(33-2)21-25(27)15-16-31-28/h11-14,21-23,28,31H,4-10,15-20H2,1-3H3 FINWRTHNMLWWST-UHFFFAOYSA-N 50013292 CHEMBL3262665 Cholinesterase 3130 ChEMBL 10.1016/j.bmcl.2014.03.058 10.7270/Q2F47QPB 24726809 Xu, ZC; Wang, XB; Yu, WY; Xie, SS; Li, SY; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013292 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013292&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 86294786 103925507 CHEMBL3262665 ZINC27634063 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094434 COc1cc2CCNC(Cc3ccc(OCCCCCCN4CCCCC4)cc3)c2cc1OC InChI=1S/C29H42N2O3/c1-32-28-21-24-14-15-30-27(26(24)22-29(28)33-2)20-23-10-12-25(13-11-23)34-19-9-4-3-6-16-31-17-7-5-8-18-31/h10-13,21-22,27,30H,3-9,14-20H2,1-2H3 XIKIQDHFFVIHEZ-UHFFFAOYSA-N 50013294 CHEMBL3262666 Cholinesterase 2510 ChEMBL 10.1016/j.bmcl.2014.03.058 10.7270/Q2F47QPB 24726809 Xu, ZC; Wang, XB; Yu, WY; Xie, SS; Li, SY; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013294 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013294&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90656318 103925509 CHEMBL3262666 ZINC27633307 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094435 COc1cc2CCNC(Cc3ccc(OCCCCCCN4CCCC4)cc3)c2cc1OC InChI=1S/C28H40N2O3/c1-31-27-20-23-13-14-29-26(25(23)21-28(27)32-2)19-22-9-11-24(12-10-22)33-18-8-4-3-5-15-30-16-6-7-17-30/h9-12,20-21,26,29H,3-8,13-19H2,1-2H3 QSASVTHZZTZXAN-UHFFFAOYSA-N 50013295 CHEMBL3262667 Cholinesterase 2340 ChEMBL 10.1016/j.bmcl.2014.03.058 10.7270/Q2F47QPB 24726809 Xu, ZC; Wang, XB; Yu, WY; Xie, SS; Li, SY; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013295 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013295&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90656319 103925510 CHEMBL3262667 ZINC27633704 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094578 Cl.CCN(C)C(=O)Oc1cccc2NCC(CCN(C)C)c12 InChI=1S/C16H25N3O2.ClH/c1-5-19(4)16(20)21-14-8-6-7-13-15(14)12(11-17-13)9-10-18(2)3;/h6-8,12,17H,5,9-11H2,1-4H3;1H BNGVJGNSCMFUAE-UHFFFAOYSA-N 50013328 CHEMBL3263347 Cholinesterase 310 ChEMBL 10.1016/j.bmcl.2014.03.081 10.7270/Q21V5GHZ 24731278 Furman, S; Nissim-Bardugo, E; Zeeli, S; Weitman, M; Nudelman, A; Finkin-Groner, E; Moradov, D; Shifrin, H; Schorer-Apelbaum, D; Weinstock, M Bar-Ilan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013328 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013328&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90656344 103925543 CHEMBL3263347 ZINC27634117 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094590 Cl.CCN(C)C(=O)Oc1ccc2C(CCN(C)C)CNc2c1 InChI=1S/C16H25N3O2.ClH/c1-5-19(4)16(20)21-13-6-7-14-12(8-9-18(2)3)11-17-15(14)10-13;/h6-7,10,12,17H,5,8-9,11H2,1-4H3;1H QGTYGVHMQSCSKS-UHFFFAOYSA-N 50013331 CHEMBL3263348 Cholinesterase 2200 ChEMBL 10.1016/j.bmcl.2014.03.081 10.7270/Q21V5GHZ 24731278 Furman, S; Nissim-Bardugo, E; Zeeli, S; Weitman, M; Nudelman, A; Finkin-Groner, E; Moradov, D; Shifrin, H; Schorer-Apelbaum, D; Weinstock, M Bar-Ilan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013331 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013331&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90656345 103925546 CHEMBL3263348 ZINC27628608 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094592 Cl.CCN(C)C(=O)Oc1cccc2NCC(CCCN)c12 InChI=1S/C15H23N3O2.ClH/c1-3-18(2)15(19)20-13-8-4-7-12-14(13)11(10-17-12)6-5-9-16;/h4,7-8,11,17H,3,5-6,9-10,16H2,1-2H3;1H IXBWENUTJICSJU-UHFFFAOYSA-N 50013332 CHEMBL3263349 Cholinesterase 1200 ChEMBL 10.1016/j.bmcl.2014.03.081 10.7270/Q21V5GHZ 24731278 Furman, S; Nissim-Bardugo, E; Zeeli, S; Weitman, M; Nudelman, A; Finkin-Groner, E; Moradov, D; Shifrin, H; Schorer-Apelbaum, D; Weinstock, M Bar-Ilan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013332 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013332&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90656346 103925547 CHEMBL3263349 ZINC27634171 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094603 Cl.CCN(C)C(=O)Oc1ccc2C(CCCN)CNc2c1 InChI=1S/C15H23N3O2.ClH/c1-3-18(2)15(19)20-12-6-7-13-11(5-4-8-16)10-17-14(13)9-12;/h6-7,9,11,17H,3-5,8,10,16H2,1-2H3;1H RJNHWUOPQGPGII-UHFFFAOYSA-N 50013333 CHEMBL3263350 Cholinesterase 4700 ChEMBL 10.1016/j.bmcl.2014.03.081 10.7270/Q21V5GHZ 24731278 Furman, S; Nissim-Bardugo, E; Zeeli, S; Weitman, M; Nudelman, A; Finkin-Groner, E; Moradov, D; Shifrin, H; Schorer-Apelbaum, D; Weinstock, M Bar-Ilan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013333 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013333&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90656347 103925548 CHEMBL3263350 ZINC27631262 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094604 Cl.CCN(C)C(=O)Oc1cccc2N(CCCN(C)C)CCc12 InChI=1S/C17H27N3O2.ClH/c1-5-19(4)17(21)22-16-9-6-8-15-14(16)10-13-20(15)12-7-11-18(2)3;/h6,8-9H,5,7,10-13H2,1-4H3;1H GGBOCVUXKXADAF-UHFFFAOYSA-N 50013334 CHEMBL3263351 Cholinesterase 900 ChEMBL 10.1016/j.bmcl.2014.03.081 10.7270/Q21V5GHZ 24731278 Furman, S; Nissim-Bardugo, E; Zeeli, S; Weitman, M; Nudelman, A; Finkin-Groner, E; Moradov, D; Shifrin, H; Schorer-Apelbaum, D; Weinstock, M Bar-Ilan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013334 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013334&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90656348 103925549 CHEMBL3263351 ZINC27633710 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094605 Cl.CCN(C)C(=O)Oc1ccc2CCN(CCCN(C)C)c2c1 InChI=1S/C17H27N3O2.ClH/c1-5-19(4)17(21)22-15-8-7-14-9-12-20(16(14)13-15)11-6-10-18(2)3;/h7-8,13H,5-6,9-12H2,1-4H3;1H FZYHJHDWAGIGFD-UHFFFAOYSA-N 50013382 CHEMBL3263352 Cholinesterase 4270 ChEMBL 10.1016/j.bmcl.2014.03.081 10.7270/Q21V5GHZ 24731278 Furman, S; Nissim-Bardugo, E; Zeeli, S; Weitman, M; Nudelman, A; Finkin-Groner, E; Moradov, D; Shifrin, H; Schorer-Apelbaum, D; Weinstock, M Bar-Ilan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50013382 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50013382&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90656350 103925597 CHEMBL3263352 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094606 CCN(C)C(=O)Oc1cccc2N(CCC(=O)OC)CCc12 InChI=1S/C16H22N2O4/c1-4-17(2)16(20)22-14-7-5-6-13-12(14)8-10-18(13)11-9-15(19)21-3/h5-7H,4,8-11H2,1-3H3 LOMCJSSKKKRIAR-UHFFFAOYSA-N 50400027 CHEMBL2177716 Cholinesterase 700 ChEMBL 10.1016/j.bmcl.2014.03.081 10.7270/Q21V5GHZ 24731278 Furman, S; Nissim-Bardugo, E; Zeeli, S; Weitman, M; Nudelman, A; Finkin-Groner, E; Moradov, D; Shifrin, H; Schorer-Apelbaum, D; Weinstock, M Bar-Ilan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50400027 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50400027&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71462532 163349051 CHEMBL2177716 ZINC95564596 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094607 CCN(C)C(=O)Oc1ccc2CCN(CCC(=O)OC)c2c1 InChI=1S/C16H22N2O4/c1-4-17(2)16(20)22-13-6-5-12-7-9-18(14(12)11-13)10-8-15(19)21-3/h5-6,11H,4,7-10H2,1-3H3 KGRQRJIFKYCPEE-UHFFFAOYSA-N 50400025 CHEMBL2177718 Cholinesterase 6780 ChEMBL 10.1016/j.bmcl.2014.03.081 10.7270/Q21V5GHZ 24731278 Furman, S; Nissim-Bardugo, E; Zeeli, S; Weitman, M; Nudelman, A; Finkin-Groner, E; Moradov, D; Shifrin, H; Schorer-Apelbaum, D; Weinstock, M Bar-Ilan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50400025 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50400025&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71459017 163349049 CHEMBL2177718 ZINC95565822 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094608 CCN(C)C(=O)Oc1cccc2NCC(CCC(=O)OC)c12 InChI=1S/C16H22N2O4/c1-4-18(2)16(20)22-13-7-5-6-12-15(13)11(10-17-12)8-9-14(19)21-3/h5-7,11,17H,4,8-10H2,1-3H3 UUWXSGBUIOHFSY-UHFFFAOYSA-N 50400020 CHEMBL2181475 Cholinesterase 300 ChEMBL 10.1016/j.bmcl.2014.03.081 10.7270/Q21V5GHZ 24731278 Furman, S; Nissim-Bardugo, E; Zeeli, S; Weitman, M; Nudelman, A; Finkin-Groner, E; Moradov, D; Shifrin, H; Schorer-Apelbaum, D; Weinstock, M Bar-Ilan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50400020 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50400020&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71452098 163349044 CHEMBL2181475 ZINC95564658 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094609 CCN(C)C(=O)Oc1ccc2C(CCC(=O)OC)CNc2c1 InChI=1S/C16H22N2O4/c1-4-18(2)16(20)22-12-6-7-13-11(5-8-15(19)21-3)10-17-14(13)9-12/h6-7,9,11,17H,4-5,8,10H2,1-3H3 QPZNQFVYXDFCMK-UHFFFAOYSA-N 50400009 CHEMBL2177708 Cholinesterase 3900 ChEMBL 10.1016/j.bmcl.2014.03.081 10.7270/Q21V5GHZ 24731278 Furman, S; Nissim-Bardugo, E; Zeeli, S; Weitman, M; Nudelman, A; Finkin-Groner, E; Moradov, D; Shifrin, H; Schorer-Apelbaum, D; Weinstock, M Bar-Ilan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50400009 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50400009&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71461079 163349033 CHEMBL2177708 ZINC95564656 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50094610 CCN(C)C(=O)Oc1cccc2NCC(CCN)c12 InChI=1S/C14H21N3O2/c1-3-17(2)14(18)19-12-6-4-5-11-13(12)10(7-8-15)9-16-11/h4-6,10,16H,3,7-9,15H2,1-2H3 QZJFTHFKKFXEKX-UHFFFAOYSA-N 50400024 CHEMBL2177719 Cholinesterase 200 ChEMBL 10.1016/j.bmcl.2014.03.081 10.7270/Q21V5GHZ 24731278 Furman, S; Nissim-Bardugo, E; Zeeli, S; Weitman, M; Nudelman, A; Finkin-Groner, E; Moradov, D; Shifrin, H; Schorer-Apelbaum, D; Weinstock, M Bar-Ilan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50400024 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50400024&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71450003 163349048 CHEMBL2177719 ZINC95564599 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098599 COc1cc(NC(=O)C(CC(=O)c2ccc(cc2)C(C)C)n2ccnc2)cc(OC)c1 InChI=1S/C24H27N3O4/c1-16(2)17-5-7-18(8-6-17)23(28)14-22(27-10-9-25-15-27)24(29)26-19-11-20(30-3)13-21(12-19)31-4/h5-13,15-16,22H,14H2,1-4H3,(H,26,29) ULAXXHKOZFRTFZ-UHFFFAOYSA-N 50016379 CHEMBL3264322 Cholinesterase >20000 ChEMBL 10.1016/j.ejmech.2014.05.008 10.7270/Q2MC91KF 24836068 Vitorovic-Todorovic, MD; Koukoulitsa, C; Juranic, IO; Mandic, LM; Drakulic, BJ Ratka Resanovica1 http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016379 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016379&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643663 242041614 CHEMBL3264322 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098600 COc1cc(NC(=O)C(CC(=O)c2ccc(cc2)C(C)C)N2CCOCC2)cc(OC)c1 InChI=1S/C25H32N2O5/c1-17(2)18-5-7-19(8-6-18)24(28)16-23(27-9-11-32-12-10-27)25(29)26-20-13-21(30-3)15-22(14-20)31-4/h5-8,13-15,17,23H,9-12,16H2,1-4H3,(H,26,29) JEHXOVWZOPNFRZ-UHFFFAOYSA-N 50016380 CHEMBL3264323 Cholinesterase >20000 ChEMBL 10.1016/j.ejmech.2014.05.008 10.7270/Q2MC91KF 24836068 Vitorovic-Todorovic, MD; Koukoulitsa, C; Juranic, IO; Mandic, LM; Drakulic, BJ Ratka Resanovica1 http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016380 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016380&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643664 242041615 CHEMBL3264323 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098601 COc1cc(NC(=O)C(CC(=O)c2ccc(cc2)C(C)C)N2CCN(C)CC2)cc(OC)c1 InChI=1S/C26H35N3O4/c1-18(2)19-6-8-20(9-7-19)25(30)17-24(29-12-10-28(3)11-13-29)26(31)27-21-14-22(32-4)16-23(15-21)33-5/h6-9,14-16,18,24H,10-13,17H2,1-5H3,(H,27,31) RJODTGUKPWQRSI-UHFFFAOYSA-N 50016381 CHEMBL3264324 Cholinesterase >20000 ChEMBL 10.1016/j.ejmech.2014.05.008 10.7270/Q2MC91KF 24836068 Vitorovic-Todorovic, MD; Koukoulitsa, C; Juranic, IO; Mandic, LM; Drakulic, BJ Ratka Resanovica1 http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016381 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016381&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643665 242041616 CHEMBL3264324 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098602 CC(C)c1ccc(NC(=O)C(CC(=O)c2ccc(cc2)C(C)C)n2ccnc2)cc1 InChI=1S/C25H29N3O2/c1-17(2)19-5-7-21(8-6-19)24(29)15-23(28-14-13-26-16-28)25(30)27-22-11-9-20(10-12-22)18(3)4/h5-14,16-18,23H,15H2,1-4H3,(H,27,30) WSOREAIXILTVLC-UHFFFAOYSA-N 50016382 CHEMBL3264326 Cholinesterase >20000 ChEMBL 10.1016/j.ejmech.2014.05.008 10.7270/Q2MC91KF 24836068 Vitorovic-Todorovic, MD; Koukoulitsa, C; Juranic, IO; Mandic, LM; Drakulic, BJ Ratka Resanovica1 http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016382 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016382&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643666 242041617 CHEMBL3264326 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098603 CC(C)c1ccc(NC(=O)C(CC(=O)c2ccc(cc2)C(C)C)N2CCOCC2)cc1 InChI=1S/C26H34N2O3/c1-18(2)20-5-7-22(8-6-20)25(29)17-24(28-13-15-31-16-14-28)26(30)27-23-11-9-21(10-12-23)19(3)4/h5-12,18-19,24H,13-17H2,1-4H3,(H,27,30) ALRDRJOEABTWMB-UHFFFAOYSA-N 50016383 CHEMBL3264327 Cholinesterase >20000 ChEMBL 10.1016/j.ejmech.2014.05.008 10.7270/Q2MC91KF 24836068 Vitorovic-Todorovic, MD; Koukoulitsa, C; Juranic, IO; Mandic, LM; Drakulic, BJ Ratka Resanovica1 http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016383 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016383&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643667 242041618 CHEMBL3264327 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098604 COc1ccc(NC(=O)C(CC(=O)c2ccc(cc2C(C)C)C(C)C)N2CCCCC2)cc1OC InChI=1S/C29H40N2O4/c1-19(2)21-10-12-23(24(16-21)20(3)4)26(32)18-25(31-14-8-7-9-15-31)29(33)30-22-11-13-27(34-5)28(17-22)35-6/h10-13,16-17,19-20,25H,7-9,14-15,18H2,1-6H3,(H,30,33) BXPDPCVHWUNNAF-UHFFFAOYSA-N 50016384 CHEMBL3264333 Cholinesterase >7500 ChEMBL 10.1016/j.ejmech.2014.05.008 10.7270/Q2MC91KF 24836068 Vitorovic-Todorovic, MD; Koukoulitsa, C; Juranic, IO; Mandic, LM; Drakulic, BJ Ratka Resanovica1 http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016384 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016384&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643668 242041619 CHEMBL3264333 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098605 COc1ccc(NC(=O)C(CC(=O)c2ccc(cc2C(C)C)C(C)C)N2CCN(C)CC2)cc1OC InChI=1S/C29H41N3O4/c1-19(2)21-8-10-23(24(16-21)20(3)4)26(33)18-25(32-14-12-31(5)13-15-32)29(34)30-22-9-11-27(35-6)28(17-22)36-7/h8-11,16-17,19-20,25H,12-15,18H2,1-7H3,(H,30,34) DKPJEMUZJBYUEB-UHFFFAOYSA-N 50016386 CHEMBL3264336 Cholinesterase 5260 ChEMBL 10.1016/j.ejmech.2014.05.008 10.7270/Q2MC91KF 24836068 Vitorovic-Todorovic, MD; Koukoulitsa, C; Juranic, IO; Mandic, LM; Drakulic, BJ Ratka Resanovica1 http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016386 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016386&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643669 242041620 CHEMBL3264336 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098606 CC(C)c1ccc(NC(=O)C(CC(=O)c2ccc(cc2C(C)C)C(C)C)n2ccnc2)cc1 InChI=1S/C28H35N3O2/c1-18(2)21-7-10-23(11-8-21)30-28(33)26(31-14-13-29-17-31)16-27(32)24-12-9-22(19(3)4)15-25(24)20(5)6/h7-15,17-20,26H,16H2,1-6H3,(H,30,33) FYFGMKHYFZUPCH-UHFFFAOYSA-N 50016387 CHEMBL3264338 Cholinesterase >20000 ChEMBL 10.1016/j.ejmech.2014.05.008 10.7270/Q2MC91KF 24836068 Vitorovic-Todorovic, MD; Koukoulitsa, C; Juranic, IO; Mandic, LM; Drakulic, BJ Ratka Resanovica1 http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016387 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016387&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643670 242041621 CHEMBL3264338 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098607 CC(C)c1ccc(NC(=O)C(CC(=O)c2ccc(cc2C(C)C)C(C)C)N2CCN(C)CC2)cc1 InChI=1S/C30H43N3O2/c1-20(2)23-8-11-25(12-9-23)31-30(35)28(33-16-14-32(7)15-17-33)19-29(34)26-13-10-24(21(3)4)18-27(26)22(5)6/h8-13,18,20-22,28H,14-17,19H2,1-7H3,(H,31,35) WLPDZOPIDDIINH-UHFFFAOYSA-N 50016389 CHEMBL3264340 Cholinesterase 740 ChEMBL 10.1016/j.ejmech.2014.05.008 10.7270/Q2MC91KF 24836068 Vitorovic-Todorovic, MD; Koukoulitsa, C; Juranic, IO; Mandic, LM; Drakulic, BJ Ratka Resanovica1 http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016389 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016389&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643671 242041622 CHEMBL3264340 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098608 CC(C)c1ccc(C(=O)CC(N2CCOCC2)C(=O)NC2CCCCC2)c(c1)C(C)C InChI=1S/C26H40N2O3/c1-18(2)20-10-11-22(23(16-20)19(3)4)25(29)17-24(28-12-14-31-15-13-28)26(30)27-21-8-6-5-7-9-21/h10-11,16,18-19,21,24H,5-9,12-15,17H2,1-4H3,(H,27,30) HFNNTECORZLVNK-UHFFFAOYSA-N 50016390 CHEMBL3264343 Cholinesterase >20000 ChEMBL 10.1016/j.ejmech.2014.05.008 10.7270/Q2MC91KF 24836068 Vitorovic-Todorovic, MD; Koukoulitsa, C; Juranic, IO; Mandic, LM; Drakulic, BJ Ratka Resanovica1 http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016390 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016390&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643672 242041623 CHEMBL3264343 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098609 CC(C)c1ccc(C(=O)CC(N2CCN(C)CC2)C(=O)NC2CCCCC2)c(c1)C(C)C InChI=1S/C27H43N3O2/c1-19(2)21-11-12-23(24(17-21)20(3)4)26(31)18-25(30-15-13-29(5)14-16-30)27(32)28-22-9-7-6-8-10-22/h11-12,17,19-20,22,25H,6-10,13-16,18H2,1-5H3,(H,28,32) APQPRFMRKBLIHC-UHFFFAOYSA-N 50016391 CHEMBL3264344 Cholinesterase 2250 ChEMBL 10.1016/j.ejmech.2014.05.008 10.7270/Q2MC91KF 24836068 Vitorovic-Todorovic, MD; Koukoulitsa, C; Juranic, IO; Mandic, LM; Drakulic, BJ Ratka Resanovica1 http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016391 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016391&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643673 242041624 CHEMBL3264344 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098610 O=C(NC1CCCCC1)C(CC(=O)c1cccc2CCCCc12)N1CCCCC1 InChI=1S/C25H36N2O2/c28-24(22-15-9-11-19-10-5-6-14-21(19)22)18-23(27-16-7-2-8-17-27)25(29)26-20-12-3-1-4-13-20/h9,11,15,20,23H,1-8,10,12-14,16-18H2,(H,26,29) VTLQZOSPDHVWFM-UHFFFAOYSA-N 50016392 CHEMBL3264345 Cholinesterase >20000 ChEMBL 10.1016/j.ejmech.2014.05.008 10.7270/Q2MC91KF 24836068 Vitorovic-Todorovic, MD; Koukoulitsa, C; Juranic, IO; Mandic, LM; Drakulic, BJ Ratka Resanovica1 http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016392 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016392&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643674 242041625 CHEMBL3264345 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098611 O=C(NC1CCCCC1)C(CC(=O)c1cccc2CCCCc12)n1ccnc1 InChI=1S/C23H29N3O2/c27-22(20-12-6-8-17-7-4-5-11-19(17)20)15-21(26-14-13-24-16-26)23(28)25-18-9-2-1-3-10-18/h6,8,12-14,16,18,21H,1-5,7,9-11,15H2,(H,25,28) MSJXSLKFFKQYOV-UHFFFAOYSA-N 50016393 CHEMBL3264346 Cholinesterase >20000 ChEMBL 10.1016/j.ejmech.2014.05.008 10.7270/Q2MC91KF 24836068 Vitorovic-Todorovic, MD; Koukoulitsa, C; Juranic, IO; Mandic, LM; Drakulic, BJ Ratka Resanovica1 http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016393 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016393&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643675 242041626 CHEMBL3264346 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098612 CC(C)c1ccc(NC(=O)C(CC(=O)c2cccc3CCCCc23)n2ccnc2)cc1 InChI=1S/C26H29N3O2/c1-18(2)19-10-12-21(13-11-19)28-26(31)24(29-15-14-27-17-29)16-25(30)23-9-5-7-20-6-3-4-8-22(20)23/h5,7,9-15,17-18,24H,3-4,6,8,16H2,1-2H3,(H,28,31) OHWCNPZBPCNNLR-UHFFFAOYSA-N 50016394 CHEMBL3264350 Cholinesterase >20000 ChEMBL 10.1016/j.ejmech.2014.05.008 10.7270/Q2MC91KF 24836068 Vitorovic-Todorovic, MD; Koukoulitsa, C; Juranic, IO; Mandic, LM; Drakulic, BJ Ratka Resanovica1 http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016394 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016394&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643676 242041627 CHEMBL3264350 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098613 CC(C)c1ccc(NC(=O)C(CC(=O)c2cccc3CCCCc23)N2CCOCC2)cc1 InChI=1S/C27H34N2O3/c1-19(2)20-10-12-22(13-11-20)28-27(31)25(29-14-16-32-17-15-29)18-26(30)24-9-5-7-21-6-3-4-8-23(21)24/h5,7,9-13,19,25H,3-4,6,8,14-18H2,1-2H3,(H,28,31) YMLSFSWFXRKQMW-UHFFFAOYSA-N 50016395 CHEMBL3264351 Cholinesterase >15000 ChEMBL 10.1016/j.ejmech.2014.05.008 10.7270/Q2MC91KF 24836068 Vitorovic-Todorovic, MD; Koukoulitsa, C; Juranic, IO; Mandic, LM; Drakulic, BJ Ratka Resanovica1 http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016395 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016395&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643677 242041628 CHEMBL3264351 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098614 CC(C)c1ccc(NC(=O)C(CC(=O)c2cccc3CCCCc23)N2CCN(C)CC2)cc1 InChI=1S/C28H37N3O2/c1-20(2)21-11-13-23(14-12-21)29-28(33)26(31-17-15-30(3)16-18-31)19-27(32)25-10-6-8-22-7-4-5-9-24(22)25/h6,8,10-14,20,26H,4-5,7,9,15-19H2,1-3H3,(H,29,33) PRVBTUDGHOEEHZ-UHFFFAOYSA-N 50016396 CHEMBL3264352 Cholinesterase 10750 ChEMBL 10.1016/j.ejmech.2014.05.008 10.7270/Q2MC91KF 24836068 Vitorovic-Todorovic, MD; Koukoulitsa, C; Juranic, IO; Mandic, LM; Drakulic, BJ Ratka Resanovica1 http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016396 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016396&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643678 103927813 CHEMBL3264352 ZINC27753223 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098615 CC(C)c1ccc(cc1)C(=O)CC(N1CCC(Cc2ccccc2)CC1)C(=O)Nc1ccccc1 InChI=1S/C31H36N2O2/c1-23(2)26-13-15-27(16-14-26)30(34)22-29(31(35)32-28-11-7-4-8-12-28)33-19-17-25(18-20-33)21-24-9-5-3-6-10-24/h3-16,23,25,29H,17-22H2,1-2H3,(H,32,35) UVCDVRDWKBACBW-UHFFFAOYSA-N 50016397 CHEMBL3264654 Cholinesterase >20000 ChEMBL 10.1016/j.ejmech.2014.05.008 10.7270/Q2MC91KF 24836068 Vitorovic-Todorovic, MD; Koukoulitsa, C; Juranic, IO; Mandic, LM; Drakulic, BJ Ratka Resanovica1 http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016397 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016397&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643679 103927814 CHEMBL3264654 ZINC27756282 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098616 COc1cc(NC(=O)C(CC(=O)c2ccc(cc2)C(C)C)N2CCN(CCN(C)C)CC2)cc(OC)c1 InChI=1S/C29H42N4O4/c1-21(2)22-7-9-23(10-8-22)28(34)20-27(33-15-13-32(14-16-33)12-11-31(3)4)29(35)30-24-17-25(36-5)19-26(18-24)37-6/h7-10,17-19,21,27H,11-16,20H2,1-6H3,(H,30,35) QRDKGYDBWCBKAJ-UHFFFAOYSA-N 50016399 CHEMBL3264655 Cholinesterase >20000 ChEMBL 10.1016/j.ejmech.2014.05.008 10.7270/Q2MC91KF 24836068 Vitorovic-Todorovic, MD; Koukoulitsa, C; Juranic, IO; Mandic, LM; Drakulic, BJ Ratka Resanovica1 http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016399 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016399&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643680 103927816 CHEMBL3264655 ZINC27755740 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098617 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 7.0 ChEMBL 10.1016/j.ejmech.2014.05.008 10.7270/Q2MC91KF 24836068 Vitorovic-Todorovic, MD; Koukoulitsa, C; Juranic, IO; Mandic, LM; Drakulic, BJ Ratka Resanovica1 http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098706 CC(=O)n1n(C(C)=O)c2ccc(Cl)cc2sc2ccccc12 InChI=1S/C16H13ClN2O2S/c1-10(20)18-13-5-3-4-6-15(13)22-16-9-12(17)7-8-14(16)19(18)11(2)21/h3-9H,1-2H3 BQCYNBXNJHMKMI-UHFFFAOYSA-N 50016482 CHEMBL3265393 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2014.04.075 10.7270/Q23F4R6B 24858540 González-Muñoz, GC; Arce, MP; Pérez, C; Romero, A; Villarroya, M; López, MG; Conde, S; Rodríguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016482 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016482&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12946013 103927880 CHEMBL3265393 ZINC29311297 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098707 CC(=O)n1n(C(C)=O)c2cc(Cl)ccc2sc2ccccc12 InChI=1S/C16H13ClN2O2S/c1-10(20)18-13-5-3-4-6-15(13)22-16-8-7-12(17)9-14(16)19(18)11(2)21/h3-9H,1-2H3 YQVALXQWMBNSMA-UHFFFAOYSA-N 50016483 CHEMBL3265394 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2014.04.075 10.7270/Q23F4R6B 24858540 González-Muñoz, GC; Arce, MP; Pérez, C; Romero, A; Villarroya, M; López, MG; Conde, S; Rodríguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016483 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016483&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12946014 103927881 CHEMBL3265394 ZINC29322122 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098708 Clc1ccc2N=Nc3ccccc3Sc2c1 InChI=1S/C12H7ClN2S/c13-8-5-6-10-12(7-8)16-11-4-2-1-3-9(11)14-15-10/h1-7H CMSKBSYSOYCPBG-UHFFFAOYSA-N 50016484 CHEMBL3265395 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2014.04.075 10.7270/Q23F4R6B 24858540 González-Muñoz, GC; Arce, MP; Pérez, C; Romero, A; Villarroya, M; López, MG; Conde, S; Rodríguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016484 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016484&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12946019 103927882 CHEMBL3265395 ZINC29314320 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098709 COc1ccc2n(C(C)=O)n(C(C)=O)c3ccccc3sc2c1 InChI=1S/C17H16N2O3S/c1-11(20)18-14-6-4-5-7-16(14)23-17-10-13(22-3)8-9-15(17)19(18)12(2)21/h4-10H,1-3H3 WBEHFGPYRISDGZ-UHFFFAOYSA-N 50016485 CHEMBL3265396 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2014.04.075 10.7270/Q23F4R6B 24858540 González-Muñoz, GC; Arce, MP; Pérez, C; Romero, A; Villarroya, M; López, MG; Conde, S; Rodríguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016485 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016485&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46219663 103927883 CHEMBL3265396 ZINC29310115 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098710 CC(=O)n1n(C(C)=O)c2ccc(cc2sc2ccccc12)C(F)(F)F InChI=1S/C17H13F3N2O2S/c1-10(23)21-13-5-3-4-6-15(13)25-16-9-12(17(18,19)20)7-8-14(16)22(21)11(2)24/h3-9H,1-2H3 YPRAIJVRPSGJBP-UHFFFAOYSA-N 50016486 CHEMBL3265397 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2014.04.075 10.7270/Q23F4R6B 24858540 González-Muñoz, GC; Arce, MP; Pérez, C; Romero, A; Villarroya, M; López, MG; Conde, S; Rodríguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016486 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016486&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46219780 103927884 CHEMBL3265397 ZINC29322117 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098711 CC(=O)n1[nH]c2ccc(cc2sc2ccccc12)[N+]([O-])=O InChI=1S/C14H11N3O3S/c1-9(18)16-12-4-2-3-5-13(12)21-14-8-10(17(19)20)6-7-11(14)15-16/h2-8,15H,1H3 VFIREGNJWDIGNT-UHFFFAOYSA-N 50016487 CHEMBL3265398 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2014.04.075 10.7270/Q23F4R6B 24858540 González-Muñoz, GC; Arce, MP; Pérez, C; Romero, A; Villarroya, M; López, MG; Conde, S; Rodríguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016487 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016487&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46219664 103927885 CHEMBL3265398 ZINC29321754 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098712 CN1CCN(CC(=O)n2n(C(=O)CN3CCN(C)CC3)c3cc(Cl)ccc3sc3ccccc23)CC1 InChI=1S/C26H33ClN6O2S/c1-28-9-13-30(14-10-28)18-25(34)32-21-5-3-4-6-23(21)36-24-8-7-20(27)17-22(24)33(32)26(35)19-31-15-11-29(2)12-16-31/h3-8,17H,9-16,18-19H2,1-2H3 REWZTZJXZHDSQK-UHFFFAOYSA-N 50016488 CHEMBL3265399 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2014.04.075 10.7270/Q23F4R6B 24858540 González-Muñoz, GC; Arce, MP; Pérez, C; Romero, A; Villarroya, M; López, MG; Conde, S; Rodríguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016488 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016488&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46219781 103927886 CHEMBL3265399 ZINC14583994 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098713 Clc1cccc2sc3ccccc3n(C(=O)CN3CCCCC3)n(C(=O)CN3CCCCC3)c12 InChI=1S/C26H31ClN4O2S/c27-20-10-9-13-23-26(20)31(25(33)19-29-16-7-2-8-17-29)30(21-11-3-4-12-22(21)34-23)24(32)18-28-14-5-1-6-15-28/h3-4,9-13H,1-2,5-8,14-19H2 BQXXYMRLOQZJAJ-UHFFFAOYSA-N 50016491 CHEMBL3265400 Cholinesterase 900 ChEMBL 10.1016/j.ejmech.2014.04.075 10.7270/Q23F4R6B 24858540 González-Muñoz, GC; Arce, MP; Pérez, C; Romero, A; Villarroya, M; López, MG; Conde, S; Rodríguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016491 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016491&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46219782 103927889 CHEMBL3265400 ZINC29324986 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098714 CN(C)CCC(=O)n1n(C(=O)CCN(C)C)c2cc(Cl)ccc2sc2ccccc12 InChI=1S/C22H27ClN4O2S/c1-24(2)13-11-21(28)26-17-7-5-6-8-19(17)30-20-10-9-16(23)15-18(20)27(26)22(29)12-14-25(3)4/h5-10,15H,11-14H2,1-4H3 POZAFCASJJUQGZ-UHFFFAOYSA-N 50016492 CHEMBL3265401 Cholinesterase 700 ChEMBL 10.1016/j.ejmech.2014.04.075 10.7270/Q23F4R6B 24858540 González-Muñoz, GC; Arce, MP; Pérez, C; Romero, A; Villarroya, M; López, MG; Conde, S; Rodríguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016492 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016492&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46219783 103927890 CHEMBL3265401 ZINC29324176 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098715 Clc1ccc2sc3ccccc3n(C(=O)CCN3CCCCC3)n(C(=O)CCN3CCCCC3)c2c1 InChI=1S/C28H35ClN4O2S/c29-22-11-12-26-24(21-22)33(28(35)14-20-31-17-7-2-8-18-31)32(23-9-3-4-10-25(23)36-26)27(34)13-19-30-15-5-1-6-16-30/h3-4,9-12,21H,1-2,5-8,13-20H2 SXNRIIWYGZDKOQ-UHFFFAOYSA-N 50016493 CHEMBL3259875 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2014.04.075 10.7270/Q23F4R6B 24858540 González-Muñoz, GC; Arce, MP; Pérez, C; Romero, A; Villarroya, M; López, MG; Conde, S; Rodríguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016493 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016493&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46219784 103927891 CHEMBL3259875 ZINC14583981 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098716 Clc1ccc2sc3ccccc3n(C(=O)CCN3CCCC3)n(C(=O)CCN3CCCC3)c2c1 InChI=1S/C26H31ClN4O2S/c27-20-9-10-24-22(19-20)31(26(33)12-18-29-15-5-6-16-29)30(21-7-1-2-8-23(21)34-24)25(32)11-17-28-13-3-4-14-28/h1-2,7-10,19H,3-6,11-18H2 DKPFRQLUAHHRGY-UHFFFAOYSA-N 50016494 CHEMBL3265402 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2014.04.075 10.7270/Q23F4R6B 24858540 González-Muñoz, GC; Arce, MP; Pérez, C; Romero, A; Villarroya, M; López, MG; Conde, S; Rodríguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016494 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016494&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46219785 103927892 CHEMBL3265402 ZINC29321387 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098717 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 10.0 ChEMBL 10.1016/j.ejmech.2014.04.075 10.7270/Q23F4R6B 24858540 González-Muñoz, GC; Arce, MP; Pérez, C; Romero, A; Villarroya, M; López, MG; Conde, S; Rodríguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098467 CNC(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1 InChI=1S/C15H21N3O2/c1-15-7-8-17(3)13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2/h5-6,9,13H,7-8H2,1-4H3,(H,16,19)/t13-,15+/m1/s1 PIJVFDBKTWXHHD-HIFRSBDPSA-N 50004000 (3aS,8aR)-1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol-5-yl methylcarbamate::Antilirium::CHEMBL94::Eserine::Physostol::physostigmine Cholinesterase 60 ChEMBL 10.1016/j.ejmech.2014.05.002 10.7270/Q24B32VG 24819955 Huang, G; Kling, B; Darras, FH; Heilmann, J; Decker, M University of W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50004000 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50004000&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5983 103917788 27953 CHEMBL94 DB00981 6598 C06535 ZINC33971762 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098468 CCCCCCCNC(=O)Oc1ccc2N(C)C3N(CCc4c3[nH]c3ccccc43)Cc2c1 InChI=1S/C27H34N4O2/c1-3-4-5-6-9-15-28-27(32)33-20-12-13-24-19(17-20)18-31-16-14-22-21-10-7-8-11-23(21)29-25(22)26(31)30(24)2/h7-8,10-13,17,26,29H,3-6,9,14-16,18H2,1-2H3,(H,28,32) HKHKOTPYNYYBTG-UHFFFAOYSA-N 50016244 CHEMBL3262489 Cholinesterase 77 ChEMBL 10.1016/j.ejmech.2014.05.002 10.7270/Q24B32VG 24819955 Huang, G; Kling, B; Darras, FH; Heilmann, J; Decker, M University of W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016244 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016244&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643589 242041523 CHEMBL3262489 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098469 CN1C2N(CCc3c2[nH]c2ccccc32)C(=O)c2cc(OCc3ccccc3)ccc12 InChI=1S/C26H23N3O2/c1-28-23-12-11-18(31-16-17-7-3-2-4-8-17)15-21(23)26(30)29-14-13-20-19-9-5-6-10-22(19)27-24(20)25(28)29/h2-12,15,25,27H,13-14,16H2,1H3 NKKITZOSLYEBJO-UHFFFAOYSA-N 50016245 CHEMBL3262479 Cholinesterase 880 ChEMBL 10.1016/j.ejmech.2014.05.002 10.7270/Q24B32VG 24819955 Huang, G; Kling, B; Darras, FH; Heilmann, J; Decker, M University of W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016245 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016245&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643590 242041524 CHEMBL3262479 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098470 CCNC(=O)Oc1ccc2N(C)C3N(CCc4c3[nH]c3ccccc43)Cc2c1 InChI=1S/C22H24N4O2/c1-3-23-22(27)28-15-8-9-19-14(12-15)13-26-11-10-17-16-6-4-5-7-18(16)24-20(17)21(26)25(19)2/h4-9,12,21,24H,3,10-11,13H2,1-2H3,(H,23,27) DYFMOUXCERYGJQ-UHFFFAOYSA-N 50016246 CHEMBL3262487 Cholinesterase 1030 ChEMBL 10.1016/j.ejmech.2014.05.002 10.7270/Q24B32VG 24819955 Huang, G; Kling, B; Darras, FH; Heilmann, J; Decker, M University of W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016246 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016246&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643591 242041525 CHEMBL3262487 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098471 CN1C2N(CCc3c2[nH]c2ccccc32)Cc2cc(OC(=O)NCc3ccccc3)ccc12 InChI=1S/C27H26N4O2/c1-30-24-12-11-20(33-27(32)28-16-18-7-3-2-4-8-18)15-19(24)17-31-14-13-22-21-9-5-6-10-23(21)29-25(22)26(30)31/h2-12,15,26,29H,13-14,16-17H2,1H3,(H,28,32) HHHJRHGRLBSYRY-UHFFFAOYSA-N 50016247 CHEMBL3262490 Cholinesterase 2150 ChEMBL 10.1016/j.ejmech.2014.05.002 10.7270/Q24B32VG 24819955 Huang, G; Kling, B; Darras, FH; Heilmann, J; Decker, M University of W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016247 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016247&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643592 242041526 CHEMBL3262490 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098472 CN1C2N(CCc3c2[nH]c2ccccc32)Cc2ccccc12 InChI=1S/C19H19N3/c1-21-17-9-5-2-6-13(17)12-22-11-10-15-14-7-3-4-8-16(14)20-18(15)19(21)22/h2-9,19-20H,10-12H2,1H3 NRPJNCRKRUUPEY-UHFFFAOYSA-N 50016248 5-(Methylene)Evodiamine::CHEMBL2171768 Cholinesterase 2680 ChEMBL 10.1016/j.ejmech.2014.05.002 10.7270/Q24B32VG 24819955 Huang, G; Kling, B; Darras, FH; Heilmann, J; Decker, M University of W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016248 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016248&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56967508 242041527 CHEMBL2171768 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098474 CCCCNC(=O)Oc1ccc2N(C)C3N(CCc4c3[nH]c3ccccc43)Cc2c1 InChI=1S/C24H28N4O2/c1-3-4-12-25-24(29)30-17-9-10-21-16(14-17)15-28-13-11-19-18-7-5-6-8-20(18)26-22(19)23(28)27(21)2/h5-10,14,23,26H,3-4,11-13,15H2,1-2H3,(H,25,29) QWMLKUNOQCZIKT-UHFFFAOYSA-N 50016249 CHEMBL3262488 Cholinesterase 3970 ChEMBL 10.1016/j.ejmech.2014.05.002 10.7270/Q24B32VG 24819955 Huang, G; Kling, B; Darras, FH; Heilmann, J; Decker, M University of W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016249 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016249&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643593 242041528 CHEMBL3262488 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098475 CN1C2N(CCc3c2[nH]c2ccccc32)C(=O)c2ccccc12 InChI=1S/C19H17N3O/c1-21-16-9-5-3-7-14(16)19(23)22-11-10-13-12-6-2-4-8-15(12)20-17(13)18(21)22/h2-9,18,20H,10-11H2,1H3 TXDUTHBFYKGSAH-UHFFFAOYSA-N 50016250 CHEMBL81925 Cholinesterase 4620 ChEMBL 10.1016/j.ejmech.2014.05.002 10.7270/Q24B32VG 24819955 Huang, G; Kling, B; Darras, FH; Heilmann, J; Decker, M University of W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016250 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016250&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 151289 242041529 CHEMBL81925 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098476 CN1C2N(CCc3c2[nH]c2ccccc32)Cc2cc(O)ccc12 InChI=1S/C19H19N3O/c1-21-17-7-6-13(23)10-12(17)11-22-9-8-15-14-4-2-3-5-16(14)20-18(15)19(21)22/h2-7,10,19-20,23H,8-9,11H2,1H3 JLCQVELPUQUIRU-UHFFFAOYSA-N 50016251 CHEMBL3262480 Cholinesterase 19300 ChEMBL 10.1016/j.ejmech.2014.05.002 10.7270/Q24B32VG 24819955 Huang, G; Kling, B; Darras, FH; Heilmann, J; Decker, M University of W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016251 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016251&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643594 242041530 CHEMBL3262480 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098477 CCNC(=O)Oc1ccc2N(C)C3N(CCc4c3[nH]c3ccccc43)C(=O)c2c1 InChI=1S/C22H22N4O3/c1-3-23-22(28)29-13-8-9-18-16(12-13)21(27)26-11-10-15-14-6-4-5-7-17(14)24-19(15)20(26)25(18)2/h4-9,12,20,24H,3,10-11H2,1-2H3,(H,23,28) SFIBKJIWAVKWLQ-UHFFFAOYSA-N 50016252 CHEMBL3262481 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2014.05.002 10.7270/Q24B32VG 24819955 Huang, G; Kling, B; Darras, FH; Heilmann, J; Decker, M University of W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016252 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016252&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643595 242041531 CHEMBL3262481 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098478 CCCCNC(=O)Oc1ccc2N(C)C3N(CCc4c3[nH]c3ccccc43)C(=O)c2c1 InChI=1S/C24H26N4O3/c1-3-4-12-25-24(30)31-15-9-10-20-18(14-15)23(29)28-13-11-17-16-7-5-6-8-19(16)26-21(17)22(28)27(20)2/h5-10,14,22,26H,3-4,11-13H2,1-2H3,(H,25,30) GVGRPDDJVVCUSK-UHFFFAOYSA-N 50016253 CHEMBL3262482 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2014.05.002 10.7270/Q24B32VG 24819955 Huang, G; Kling, B; Darras, FH; Heilmann, J; Decker, M University of W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016253 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016253&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643596 242041532 CHEMBL3262482 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098479 CCCCCCCOC(=O)Nc1ccc2N(C)C3N(CCc4c3[nH]c3ccccc43)C(=O)c2c1 InChI=1S/C27H32N4O3/c1-3-4-5-6-9-16-34-27(33)28-18-12-13-23-21(17-18)26(32)31-15-14-20-19-10-7-8-11-22(19)29-24(20)25(31)30(23)2/h7-8,10-13,17,25,29H,3-6,9,14-16H2,1-2H3,(H,28,33) RZWHNKWMQCLFSI-UHFFFAOYSA-N 50016254 CHEMBL3262483 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2014.05.002 10.7270/Q24B32VG 24819955 Huang, G; Kling, B; Darras, FH; Heilmann, J; Decker, M University of W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016254 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016254&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643597 242041533 CHEMBL3262483 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098480 CN1C2N(CCc3c2[nH]c2ccccc32)C(=O)c2cc(OC(=O)NCc3ccccc3)ccc12 InChI=1S/C27H24N4O3/c1-30-23-12-11-18(34-27(33)28-16-17-7-3-2-4-8-17)15-21(23)26(32)31-14-13-20-19-9-5-6-10-22(19)29-24(20)25(30)31/h2-12,15,25,29H,13-14,16H2,1H3,(H,28,33) XBXZZFHJOIRRPN-UHFFFAOYSA-N 50016255 CHEMBL3262484 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2014.05.002 10.7270/Q24B32VG 24819955 Huang, G; Kling, B; Darras, FH; Heilmann, J; Decker, M University of W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016255 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016255&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643598 242041534 CHEMBL3262484 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098481 CC(C)c1ccc(NC(=O)Oc2ccc3N(C)C4N(CCc5c4[nH]c4ccccc54)C(=O)c3c2)cc1 InChI=1S/C29H28N4O3/c1-17(2)18-8-10-19(11-9-18)30-29(35)36-20-12-13-25-23(16-20)28(34)33-15-14-22-21-6-4-5-7-24(21)31-26(22)27(33)32(25)3/h4-13,16-17,27,31H,14-15H2,1-3H3,(H,30,35) GWXGGMQMEHCZJN-UHFFFAOYSA-N 50016256 CHEMBL3262485 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2014.05.002 10.7270/Q24B32VG 24819955 Huang, G; Kling, B; Darras, FH; Heilmann, J; Decker, M University of W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016256 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016256&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643599 242041535 CHEMBL3262485 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098482 COc1cccc(NC(=O)Oc2ccc3N(C)C4N(CCc5c4[nH]c4ccccc54)C(=O)c3c2)c1 InChI=1S/C27H24N4O4/c1-30-23-11-10-18(35-27(33)28-16-6-5-7-17(14-16)34-2)15-21(23)26(32)31-13-12-20-19-8-3-4-9-22(19)29-24(20)25(30)31/h3-11,14-15,25,29H,12-13H2,1-2H3,(H,28,33) OFNNLVIKOBPZPX-UHFFFAOYSA-N 50016257 CHEMBL3262486 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2014.05.002 10.7270/Q24B32VG 24819955 Huang, G; Kling, B; Darras, FH; Heilmann, J; Decker, M University of W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016257 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016257&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643600 242041536 CHEMBL3262486 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098483 CC(C)c1ccc(NC(=O)Oc2ccc3N(C)C4N(CCc5c4[nH]c4ccccc54)Cc3c2)cc1 InChI=1S/C29H30N4O2/c1-18(2)19-8-10-21(11-9-19)30-29(34)35-22-12-13-26-20(16-22)17-33-15-14-24-23-6-4-5-7-25(23)31-27(24)28(33)32(26)3/h4-13,16,18,28,31H,14-15,17H2,1-3H3,(H,30,34) RJRXXGIZPLYCKG-UHFFFAOYSA-N 50016258 CHEMBL3262491 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2014.05.002 10.7270/Q24B32VG 24819955 Huang, G; Kling, B; Darras, FH; Heilmann, J; Decker, M University of W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016258 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016258&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643601 242041537 CHEMBL3262491 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098484 COc1cccc(NC(=O)Oc2ccc3N(C)C4N(CCc5c4[nH]c4ccccc54)Cc3c2)c1 InChI=1S/C27H26N4O3/c1-30-24-11-10-20(34-27(32)28-18-6-5-7-19(15-18)33-2)14-17(24)16-31-13-12-22-21-8-3-4-9-23(21)29-25(22)26(30)31/h3-11,14-15,26,29H,12-13,16H2,1-2H3,(H,28,32) QIWBJLBDULQJET-UHFFFAOYSA-N 50016259 CHEMBL3262492 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2014.05.002 10.7270/Q24B32VG 24819955 Huang, G; Kling, B; Darras, FH; Heilmann, J; Decker, M University of W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016259 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016259&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90643602 242041538 CHEMBL3262492 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50098499 CN1C2N(CCc3c2[nH]c2ccccc32)C(=O)c2cc(O)ccc12 InChI=1S/C19H17N3O2/c1-21-16-7-6-11(23)10-14(16)19(24)22-9-8-13-12-4-2-3-5-15(12)20-17(13)18(21)22/h2-7,10,18,20,23H,8-9H2,1H3 HJMRPVURQRIKJZ-UHFFFAOYSA-N 50016260 3-Hydroxyevodiamine::CHEMBL2171793 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2014.05.002 10.7270/Q24B32VG 24819955 Huang, G; Kling, B; Darras, FH; Heilmann, J; Decker, M University of W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50016260 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50016260&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56967992 242041539 CHEMBL2171793 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50103324 Oc1ccc(CN(CC#C)C(CCC2CCN(Cc3ccccc3)CC2)C#N)c2cccnc12 InChI=1S/C29H32N4O/c1-2-17-33(22-25-11-13-28(34)29-27(25)9-6-16-31-29)26(20-30)12-10-23-14-18-32(19-15-23)21-24-7-4-3-5-8-24/h1,3-9,11,13,16,23,26,34H,10,12,14-15,17-19,21-22H2 ATRSFRGWPPYVGZ-UHFFFAOYSA-N 50018671 CHEMBL3291019 Cholinesterase 1600 ChEMBL 10.1016/j.ejmech.2014.04.078 10.7270/Q2BK1DWK 24813882 Wang, L; Esteban, G; Ojima, M; Bautista-Aguilera, OM; Inokuchi, T; Moraleda, I; Iriepa, I; Samadi, A; Youdim, MB; Romero, A; Soriano, E; Herrero, R; Fernández Fernández, AP; Ricardo-Martínez-Murillo, na; Marco-Contelles, J; Unzeta, M Okayama University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50018671 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50018671&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73671789 103929763 CHEMBL3291019 ZINC06094927 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50103332 Oc1ccc(CN(CCCC2CCN(Cc3ccccc3)CC2)CC#C)c2cccnc12 InChI=1S/C28H33N3O/c1-2-17-30(22-25-12-13-27(32)28-26(25)11-6-16-29-28)18-7-10-23-14-19-31(20-15-23)21-24-8-4-3-5-9-24/h1,3-6,8-9,11-13,16,23,32H,7,10,14-15,17-22H2 MNJCTXPKVQZKIR-UHFFFAOYSA-N 50018672 CHEMBL3291020 Cholinesterase 4500 ChEMBL 10.1016/j.ejmech.2014.04.078 10.7270/Q2BK1DWK 24813882 Wang, L; Esteban, G; Ojima, M; Bautista-Aguilera, OM; Inokuchi, T; Moraleda, I; Iriepa, I; Samadi, A; Youdim, MB; Romero, A; Soriano, E; Herrero, R; Fernández Fernández, AP; Ricardo-Martínez-Murillo, na; Marco-Contelles, J; Unzeta, M Okayama University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50018672 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50018672&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 74221603 103929764 CHEMBL3291020 ZINC26815801 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50103336 Oc1ccc(CN(CC#C)C(CC2CCN(Cc3ccccc3)CC2)C#N)c2cccnc12 InChI=1S/C28H30N4O/c1-2-15-32(21-24-10-11-27(33)28-26(24)9-6-14-30-28)25(19-29)18-22-12-16-31(17-13-22)20-23-7-4-3-5-8-23/h1,3-11,14,22,25,33H,12-13,15-18,20-21H2 CMDSWMANYVESRV-UHFFFAOYSA-N 50018674 CHEMBL3291017 Cholinesterase 6100 ChEMBL 10.1016/j.ejmech.2014.04.078 10.7270/Q2BK1DWK 24813882 Wang, L; Esteban, G; Ojima, M; Bautista-Aguilera, OM; Inokuchi, T; Moraleda, I; Iriepa, I; Samadi, A; Youdim, MB; Romero, A; Soriano, E; Herrero, R; Fernández Fernández, AP; Ricardo-Martínez-Murillo, na; Marco-Contelles, J; Unzeta, M Okayama University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50018674 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50018674&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 74222915 103929766 CHEMBL3291017 ZINC04071646 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50103344 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 7400 ChEMBL 10.1016/j.ejmech.2014.04.078 10.7270/Q2BK1DWK 24813882 Wang, L; Esteban, G; Ojima, M; Bautista-Aguilera, OM; Inokuchi, T; Moraleda, I; Iriepa, I; Samadi, A; Youdim, MB; Romero, A; Soriano, E; Herrero, R; Fernández Fernández, AP; Ricardo-Martínez-Murillo, na; Marco-Contelles, J; Unzeta, M Okayama University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50103350 Oc1ccc(CN(CC#C)CC2CCN(Cc3ccccc3)CC2)c2cccnc12 InChI=1S/C26H29N3O/c1-2-15-29(20-23-10-11-25(30)26-24(23)9-6-14-27-26)19-22-12-16-28(17-13-22)18-21-7-4-3-5-8-21/h1,3-11,14,22,30H,12-13,15-20H2 AMRMOSRTGRJRGB-UHFFFAOYSA-N 50018675 CHEMBL3291016 Cholinesterase 12800 ChEMBL 10.1016/j.ejmech.2014.04.078 10.7270/Q2BK1DWK 24813882 Wang, L; Esteban, G; Ojima, M; Bautista-Aguilera, OM; Inokuchi, T; Moraleda, I; Iriepa, I; Samadi, A; Youdim, MB; Romero, A; Soriano, E; Herrero, R; Fernández Fernández, AP; Ricardo-Martínez-Murillo, na; Marco-Contelles, J; Unzeta, M Okayama University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50018675 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50018675&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 74222916 103929767 CHEMBL3291016 ZINC26815945 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50103351 Oc1ccc(CN(CC#C)C(C#N)C2CCN(Cc3ccccc3)CC2)c2cccnc12 InChI=1S/C27H28N4O/c1-2-15-31(20-23-10-11-26(32)27-24(23)9-6-14-29-27)25(18-28)22-12-16-30(17-13-22)19-21-7-4-3-5-8-21/h1,3-11,14,22,25,32H,12-13,15-17,19-20H2 YTAMOLXXEXNVLH-UHFFFAOYSA-N 50018676 CHEMBL3291015 Cholinesterase 13500 ChEMBL 10.1016/j.ejmech.2014.04.078 10.7270/Q2BK1DWK 24813882 Wang, L; Esteban, G; Ojima, M; Bautista-Aguilera, OM; Inokuchi, T; Moraleda, I; Iriepa, I; Samadi, A; Youdim, MB; Romero, A; Soriano, E; Herrero, R; Fernández Fernández, AP; Ricardo-Martínez-Murillo, na; Marco-Contelles, J; Unzeta, M Okayama University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50018676 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50018676&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 74222914 103929768 CHEMBL3291015 ZINC26817075 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50103353 Oc1ccc(CN(CCC2CCN(Cc3ccccc3)CC2)CC#C)c2cccnc12 InChI=1S/C27H31N3O/c1-2-16-29(21-24-10-11-26(31)27-25(24)9-6-15-28-27)17-12-22-13-18-30(19-14-22)20-23-7-4-3-5-8-23/h1,3-11,15,22,31H,12-14,16-21H2 AAHFVXABQPDRND-UHFFFAOYSA-N 50018673 CHEMBL3291018 Cholinesterase 14500 ChEMBL 10.1016/j.ejmech.2014.04.078 10.7270/Q2BK1DWK 24813882 Wang, L; Esteban, G; Ojima, M; Bautista-Aguilera, OM; Inokuchi, T; Moraleda, I; Iriepa, I; Samadi, A; Youdim, MB; Romero, A; Soriano, E; Herrero, R; Fernández Fernández, AP; Ricardo-Martínez-Murillo, na; Marco-Contelles, J; Unzeta, M Okayama University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50018673 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50018673&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 74222917 103929765 CHEMBL3291018 ZINC26823449 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104379 CC(=C)[C@@H]1CC[C@@]2(C)[C@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)C[C@@H]2O InChI=1S/C30H50O2/c1-18(2)19-11-14-28(6)24(32)17-30(8)20(25(19)28)9-10-22-27(5)15-13-23(31)26(3,4)21(27)12-16-29(22,30)7/h19-25,31-32H,1,9-17H2,2-8H3/t19-,20+,21-,22+,23-,24-,25+,27-,28+,29+,30+/m0/s1 AJBZENLMTKDAEK-SKESNUHASA-N 50019002 Calenduladiol Cholinesterase >200000 ChEMBL 10.1016/j.bmc.2014.04.050 10.7270/Q28P6220 24835788 Castro, MJ; Richmond, V; Romero, C; Maier, MS; Estévez-Braun, A; Ravelo, AG; Faraoni, MB; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019002 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019002&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 461835 103930044 ZINC29471346 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104380 [Na+].[Na+].CC(=C)[C@@H]1CC[C@@]2(C)[C@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](OS([O-])(=O)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)C[C@@H]2OS([O-])(=O)=O InChI=1S/C30H50O8S2.2Na/c1-18(2)19-11-14-28(6)24(38-40(34,35)36)17-30(8)20(25(19)28)9-10-22-27(5)15-13-23(37-39(31,32)33)26(3,4)21(27)12-16-29(22,30)7;;/h19-25H,1,9-17H2,2-8H3,(H,31,32,33)(H,34,35,36);;/q;2*+1/p-2/t19-,20+,21-,22+,23-,24-,25+,27-,28+,29+,30+;;/m0../s1 BMXCVAGNZYUFIB-CTNMRGLWSA-L 50019003 CHEMBL3288074 Cholinesterase 64300 ChEMBL 10.1016/j.bmc.2014.04.050 10.7270/Q28P6220 24835788 Castro, MJ; Richmond, V; Romero, C; Maier, MS; Estévez-Braun, A; Ravelo, AG; Faraoni, MB; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019003 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019003&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644260 103930045 CHEMBL3288074 ZINC29478660 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104381 [Na+].[Na+].[Na+].C[C@]12CC[C@H]([C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](OS([O-])(=O)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)C[C@@H]2OS([O-])(=O)=O)C(=C)COS([O-])(=O)=O InChI=1S/C30H50O12S3.3Na/c1-18(17-40-43(31,32)33)19-10-13-28(5)24(42-45(37,38)39)16-30(7)20(25(19)28)8-9-22-27(4)14-12-23(41-44(34,35)36)26(2,3)21(27)11-15-29(22,30)6;;;/h19-25H,1,8-17H2,2-7H3,(H,31,32,33)(H,34,35,36)(H,37,38,39);;;/q;3*+1/p-3/t19-,20+,21-,22+,23-,24-,25+,27-,28+,29+,30+;;;/m0.../s1 HRQWYFJILYUKPU-PGOROUMASA-K 50019008 CHEMBL3288080 Cholinesterase >200000 ChEMBL 10.1016/j.bmc.2014.04.050 10.7270/Q28P6220 24835788 Castro, MJ; Richmond, V; Romero, C; Maier, MS; Estévez-Braun, A; Ravelo, AG; Faraoni, MB; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019008 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019008&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644266 103930050 CHEMBL3288080 ZINC29473749 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104382 [Na+].[Na+].C[C@]12CC[C@H]([C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](OS([O-])(=O)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)C[C@@H]2OS([O-])(=O)=O)C(=C)CO InChI=1S/C30H50O9S2.2Na/c1-18(17-31)19-10-13-28(5)24(39-41(35,36)37)16-30(7)20(25(19)28)8-9-22-27(4)14-12-23(38-40(32,33)34)26(2,3)21(27)11-15-29(22,30)6;;/h19-25,31H,1,8-17H2,2-7H3,(H,32,33,34)(H,35,36,37);;/q;2*+1/p-2/t19-,20+,21-,22+,23-,24-,25+,27-,28+,29+,30+;;/m0../s1 KUHXETQLAYFIQG-CTNMRGLWSA-L 50019009 CHEMBL3288081 Cholinesterase 188400 ChEMBL 10.1016/j.bmc.2014.04.050 10.7270/Q28P6220 24835788 Castro, MJ; Richmond, V; Romero, C; Maier, MS; Estévez-Braun, A; Ravelo, AG; Faraoni, MB; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019009 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019009&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644268 103930051 CHEMBL3288081 ZINC29476619 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104383 [Na+].[Na+].CC(C)[C@@H]1CC[C@@]2(C)[C@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](OS([O-])(=O)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)C[C@@H]2OS([O-])(=O)=O InChI=1S/C30H52O8S2.2Na/c1-18(2)19-11-14-28(6)24(38-40(34,35)36)17-30(8)20(25(19)28)9-10-22-27(5)15-13-23(37-39(31,32)33)26(3,4)21(27)12-16-29(22,30)7;;/h18-25H,9-17H2,1-8H3,(H,31,32,33)(H,34,35,36);;/q;2*+1/p-2/t19-,20+,21-,22+,23-,24-,25+,27-,28+,29+,30+;;/m0../s1 XVDRHYGNDFAGFN-CTNMRGLWSA-L 50019010 CHEMBL3288082 Cholinesterase 104200 ChEMBL 10.1016/j.bmc.2014.04.050 10.7270/Q28P6220 24835788 Castro, MJ; Richmond, V; Romero, C; Maier, MS; Estévez-Braun, A; Ravelo, AG; Faraoni, MB; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019010 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019010&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644270 103930052 CHEMBL3288082 ZINC29478223 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104384 [Na+].[Na+].C[C@@]1(CO1)[C@@H]1CC[C@@]2(C)[C@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](OS([O-])(=O)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)C[C@@H]2OS([O-])(=O)=O InChI=1S/C30H50O9S2.2Na/c1-25(2)20-11-15-28(5)21(26(20,3)14-12-22(25)38-40(31,32)33)9-8-18-24-19(30(7)17-37-30)10-13-27(24,4)23(16-29(18,28)6)39-41(34,35)36;;/h18-24H,8-17H2,1-7H3,(H,31,32,33)(H,34,35,36);;/q;2*+1/p-2/t18-,19-,20+,21-,22+,23+,24+,26+,27-,28-,29-,30-;;/m1../s1 JXXLIPOTRSLFEI-DYEBMMPOSA-L 50019011 CHEMBL3288083 Cholinesterase >200000 ChEMBL 10.1016/j.bmc.2014.04.050 10.7270/Q28P6220 24835788 Castro, MJ; Richmond, V; Romero, C; Maier, MS; Estévez-Braun, A; Ravelo, AG; Faraoni, MB; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019011 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019011&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644272 103930053 CHEMBL3288083 ZINC29473736 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104385 CC(=C)[C@@H]1CC[C@@]2(C)[C@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)C[C@@H]2O InChI=1S/C32H52O3/c1-19(2)21-12-15-30(7)25(34)18-32(9)22(27(21)30)10-11-24-29(6)16-14-26(35-20(3)33)28(4,5)23(29)13-17-31(24,32)8/h21-27,34H,1,10-18H2,2-9H3/t21-,22+,23-,24+,25-,26-,27+,29-,30+,31+,32+/m0/s1 XIJUDLQHNIMDGG-FAOJOLMRSA-N 50019014 CHEMBL3288085 Cholinesterase >200000 ChEMBL 10.1016/j.bmc.2014.04.050 10.7270/Q28P6220 24835788 Castro, MJ; Richmond, V; Romero, C; Maier, MS; Estévez-Braun, A; Ravelo, AG; Faraoni, MB; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019014 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019014&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644276 103930056 CHEMBL3288085 ZINC29476150 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104386 CC(=C)[C@@H]1CC[C@@]2(C)[C@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)C[C@@H]2OC(C)=O InChI=1S/C32H52O3/c1-19(2)21-12-15-30(7)26(35-20(3)33)18-32(9)22(27(21)30)10-11-24-29(6)16-14-25(34)28(4,5)23(29)13-17-31(24,32)8/h21-27,34H,1,10-18H2,2-9H3/t21-,22+,23-,24+,25-,26-,27+,29-,30+,31+,32+/m0/s1 GLQBBIZGEYZJHO-FAOJOLMRSA-N 50019015 CHEMBL3288086 Cholinesterase >200000 ChEMBL 10.1016/j.bmc.2014.04.050 10.7270/Q28P6220 24835788 Castro, MJ; Richmond, V; Romero, C; Maier, MS; Estévez-Braun, A; Ravelo, AG; Faraoni, MB; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019015 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019015&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644277 103930057 CHEMBL3288086 ZINC29476925 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104387 CC(=O)O[C@H]1C[C@]2(C)[C@H](CC[C@@H]3[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]4CC[C@@]23C)[C@H]2[C@@H](CC[C@]12C)C(=C)C=O InChI=1S/C34H52O5/c1-20(19-35)23-12-15-32(7)28(39-22(3)37)18-34(9)24(29(23)32)10-11-26-31(6)16-14-27(38-21(2)36)30(4,5)25(31)13-17-33(26,34)8/h19,23-29H,1,10-18H2,2-9H3/t23-,24+,25-,26+,27-,28-,29+,31-,32+,33+,34+/m0/s1 WVNFKYOJEUPNMY-OLMWJSBESA-N 50019016 CHEMBL3288087 Cholinesterase >200000 ChEMBL 10.1016/j.bmc.2014.04.050 10.7270/Q28P6220 24835788 Castro, MJ; Richmond, V; Romero, C; Maier, MS; Estévez-Braun, A; Ravelo, AG; Faraoni, MB; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019016 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019016&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644278 103930058 CHEMBL3288087 ZINC29477718 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104388 CC(=C)[C@@H]1CC[C@@]2(C)[C@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](OC(=O)CCCCC(O)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)C[C@@H]2OC(=O)CCCCC(O)=O InChI=1S/C42H66O8/c1-26(2)27-19-22-40(6)32(50-36(48)16-12-10-14-34(45)46)25-42(8)28(37(27)40)17-18-30-39(5)23-21-31(49-35(47)15-11-9-13-33(43)44)38(3,4)29(39)20-24-41(30,42)7/h27-32,37H,1,9-25H2,2-8H3,(H,43,44)(H,45,46)/t27-,28+,29-,30+,31-,32-,37+,39-,40+,41+,42+/m0/s1 WFDSSHLGLSSCAL-RNMYOVDNSA-N 50019012 CHEMBL3288092 Cholinesterase 80600 ChEMBL 10.1016/j.bmc.2014.04.050 10.7270/Q28P6220 24835788 Castro, MJ; Richmond, V; Romero, C; Maier, MS; Estévez-Braun, A; Ravelo, AG; Faraoni, MB; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019012 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019012&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644274 103930054 CHEMBL3288092 ZINC29473899 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104389 C[C@]12CC[C@H]([C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CCC(=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2=O)C(=C)C=O InChI=1S/C30H44O3/c1-18(17-31)19-10-13-28(5)24(33)16-30(7)20(25(19)28)8-9-22-27(4)14-12-23(32)26(2,3)21(27)11-15-29(22,30)6/h17,19-22,25H,1,8-16H2,2-7H3/t19-,20+,21-,22+,25+,27-,28+,29+,30+/m0/s1 PEXSLIJXRWANOX-BIPUANEUSA-N 50019013 CHEMBL3288094 Cholinesterase 21500 ChEMBL 10.1016/j.bmc.2014.04.050 10.7270/Q28P6220 24835788 Castro, MJ; Richmond, V; Romero, C; Maier, MS; Estévez-Braun, A; Ravelo, AG; Faraoni, MB; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019013 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019013&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644275 103930055 CHEMBL3288094 ZINC29474463 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104390 CNC(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1 InChI=1S/C15H21N3O2/c1-15-7-8-17(3)13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2/h5-6,9,13H,7-8H2,1-4H3,(H,16,19)/t13-,15+/m1/s1 PIJVFDBKTWXHHD-HIFRSBDPSA-N 50004000 (3aS,8aR)-1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol-5-yl methylcarbamate::Antilirium::CHEMBL94::Eserine::Physostol::physostigmine Cholinesterase 14 ChEMBL 10.1016/j.bmc.2014.04.050 10.7270/Q28P6220 24835788 Castro, MJ; Richmond, V; Romero, C; Maier, MS; Estévez-Braun, A; Ravelo, AG; Faraoni, MB; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50004000 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50004000&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5983 103917788 27953 CHEMBL94 DB00981 6598 C06535 ZINC33971762 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104391 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 4.0 ChEMBL 10.1016/j.bmc.2014.04.050 10.7270/Q28P6220 24835788 Castro, MJ; Richmond, V; Romero, C; Maier, MS; Estévez-Braun, A; Ravelo, AG; Faraoni, MB; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50101384 NCCCCNCC(=O)Nc1c2ccccc2cc2ccccc12 InChI=1S/C20H23N3O.ClH/c21-11-5-6-12-22-14-19(24)23-20-17-9-3-1-7-15(17)13-16-8-2-4-10-18(16)20;/h1-4,7-10,13,22H,5-6,11-12,14,21H2,(H,23,24);1H YRXWNIRXXBQIPS-UHFFFAOYSA-N 50017944 CHEMBL3289313 Cholinesterase 16 ChEMBL 10.1016/j.bmc.2014.03.045 10.7270/Q2DJ5H6N 24794747 Hong, C; Luo, W; Yao, D; Su, YB; Zhang, X; Tian, RG; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50017944 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50017944&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644024 242041836 CHEMBL3289313 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50101385 NCCCCCCNCC(=O)Nc1c2ccccc2cc2ccccc12 InChI=1S/C22H27N3O.ClH/c23-13-7-1-2-8-14-24-16-21(26)25-22-19-11-5-3-9-17(19)15-18-10-4-6-12-20(18)22;/h3-6,9-12,15,24H,1-2,7-8,13-14,16,23H2,(H,25,26);1H CSTDVZFBSGOBMJ-UHFFFAOYSA-N 50017945 CHEMBL3289314 Cholinesterase 23 ChEMBL 10.1016/j.bmc.2014.03.045 10.7270/Q2DJ5H6N 24794747 Hong, C; Luo, W; Yao, D; Su, YB; Zhang, X; Tian, RG; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50017945 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50017945&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644025 242041837 CHEMBL3289314 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50101386 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 37 ChEMBL 10.1016/j.bmc.2014.03.045 10.7270/Q2DJ5H6N 24794747 Hong, C; Luo, W; Yao, D; Su, YB; Zhang, X; Tian, RG; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50101387 CN(C)CCNCC(=O)Nc1c2ccccc2cc2ccccc12 InChI=1S/C20H23N3O.ClH/c1-23(2)12-11-21-14-19(24)22-20-17-9-5-3-7-15(17)13-16-8-4-6-10-18(16)20;/h3-10,13,21H,11-12,14H2,1-2H3,(H,22,24);1H JVXLBUMLCNFFBS-UHFFFAOYSA-N 50017946 CHEMBL3289311 Cholinesterase 161 ChEMBL 10.1016/j.bmc.2014.03.045 10.7270/Q2DJ5H6N 24794747 Hong, C; Luo, W; Yao, D; Su, YB; Zhang, X; Tian, RG; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50017946 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50017946&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644026 242041838 CHEMBL3289311 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50101388 NCCCNCCCCNCC(=O)Nc1c2ccccc2cc2ccccc12 InChI=1S/C23H30N4O.ClH/c24-12-7-15-25-13-5-6-14-26-17-22(28)27-23-20-10-3-1-8-18(20)16-19-9-2-4-11-21(19)23;/h1-4,8-11,16,25-26H,5-7,12-15,17,24H2,(H,27,28);1H GNLFUNMFKSELLE-UHFFFAOYSA-N 50017947 CHEMBL3289316 Cholinesterase 164 ChEMBL 10.1016/j.bmc.2014.03.045 10.7270/Q2DJ5H6N 24794747 Hong, C; Luo, W; Yao, D; Su, YB; Zhang, X; Tian, RG; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50017947 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50017947&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644028 242041839 CHEMBL3289316 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50101390 NCCCNCC(=O)Nc1c2ccccc2cc2ccccc12 InChI=1S/C19H21N3O.ClH/c20-10-5-11-21-13-18(23)22-19-16-8-3-1-6-14(16)12-15-7-2-4-9-17(15)19;/h1-4,6-9,12,21H,5,10-11,13,20H2,(H,22,23);1H QWVQBMRLEXMIGL-UHFFFAOYSA-N 50017948 CHEMBL3289312 Cholinesterase 280 ChEMBL 10.1016/j.bmc.2014.03.045 10.7270/Q2DJ5H6N 24794747 Hong, C; Luo, W; Yao, D; Su, YB; Zhang, X; Tian, RG; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50017948 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50017948&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644030 242041840 CHEMBL3289312 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50101391 NCCCNCCCNCC(=O)Nc1c2ccccc2cc2ccccc12 InChI=1S/C22H28N4O.ClH/c23-11-5-12-24-13-6-14-25-16-21(27)26-22-19-9-3-1-7-17(19)15-18-8-2-4-10-20(18)22;/h1-4,7-10,15,24-25H,5-6,11-14,16,23H2,(H,26,27);1H VUMVEYBWGIRKDO-UHFFFAOYSA-N 50017949 CHEMBL3289315 Cholinesterase 305 ChEMBL 10.1016/j.bmc.2014.03.045 10.7270/Q2DJ5H6N 24794747 Hong, C; Luo, W; Yao, D; Su, YB; Zhang, X; Tian, RG; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50017949 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50017949&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644032 242041841 CHEMBL3289315 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50101392 OCCCNCC(=O)Nc1c2ccccc2cc2ccccc12 InChI=1S/C19H20N2O2.ClH/c22-11-5-10-20-13-18(23)21-19-16-8-3-1-6-14(16)12-15-7-2-4-9-17(15)19;/h1-4,6-9,12,20,22H,5,10-11,13H2,(H,21,23);1H DWXWBKBMRQUVQL-UHFFFAOYSA-N 50017950 CHEMBL3289310 Cholinesterase 502 ChEMBL 10.1016/j.bmc.2014.03.045 10.7270/Q2DJ5H6N 24794747 Hong, C; Luo, W; Yao, D; Su, YB; Zhang, X; Tian, RG; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50017950 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50017950&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644034 242041842 CHEMBL3289310 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50101393 NCCCNCCCCNCCCNCC(=O)Nc1c2ccccc2cc2ccccc12 InChI=1S/C26H37N5O.ClH/c27-13-7-16-28-14-5-6-15-29-17-8-18-30-20-25(32)31-26-23-11-3-1-9-21(23)19-22-10-2-4-12-24(22)26;/h1-4,9-12,19,28-30H,5-8,13-18,20,27H2,(H,31,32);1H BAJVWBXAINACIV-UHFFFAOYSA-N 50017951 CHEMBL3289317 Cholinesterase 657 ChEMBL 10.1016/j.bmc.2014.03.045 10.7270/Q2DJ5H6N 24794747 Hong, C; Luo, W; Yao, D; Su, YB; Zhang, X; Tian, RG; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50017951 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50017951&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644036 242041843 CHEMBL3289317 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50101397 CN(C)CCNCC(=O)Nc1cccc2ccccc12 InChI=1S/C16H21N3O.ClH/c1-19(2)11-10-17-12-16(20)18-15-9-5-7-13-6-3-4-8-14(13)15;/h3-9,17H,10-12H2,1-2H3,(H,18,20);1H LCGPEUKIBUVBNR-UHFFFAOYSA-N 50017954 CHEMBL3289304 Cholinesterase 4390 ChEMBL 10.1016/j.bmc.2014.03.045 10.7270/Q2DJ5H6N 24794747 Hong, C; Luo, W; Yao, D; Su, YB; Zhang, X; Tian, RG; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50017954 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50017954&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644042 242041846 CHEMBL3289304 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50101400 NCCCCNCC(=O)Nc1cccc2ccccc12 InChI=1S/C16H21N3O.ClH/c17-10-3-4-11-18-12-16(20)19-15-9-5-7-13-6-1-2-8-14(13)15;/h1-2,5-9,18H,3-4,10-12,17H2,(H,19,20);1H NPJZSBZYRKCCHF-UHFFFAOYSA-N 50017956 CHEMBL3289305 Cholinesterase 10280 ChEMBL 10.1016/j.bmc.2014.03.045 10.7270/Q2DJ5H6N 24794747 Hong, C; Luo, W; Yao, D; Su, YB; Zhang, X; Tian, RG; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50017956 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50017956&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644046 242041848 CHEMBL3289305 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50101410 NCCCNCCCCNCC(=O)Nc1cccc2C(=O)c3ccccc3C(=O)c12 InChI=1S/C23H28N4O3.ClH/c24-11-6-14-25-12-3-4-13-26-15-20(28)27-19-10-5-9-18-21(19)23(30)17-8-2-1-7-16(17)22(18)29;/h1-2,5,7-10,25-26H,3-4,6,11-15,24H2,(H,27,28);1H LCQGEBRNNDUSNG-UHFFFAOYSA-N 50017953 CHEMBL3289320 Cholinesterase 32960 ChEMBL 10.1016/j.bmc.2014.03.045 10.7270/Q2DJ5H6N 24794747 Hong, C; Luo, W; Yao, D; Su, YB; Zhang, X; Tian, RG; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50017953 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50017953&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644040 242041845 CHEMBL3289320 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50101448 NCCCNCCCCNCC(=O)Nc1cccc2ccccc12 InChI=1S/C19H28N4O.ClH/c20-11-6-14-21-12-3-4-13-22-15-19(24)23-18-10-5-8-16-7-1-2-9-17(16)18;/h1-2,5,7-10,21-22H,3-4,6,11-15,20H2,(H,23,24);1H ABKTYTWNCCTGNS-UHFFFAOYSA-N 50017958 CHEMBL3289306 Cholinesterase 47550 ChEMBL 10.1016/j.bmc.2014.03.045 10.7270/Q2DJ5H6N 24794747 Hong, C; Luo, W; Yao, D; Su, YB; Zhang, X; Tian, RG; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50017958 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50017958&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644049 242041850 CHEMBL3289306 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50101460 OCCCNCC(=O)Nc1cccc2ccccc12 InChI=1S/C15H18N2O2.ClH/c18-10-4-9-16-11-15(19)17-14-8-3-6-12-5-1-2-7-13(12)14;/h1-3,5-8,16,18H,4,9-11H2,(H,17,19);1H NDPDQQQMDSQGEZ-UHFFFAOYSA-N 50017959 CHEMBL3289303 Cholinesterase >50000 ChEMBL 10.1016/j.bmc.2014.03.045 10.7270/Q2DJ5H6N 24794747 Hong, C; Luo, W; Yao, D; Su, YB; Zhang, X; Tian, RG; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50017959 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50017959&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644051 242041851 CHEMBL3289303 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50101461 NCCCNCCCCNCCCNCC(=O)Nc1cccc2ccccc12 InChI=1S/C22H35N5O.ClH/c23-12-6-15-24-13-3-4-14-25-16-7-17-26-18-22(28)27-21-11-5-9-19-8-1-2-10-20(19)21;/h1-2,5,8-11,24-26H,3-4,6-7,12-18,23H2,(H,27,28);1H MYKNMEDUMMUTES-UHFFFAOYSA-N 50017960 CHEMBL3289307 Cholinesterase >50000 ChEMBL 10.1016/j.bmc.2014.03.045 10.7270/Q2DJ5H6N 24794747 Hong, C; Luo, W; Yao, D; Su, YB; Zhang, X; Tian, RG; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50017960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50017960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644052 242041852 CHEMBL3289307 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50101462 OCCCNCC(=O)Nc1cccc2C(=O)c3ccccc3C(=O)c12 InChI=1S/C19H18N2O4.ClH/c22-10-4-9-20-11-16(23)21-15-8-3-7-14-17(15)19(25)13-6-2-1-5-12(13)18(14)24;/h1-3,5-8,20,22H,4,9-11H2,(H,21,23);1H GJHCVLAYGIXMFL-UHFFFAOYSA-N 50017957 CHEMBL3289318 Cholinesterase >50000 ChEMBL 10.1016/j.bmc.2014.03.045 10.7270/Q2DJ5H6N 24794747 Hong, C; Luo, W; Yao, D; Su, YB; Zhang, X; Tian, RG; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50017957 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50017957&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644048 242041849 CHEMBL3289318 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50101463 NCCCCNCC(=O)Nc1cccc2C(=O)c3ccccc3C(=O)c12 InChI=1S/C20H21N3O3.ClH/c21-10-3-4-11-22-12-17(24)23-16-9-5-8-15-18(16)20(26)14-7-2-1-6-13(14)19(15)25;/h1-2,5-9,22H,3-4,10-12,21H2,(H,23,24);1H XVLBPTVEVXBYTI-UHFFFAOYSA-N 50017952 CHEMBL3289319 Cholinesterase >50000 ChEMBL 10.1016/j.bmc.2014.03.045 10.7270/Q2DJ5H6N 24794747 Hong, C; Luo, W; Yao, D; Su, YB; Zhang, X; Tian, RG; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50017952 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50017952&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644038 242041844 CHEMBL3289319 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50101464 NCCCNCCCCNCCCNCC(=O)Nc1cccc2C(=O)c3ccccc3C(=O)c12 InChI=1S/C26H35N5O3.ClH/c27-12-6-15-28-13-3-4-14-29-16-7-17-30-18-23(32)31-22-11-5-10-21-24(22)26(34)20-9-2-1-8-19(20)25(21)33;/h1-2,5,8-11,28-30H,3-4,6-7,12-18,27H2,(H,31,32);1H UIXNKAMAVCFKCX-UHFFFAOYSA-N 50017955 CHEMBL3289321 Cholinesterase >50000 ChEMBL 10.1016/j.bmc.2014.03.045 10.7270/Q2DJ5H6N 24794747 Hong, C; Luo, W; Yao, D; Su, YB; Zhang, X; Tian, RG; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50017955 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50017955&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644044 242041847 CHEMBL3289321 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104846 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 9370 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104847 Cl.CC1(C)[C@H](CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(O)=O)OC(=O)CN InChI=1S/C32H49NO5.ClH/c1-27(2)22-8-11-32(7)25(30(22,5)10-9-23(27)38-24(35)18-33)21(34)16-19-20-17-29(4,26(36)37)13-12-28(20,3)14-15-31(19,32)6;/h16,20,22-23,25H,8-15,17-18,33H2,1-7H3,(H,36,37);1H/t20-,22-,23-,25+,28+,29-,30-,31+,32+;/m0./s1 JCMKEVXXLFLBFM-LQMROMBFSA-N 50019348 CHEMBL1269517 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019348 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019348&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 52949136 103930319 CHEMBL1269517 ZINC36215449 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104848 Cl.COC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](OC(=O)CN)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 InChI=1S/C33H51NO5.ClH/c1-28(2)23-9-12-33(7)26(31(23,5)11-10-24(28)39-25(36)19-34)22(35)17-20-21-18-30(4,27(37)38-8)14-13-29(21,3)15-16-32(20,33)6;/h17,21,23-24,26H,9-16,18-19,34H2,1-8H3;1H/t21-,23-,24-,26+,29+,30-,31-,32+,33+;/m0./s1 YAWANXGADKFCKF-GWLKGNTBSA-N 50019349 CHEMBL1269532 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019349 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019349&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 52946679 103930320 CHEMBL1269532 ZINC05167618 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104849 Cl.C[C@H](N)C(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2C(=O)C=C2[C@@H]4C[C@](C)(CC[C@]4(C)CC[C@@]32C)C(O)=O)C1(C)C InChI=1S/C33H51NO5.ClH/c1-19(34)26(36)39-24-10-11-31(6)23(28(24,2)3)9-12-33(8)25(31)22(35)17-20-21-18-30(5,27(37)38)14-13-29(21,4)15-16-32(20,33)7;/h17,19,21,23-25H,9-16,18,34H2,1-8H3,(H,37,38);1H/t19-,21-,23-,24-,25+,29+,30-,31-,32+,33+;/m0./s1 TYSSWIVGCOGDNP-BFCASQNWSA-N 50019350 CHEMBL1269518 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019350 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019350&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 52949138 103930321 CHEMBL1269518 ZINC39395225 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104850 Cl.COC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](OC(=O)[C@H](C)N)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 InChI=1S/C34H53NO5.ClH/c1-20(35)27(37)40-25-11-12-32(6)24(29(25,2)3)10-13-34(8)26(32)23(36)18-21-22-19-31(5,28(38)39-9)15-14-30(22,4)16-17-33(21,34)7;/h18,20,22,24-26H,10-17,19,35H2,1-9H3;1H/t20-,22-,24-,25-,26+,30+,31-,32-,33+,34+;/m0./s1 RWOWZMJXFUZILF-YZNCKJOXSA-N 50019352 CHEMBL1269533 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019352 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019352&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 52944238 103930323 CHEMBL1269533 ZINC29411832 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104851 COC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](OC(=O)[C@@H](C)N)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 InChI=1S/C34H53NO5/c1-20(35)27(37)40-25-11-12-32(6)24(29(25,2)3)10-13-34(8)26(32)23(36)18-21-22-19-31(5,28(38)39-9)15-14-30(22,4)16-17-33(21,34)7/h18,20,22,24-26H,10-17,19,35H2,1-9H3/t20-,22+,24+,25+,26-,30-,31+,32+,33-,34-/m1/s1 PFILNRFHVVERBY-SGIMCEGQSA-N 50019353 CHEMBL1269535 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019353 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019353&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 52945466 103930324 CHEMBL1269535 C03317 ZINC29413177 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104852 COC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](OC(=O)[C@@H]6CCCN6)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 InChI=1S/C36H55NO5/c1-31(2)26-11-14-36(7)28(34(26,5)13-12-27(31)42-29(39)24-10-9-19-37-24)25(38)20-22-23-21-33(4,30(40)41-8)16-15-32(23,3)17-18-35(22,36)6/h20,23-24,26-28,37H,9-19,21H2,1-8H3/t23-,24-,26-,27-,28+,32+,33-,34-,35+,36+/m0/s1 RQMGPIZRCLARIR-YCUVPHTGSA-N 50019354 CHEMBL3289469 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019354 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019354&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71619452 242042075 CHEMBL3289469 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104853 COC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](OC(=O)[C@@H](N)Cc6ccccc6)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 InChI=1S/C40H57NO5/c1-35(2)30-14-17-40(7)32(38(30,5)16-15-31(35)46-33(43)28(41)22-25-12-10-9-11-13-25)29(42)23-26-27-24-37(4,34(44)45-8)19-18-36(27,3)20-21-39(26,40)6/h9-13,23,27-28,30-32H,14-22,24,41H2,1-8H3/t27-,28-,30-,31-,32+,36+,37-,38-,39+,40+/m0/s1 ZNEHQDREEGGBJP-SJYWEGTMSA-N 50019356 CHEMBL3289470 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019356 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019356&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71619545 242042076 CHEMBL3289470 C03317 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104854 CCOC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](OC(=O)[C@H](Cc6ccccc6)NC(=O)OC(C)(C)C)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 InChI=1S/C46H67NO7/c1-12-52-38(50)43(8)23-22-42(7)24-25-45(10)30(31(42)28-43)27-33(48)36-44(9)20-19-35(41(5,6)34(44)18-21-46(36,45)11)53-37(49)32(26-29-16-14-13-15-17-29)47-39(51)54-40(2,3)4/h13-17,27,31-32,34-36H,12,18-26,28H2,1-11H3,(H,47,51)/t31-,32-,34-,35-,36+,42+,43-,44-,45+,46+/m0/s1 YGHMONWOVYVKOV-VBTQCZFOSA-N 50019357 CHEMBL3289710 Cholinesterase >2000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019357 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019357&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644371 103930326 CHEMBL3289710 ZINC27197979 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104855 CCOC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](OC(=O)[C@@H](N)Cc6ccccc6)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 InChI=1S/C41H59NO5/c1-9-46-35(45)38(5)20-19-37(4)21-22-40(7)27(28(37)25-38)24-30(43)33-39(6)17-16-32(36(2,3)31(39)15-18-41(33,40)8)47-34(44)29(42)23-26-13-11-10-12-14-26/h10-14,24,28-29,31-33H,9,15-23,25,42H2,1-8H3/t28-,29-,31-,32-,33+,37+,38-,39-,40+,41+/m0/s1 YSJHTFGZBULHSD-ZTQKKLPLSA-N 50019360 CHEMBL3289711 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019360 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019360&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644372 103930329 CHEMBL3289711 C03317 ZINC27202868 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104856 CNCC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2C(=O)C=C2[C@@H]4C[C@](C)(CC[C@]4(C)CC[C@@]32C)C(=O)OC)C1(C)C InChI=1S/C34H53NO5/c1-29(2)24-10-13-34(7)27(32(24,5)12-11-25(29)40-26(37)20-35-8)23(36)18-21-22-19-31(4,28(38)39-9)15-14-30(22,3)16-17-33(21,34)6/h18,22,24-25,27,35H,10-17,19-20H2,1-9H3/t22-,24-,25-,27+,30+,31-,32-,33+,34+/m0/s1 GRFISUHGNXTIQQ-AWTOMRQRSA-N 50019361 CHEMBL3289712 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019361 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019361&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71619451 103930330 CHEMBL3289712 ZINC27193271 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104857 CCOC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](OC(=O)[C@H](N)Cc6c[nH]c7ccccc67)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 InChI=1S/C43H60N2O5/c1-9-49-37(48)40(5)19-18-39(4)20-21-42(7)28(29(39)24-40)23-32(46)35-41(6)16-15-34(38(2,3)33(41)14-17-43(35,42)8)50-36(47)30(44)22-26-25-45-31-13-11-10-12-27(26)31/h10-13,23,25,29-30,33-35,45H,9,14-22,24,44H2,1-8H3/t29-,30+,33-,34-,35+,39+,40-,41-,42+,43+/m0/s1 OSJQXWILHFFBDU-NPVIHDMJSA-N 50019363 CHEMBL3289713 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019363 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019363&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644373 103930332 CHEMBL3289713 C03317 ZINC27196037 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104858 COC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](OC(=O)[C@@H](N)CSCc6ccccc6)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 InChI=1S/C41H59NO5S/c1-36(2)31-14-17-41(7)33(39(31,5)16-15-32(36)47-34(44)29(42)25-48-24-26-12-10-9-11-13-26)30(43)22-27-28-23-38(4,35(45)46-8)19-18-37(28,3)20-21-40(27,41)6/h9-13,22,28-29,31-33H,14-21,23-25,42H2,1-8H3/t28-,29-,31-,32-,33+,37+,38-,39-,40+,41+/m0/s1 AJNPCTJCSHHACY-ZTQKKLPLSA-N 50019371 CHEMBL2151725 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019371 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019371&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56930188 103930340 CHEMBL2151725 C03317 ZINC12359680 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104859 COC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](OC(=O)[C@@H](N)CCN)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 InChI=1S/C35H56N2O5/c1-30(2)25-9-13-35(7)27(33(25,5)12-10-26(30)42-28(39)23(37)11-18-36)24(38)19-21-22-20-32(4,29(40)41-8)15-14-31(22,3)16-17-34(21,35)6/h19,22-23,25-27H,9-18,20,36-37H2,1-8H3/t22-,23-,25-,26-,27+,31+,32-,33-,34+,35+/m0/s1 TWMXGZWEISILIC-LXYXONKRSA-N 50019373 CHEMBL3289714 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019373 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019373&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71619757 103930342 CHEMBL3289714 C03317 ZINC27193276 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104860 CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(O)=O InChI=1S/C30H46O4/c1-25(2)21-8-11-30(7)23(28(21,5)10-9-22(25)32)20(31)16-18-19-17-27(4,24(33)34)13-12-26(19,3)14-15-29(18,30)6/h16,19,21-23,32H,8-15,17H2,1-7H3,(H,33,34)/t19-,21-,22-,23+,26+,27-,28-,29+,30+/m0/s1 MPDGHEJMBKOTSU-YKLVYJNSSA-N 50233538 18beta-glycyrrhetic acid::3beta-hydroxy-11-oxoolean-12-en-30-oic acid::CHEMBL230006::US11660306, Example 18beta Glycyrrhetinic acid::glycyrrhetinic acid Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50233538 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50233538&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search CBW 5C71,4PV5,2W4Q 10114 104055693 30853 CHEMBL230006 C02283 ZINC19203131 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104861 COC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](OC(=O)[C@@H](N)CCCCN)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 InChI=1S/C37H60N2O5/c1-32(2)27-12-15-37(7)29(35(27,5)14-13-28(32)44-30(41)25(39)11-9-10-20-38)26(40)21-23-24-22-34(4,31(42)43-8)17-16-33(24,3)18-19-36(23,37)6/h21,24-25,27-29H,9-20,22,38-39H2,1-8H3/t24-,25-,27-,28-,29+,33+,34-,35-,36+,37+/m0/s1 OGTXRRMPMYDBMT-WDIPUWLYSA-N 50019381 CHEMBL3289716 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019381 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019381&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71619759 103930350 CHEMBL3289716 C03317 ZINC27524012 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104862 Cl.COC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](OC(=O)[C@@H](N)CCC(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 InChI=1S/C36H55NO7.ClH/c1-31(2)25-11-14-36(7)28(34(25,5)13-12-26(31)44-29(41)23(37)9-10-27(39)40)24(38)19-21-22-20-33(4,30(42)43-8)16-15-32(22,3)17-18-35(21,36)6;/h19,22-23,25-26,28H,9-18,20,37H2,1-8H3,(H,39,40);1H/t22-,23-,25-,26-,28+,32+,33-,34-,35+,36+;/m0./s1 KWIXKAAGOYKAOV-YSIOMAOMSA-N 50019382 CHEMBL3289717 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019382 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019382&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53473621 103930351 CHEMBL3289717 ZINC27525132 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104863 COC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](OC(=O)[C@@H](N)CCC(=O)OCc6ccccc6)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 InChI=1S/C43H61NO7/c1-38(2)32-16-19-43(7)35(31(45)24-28-29-25-40(4,37(48)49-8)21-20-39(29,3)22-23-42(28,43)6)41(32,5)18-17-33(38)51-36(47)30(44)14-15-34(46)50-26-27-12-10-9-11-13-27/h9-13,24,29-30,32-33,35H,14-23,25-26,44H2,1-8H3/t29-,30-,32-,33-,35+,39+,40-,41-,42+,43+/m0/s1 FHLUPNCWSRMRAC-FHNBYQFJSA-N 50019383 CHEMBL3289718 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019383 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019383&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53473524 103930352 CHEMBL3289718 C03317 ZINC27523941 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104864 Cl.COC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](OC(=O)[C@@H](N)CC(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 InChI=1S/C35H53NO7.ClH/c1-30(2)24-9-12-35(7)27(33(24,5)11-10-25(30)43-28(40)22(36)18-26(38)39)23(37)17-20-21-19-32(4,29(41)42-8)14-13-31(21,3)15-16-34(20,35)6;/h17,21-22,24-25,27H,9-16,18-19,36H2,1-8H3,(H,38,39);1H/t21-,22-,24-,25-,27+,31+,32-,33-,34+,35+;/m0./s1 NDJKXSGBEBFEPL-RSEOUFHTSA-N 50019384 CHEMBL3289720 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019384 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019384&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53473619 103930353 CHEMBL3289720 ZINC06091787 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104865 COC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](OC(=O)[C@@H](N)CC(=O)OCc6ccccc6)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 InChI=1S/C42H59NO7/c1-37(2)31-14-17-42(7)34(30(44)22-27-28-24-39(4,36(47)48-8)19-18-38(28,3)20-21-41(27,42)6)40(31,5)16-15-32(37)50-35(46)29(43)23-33(45)49-25-26-12-10-9-11-13-26/h9-13,22,28-29,31-32,34H,14-21,23-25,43H2,1-8H3/t28-,29-,31-,32-,34+,38+,39-,40-,41+,42+/m0/s1 UUUWWGUYRAWBRB-HPPZXAQFSA-N 50019390 CHEMBL3289721 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019390 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019390&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53473523 242042077 CHEMBL3289721 C03317 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104866 CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(=O)OCCBr InChI=1S/C32H49BrO4/c1-27(2)23-8-11-32(7)25(30(23,5)10-9-24(27)35)22(34)18-20-21-19-29(4,26(36)37-17-16-33)13-12-28(21,3)14-15-31(20,32)6/h18,21,23-25,35H,8-17,19H2,1-7H3/t21-,23-,24-,25+,28+,29-,30-,31+,32+/m0/s1 BQAKSUMTOOZHQG-XWEVEMRCSA-N 50019391 CHEMBL3289723 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019391 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019391&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57327753 242042078 CHEMBL3289723 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104867 CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(=O)OCCC=C InChI=1S/C34H52O4/c1-9-10-19-38-28(37)31(5)16-15-30(4)17-18-33(7)22(23(30)21-31)20-24(35)27-32(6)13-12-26(36)29(2,3)25(32)11-14-34(27,33)8/h9,20,23,25-27,36H,1,10-19,21H2,2-8H3/t23-,25-,26-,27+,30+,31-,32-,33+,34+/m0/s1 LBJFMELQLNDMGE-JYVVQSDUSA-N 50019338 CHEMBL2024627 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019338 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019338&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57327828 103930309 CHEMBL2024627 ZINC27867672 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104868 CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(=O)OC\C=C\CBr InChI=1S/C34H51BrO4/c1-29(2)25-10-13-34(7)27(32(25,5)12-11-26(29)37)24(36)20-22-23-21-31(4,28(38)39-19-9-8-18-35)15-14-30(23,3)16-17-33(22,34)6/h8-9,20,23,25-27,37H,10-19,21H2,1-7H3/b9-8+/t23-,25-,26-,27+,30+,31-,32-,33+,34+/m0/s1 QXKIVQKIDVKKTD-GTBRJVQMSA-N 50019339 CHEMBL3289724 Cholinesterase >40000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019339 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019339&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57327827 103930310 CHEMBL3289724 ZINC27864800 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104869 CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(=O)OCCCCCCBr InChI=1S/C36H57BrO4/c1-31(2)27-12-15-36(7)29(34(27,5)14-13-28(31)39)26(38)22-24-25-23-33(4,30(40)41-21-11-9-8-10-20-37)17-16-32(25,3)18-19-35(24,36)6/h22,25,27-29,39H,8-21,23H2,1-7H3/t25-,27-,28-,29+,32+,33-,34-,35+,36+/m0/s1 IXPQOVLMLPXTNL-KNPCULJYSA-N 50019340 CHEMBL3289725 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019340 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019340&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57327826 103930311 CHEMBL3289725 ZINC27874175 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104870 CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(=O)NCCN InChI=1S/C32H52N2O3/c1-27(2)23-8-11-32(7)25(30(23,5)10-9-24(27)36)22(35)18-20-21-19-29(4,26(37)34-17-16-33)13-12-28(21,3)14-15-31(20,32)6/h18,21,23-25,36H,8-17,19,33H2,1-7H3,(H,34,37)/t21-,23-,24-,25+,28+,29-,30-,31+,32+/m0/s1 HFRQHSFQIRQETC-XWEVEMRCSA-N 50019341 CHEMBL1836976 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019341 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019341&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56662191 103930312 CHEMBL1836976 ZINC27862030 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104871 CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(=O)NCCCN InChI=1S/C33H54N2O3/c1-28(2)24-9-12-33(7)26(31(24,5)11-10-25(28)37)23(36)19-21-22-20-30(4,27(38)35-18-8-17-34)14-13-29(22,3)15-16-32(21,33)6/h19,22,24-26,37H,8-18,20,34H2,1-7H3,(H,35,38)/t22-,24-,25-,26+,29+,30-,31-,32+,33+/m0/s1 AICJYSXUHPYYBI-IREBYWSLSA-N 50019342 CHEMBL3289726 Cholinesterase 5430 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019342 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019342&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57327751 103930313 CHEMBL3289726 ZINC27878888 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104872 CC(C)(C)OC(=O)NCCCNC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 InChI=1S/C38H62N2O5/c1-32(2,3)45-31(44)40-21-11-20-39-30(43)35(7)17-16-34(6)18-19-37(9)24(25(34)23-35)22-26(41)29-36(8)14-13-28(42)33(4,5)27(36)12-15-38(29,37)10/h22,25,27-29,42H,11-21,23H2,1-10H3,(H,39,43)(H,40,44)/t25-,27-,28-,29+,34+,35-,36-,37+,38+/m0/s1 TXOXODKTTKQDPA-PZPBRRGHSA-N 50019343 CHEMBL3289727 Cholinesterase >10000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019343 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019343&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57327752 103930314 CHEMBL3289727 ZINC02014158 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104873 CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(=O)NCCCCN InChI=1S/C34H56N2O3/c1-29(2)25-10-13-34(7)27(32(25,5)12-11-26(29)38)24(37)20-22-23-21-31(4,28(39)36-19-9-8-18-35)15-14-30(23,3)16-17-33(22,34)6/h20,23,25-27,38H,8-19,21,35H2,1-7H3,(H,36,39)/t23-,25-,26-,27+,30+,31-,32-,33+,34+/m0/s1 PVWSDFWXQOAOCN-JYVVQSDUSA-N 50019344 CHEMBL3289728 Cholinesterase 74300 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019344 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019344&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57327750 103930315 CHEMBL3289728 ZINC34800967 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104874 CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(=O)NCCCCCN InChI=1S/C35H58N2O3/c1-30(2)26-11-14-35(7)28(33(26,5)13-12-27(30)39)25(38)21-23-24-22-32(4,29(40)37-20-10-8-9-19-36)16-15-31(24,3)17-18-34(23,35)6/h21,24,26-28,39H,8-20,22,36H2,1-7H3,(H,37,40)/t24-,26-,27-,28+,31+,32-,33-,34+,35+/m0/s1 RXVHRXIOSJNPAK-JOKULHESSA-N 50019345 CHEMBL3289729 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019345 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019345&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644369 103930316 CHEMBL3289729 ZINC05765273 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104876 C[C@]12CC[C@@](C)(C[C@H]1C1=CC(=O)[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(=O)O\C(NC1CCCCC1)=N/C1CCCCC1 InChI=1S/C43H68N2O4/c1-38(2)33-18-21-43(7)35(41(33,5)20-19-34(38)47)32(46)26-30-31-27-40(4,23-22-39(31,3)24-25-42(30,43)6)36(48)49-37(44-28-14-10-8-11-15-28)45-29-16-12-9-13-17-29/h26,28-29,31,33-35,47H,8-25,27H2,1-7H3,(H,44,45)/t31-,33-,34-,35+,39+,40-,41-,42+,43+/m0/s1 XGTJWNVNQGTBDI-MQXHQLTJSA-N 50019346 CHEMBL3289730 Cholinesterase >10000 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019346 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019346&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644370 103930317 CHEMBL3289730 ZINC34800965 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50104879 CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(=O)On1nnc2ccccc12 InChI=1S/C36H49N3O4/c1-31(2)27-12-15-36(7)29(34(27,5)14-13-28(31)41)26(40)20-22-23-21-33(4,17-16-32(23,3)18-19-35(22,36)6)30(42)43-39-25-11-9-8-10-24(25)37-38-39/h8-11,20,23,27-29,41H,12-19,21H2,1-7H3/t23-,27-,28-,29+,32+,33-,34-,35+,36+/m0/s1 XEVYSBZDMALPKK-DIULBLBCSA-N 50019347 CHEMBL3289731 Cholinesterase 9810 ChEMBL 10.1016/j.bmc.2014.04.046 10.7270/Q26Q1ZTF 24853320 Schwarz, S; Lucas, SD; Sommerwerk, S; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50019347 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50019347&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71677400 103930318 CHEMBL3289731 ZINC36215466 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50107653 O=C(CCCOc1ccc2ccc(=O)oc2c1)N1CCN(CC1)c1ccccc1 InChI=1S/C23H24N2O4/c26-22(25-14-12-24(13-15-25)19-5-2-1-3-6-19)7-4-16-28-20-10-8-18-9-11-23(27)29-21(18)17-20/h1-3,5-6,8-11,17H,4,7,12-16H2 SYHBCRQRXZTJAB-UHFFFAOYSA-N 50020733 CHEMBL3286721 Cholinesterase 120000 ChEMBL 10.1016/j.ejmech.2014.05.056 10.7270/Q27D2WQV 24941128 Alipour, M; Khoobi, M; Moradi, A; Nadri, H; Homayouni Moghadam, F; Emami, S; Hasanpour, Z; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50020733 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50020733&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644890 103931478 CHEMBL3286721 ZINC29478251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50107655 Oc1ccccc1N1CCN(CC1)C(=O)CCCOc1ccc2ccc(=O)oc2c1 InChI=1S/C23H24N2O5/c26-20-5-2-1-4-19(20)24-11-13-25(14-12-24)22(27)6-3-15-29-18-9-7-17-8-10-23(28)30-21(17)16-18/h1-2,4-5,7-10,16,26H,3,6,11-15H2 MBPSPTSVKOOZAY-UHFFFAOYSA-N 50020734 CHEMBL3286722 Cholinesterase 280000 ChEMBL 10.1016/j.ejmech.2014.05.056 10.7270/Q27D2WQV 24941128 Alipour, M; Khoobi, M; Moradi, A; Nadri, H; Homayouni Moghadam, F; Emami, S; Hasanpour, Z; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50020734 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50020734&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644891 103931479 CHEMBL3286722 ZINC29471067 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50107656 Fc1ccccc1N1CCN(CC1)C(=O)CCCOc1ccc2ccc(=O)oc2c1 InChI=1S/C23H23FN2O4/c24-19-4-1-2-5-20(19)25-11-13-26(14-12-25)22(27)6-3-15-29-18-9-7-17-8-10-23(28)30-21(17)16-18/h1-2,4-5,7-10,16H,3,6,11-15H2 YHOCWZPXLDKWFZ-UHFFFAOYSA-N 50020735 CHEMBL3286723 Cholinesterase 15000 ChEMBL 10.1016/j.ejmech.2014.05.056 10.7270/Q27D2WQV 24941128 Alipour, M; Khoobi, M; Moradi, A; Nadri, H; Homayouni Moghadam, F; Emami, S; Hasanpour, Z; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50020735 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50020735&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644892 242042301 CHEMBL3286723 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50107657 Fc1ccc(cc1)N1CCN(CC1)C(=O)CCCOc1ccc2ccc(=O)oc2c1 InChI=1S/C23H23FN2O4/c24-18-5-7-19(8-6-18)25-11-13-26(14-12-25)22(27)2-1-15-29-20-9-3-17-4-10-23(28)30-21(17)16-20/h3-10,16H,1-2,11-15H2 XNBKEQHQCLFXBY-UHFFFAOYSA-N 50020736 CHEMBL3286724 Cholinesterase 75000 ChEMBL 10.1016/j.ejmech.2014.05.056 10.7270/Q27D2WQV 24941128 Alipour, M; Khoobi, M; Moradi, A; Nadri, H; Homayouni Moghadam, F; Emami, S; Hasanpour, Z; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50020736 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50020736&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644893 242042302 CHEMBL3286724 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50107659 Clc1ccc(cc1Cl)N1CCN(CC1)C(=O)CCCOc1ccc2ccc(=O)oc2c1 InChI=1S/C23H22Cl2N2O4/c24-19-7-5-17(14-20(19)25)26-9-11-27(12-10-26)22(28)2-1-13-30-18-6-3-16-4-8-23(29)31-21(16)15-18/h3-8,14-15H,1-2,9-13H2 UBMWAMCPOIJFTL-UHFFFAOYSA-N 50020737 CHEMBL3286725 Cholinesterase 80000 ChEMBL 10.1016/j.ejmech.2014.05.056 10.7270/Q27D2WQV 24941128 Alipour, M; Khoobi, M; Moradi, A; Nadri, H; Homayouni Moghadam, F; Emami, S; Hasanpour, Z; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50020737 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50020737&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644894 242042303 CHEMBL3286725 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50107660 O=C(CCCOc1ccc2ccc(=O)oc2c1)N1CCC(Cc2ccccc2)CC1 InChI=1S/C25H27NO4/c27-24(26-14-12-20(13-15-26)17-19-5-2-1-3-6-19)7-4-16-29-22-10-8-21-9-11-25(28)30-23(21)18-22/h1-3,5-6,8-11,18,20H,4,7,12-17H2 GJVAFWHEAOFOAU-UHFFFAOYSA-N 50020738 CHEMBL3286726 Cholinesterase 387000 ChEMBL 10.1016/j.ejmech.2014.05.056 10.7270/Q27D2WQV 24941128 Alipour, M; Khoobi, M; Moradi, A; Nadri, H; Homayouni Moghadam, F; Emami, S; Hasanpour, Z; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50020738 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50020738&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644895 242042304 CHEMBL3286726 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50107661 OC1(CCN(CC1)C(=O)CCCOc1ccc2ccc(=O)oc2c1)c1ccc(Br)cc1 InChI=1S/C24H24BrNO5/c25-19-7-5-18(6-8-19)24(29)11-13-26(14-12-24)22(27)2-1-15-30-20-9-3-17-4-10-23(28)31-21(17)16-20/h3-10,16,29H,1-2,11-15H2 KOBHORUUTSCXEH-UHFFFAOYSA-N 50020739 CHEMBL3286727 Cholinesterase 180000 ChEMBL 10.1016/j.ejmech.2014.05.056 10.7270/Q27D2WQV 24941128 Alipour, M; Khoobi, M; Moradi, A; Nadri, H; Homayouni Moghadam, F; Emami, S; Hasanpour, Z; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50020739 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50020739&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644896 242042305 CHEMBL3286727 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50107665 Cc1cc(=O)oc2cc(OCCCC(=O)N3CCN(CC3)c3ccccc3)ccc12 InChI=1S/C24H26N2O4/c1-18-16-24(28)30-22-17-20(9-10-21(18)22)29-15-5-8-23(27)26-13-11-25(12-14-26)19-6-3-2-4-7-19/h2-4,6-7,9-10,16-17H,5,8,11-15H2,1H3 IXMMPFRXJWSRMJ-UHFFFAOYSA-N 50020740 CHEMBL3286728 Cholinesterase 68000 ChEMBL 10.1016/j.ejmech.2014.05.056 10.7270/Q27D2WQV 24941128 Alipour, M; Khoobi, M; Moradi, A; Nadri, H; Homayouni Moghadam, F; Emami, S; Hasanpour, Z; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50020740 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50020740&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644897 242042306 CHEMBL3286728 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50107666 Cc1cc(=O)oc2cc(OCCCC(=O)N3CCN(CC3)c3ccccc3O)ccc12 InChI=1S/C24H26N2O5/c1-17-15-24(29)31-22-16-18(8-9-19(17)22)30-14-4-7-23(28)26-12-10-25(11-13-26)20-5-2-3-6-21(20)27/h2-3,5-6,8-9,15-16,27H,4,7,10-14H2,1H3 SYBPUPHIQWIZSD-UHFFFAOYSA-N 50020741 CHEMBL3286941 Cholinesterase 184000 ChEMBL 10.1016/j.ejmech.2014.05.056 10.7270/Q27D2WQV 24941128 Alipour, M; Khoobi, M; Moradi, A; Nadri, H; Homayouni Moghadam, F; Emami, S; Hasanpour, Z; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50020741 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50020741&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644898 242042307 CHEMBL3286941 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50107669 Cc1cc(=O)oc2cc(OCCCC(=O)N3CCN(CC3)c3ccccc3F)ccc12 InChI=1S/C24H25FN2O4/c1-17-15-24(29)31-22-16-18(8-9-19(17)22)30-14-4-7-23(28)27-12-10-26(11-13-27)21-6-3-2-5-20(21)25/h2-3,5-6,8-9,15-16H,4,7,10-14H2,1H3 MBMAEDCVHBFWRB-UHFFFAOYSA-N 50020742 CHEMBL3286942 Cholinesterase 29000 ChEMBL 10.1016/j.ejmech.2014.05.056 10.7270/Q27D2WQV 24941128 Alipour, M; Khoobi, M; Moradi, A; Nadri, H; Homayouni Moghadam, F; Emami, S; Hasanpour, Z; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50020742 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50020742&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644899 242042308 CHEMBL3286942 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50107709 Cc1cc(=O)oc2cc(OCCCC(=O)N3CCN(CC3)c3ccc(F)cc3)ccc12 InChI=1S/C24H25FN2O4/c1-17-15-24(29)31-22-16-20(8-9-21(17)22)30-14-2-3-23(28)27-12-10-26(11-13-27)19-6-4-18(25)5-7-19/h4-9,15-16H,2-3,10-14H2,1H3 DMWFBAOSXMVGFU-UHFFFAOYSA-N 50020744 CHEMBL3286943 Cholinesterase 24000 ChEMBL 10.1016/j.ejmech.2014.05.056 10.7270/Q27D2WQV 24941128 Alipour, M; Khoobi, M; Moradi, A; Nadri, H; Homayouni Moghadam, F; Emami, S; Hasanpour, Z; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50020744 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50020744&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644900 242042309 CHEMBL3286943 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50107710 Cc1cc(=O)oc2cc(OCCCC(=O)N3CCN(CC3)c3ccc(Cl)c(Cl)c3)ccc12 InChI=1S/C24H24Cl2N2O4/c1-16-13-24(30)32-22-15-18(5-6-19(16)22)31-12-2-3-23(29)28-10-8-27(9-11-28)17-4-7-20(25)21(26)14-17/h4-7,13-15H,2-3,8-12H2,1H3 UKFYJPDSZJDQJK-UHFFFAOYSA-N 50020745 CHEMBL3286944 Cholinesterase 250000 ChEMBL 10.1016/j.ejmech.2014.05.056 10.7270/Q27D2WQV 24941128 Alipour, M; Khoobi, M; Moradi, A; Nadri, H; Homayouni Moghadam, F; Emami, S; Hasanpour, Z; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50020745 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50020745&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644901 242042310 CHEMBL3286944 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50107711 Cc1cc(=O)oc2cc(OCCCC(=O)N3CCC(O)(CC3)c3ccc(Br)cc3)ccc12 InChI=1S/C25H26BrNO5/c1-17-15-24(29)32-22-16-20(8-9-21(17)22)31-14-2-3-23(28)27-12-10-25(30,11-13-27)18-4-6-19(26)7-5-18/h4-9,15-16,30H,2-3,10-14H2,1H3 CQSSKKKLMZMKIC-UHFFFAOYSA-N 50020746 CHEMBL3286945 Cholinesterase 141000 ChEMBL 10.1016/j.ejmech.2014.05.056 10.7270/Q27D2WQV 24941128 Alipour, M; Khoobi, M; Moradi, A; Nadri, H; Homayouni Moghadam, F; Emami, S; Hasanpour, Z; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50020746 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50020746&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644902 242042311 CHEMBL3286945 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50107712 O=C(COc1ccc2ccc(=O)oc2c1)N1CCN(CC1)c1ccccc1 InChI=1S/C21H20N2O4/c24-20(23-12-10-22(11-13-23)17-4-2-1-3-5-17)15-26-18-8-6-16-7-9-21(25)27-19(16)14-18/h1-9,14H,10-13,15H2 XWBYTAVVLCPXRQ-UHFFFAOYSA-N 50020747 CHEMBL1618958 Cholinesterase 50000 ChEMBL 10.1016/j.ejmech.2014.05.056 10.7270/Q27D2WQV 24941128 Alipour, M; Khoobi, M; Moradi, A; Nadri, H; Homayouni Moghadam, F; Emami, S; Hasanpour, Z; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50020747 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50020747&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 2127990 242042312 CHEMBL1618958 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50107739 Fc1ccccc1N1CCN(CC1)C(=O)COc1ccc2ccc(=O)oc2c1 InChI=1S/C21H19FN2O4/c22-17-3-1-2-4-18(17)23-9-11-24(12-10-23)20(25)14-27-16-7-5-15-6-8-21(26)28-19(15)13-16/h1-8,13H,9-12,14H2 ZFSCLEITUUKAOO-UHFFFAOYSA-N 50020748 CHEMBL3286946 Cholinesterase 86000 ChEMBL 10.1016/j.ejmech.2014.05.056 10.7270/Q27D2WQV 24941128 Alipour, M; Khoobi, M; Moradi, A; Nadri, H; Homayouni Moghadam, F; Emami, S; Hasanpour, Z; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50020748 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50020748&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 8882232 242042313 CHEMBL3286946 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50107745 Clc1ccc(cc1Cl)N1CCN(CC1)C(=O)COc1ccc2ccc(=O)oc2c1 InChI=1S/C21H18Cl2N2O4/c22-17-5-3-15(11-18(17)23)24-7-9-25(10-8-24)20(26)13-28-16-4-1-14-2-6-21(27)29-19(14)12-16/h1-6,11-12H,7-10,13H2 CZAOPTAYVPVWMU-UHFFFAOYSA-N 50020749 CHEMBL3286947 Cholinesterase 120000 ChEMBL 10.1016/j.ejmech.2014.05.056 10.7270/Q27D2WQV 24941128 Alipour, M; Khoobi, M; Moradi, A; Nadri, H; Homayouni Moghadam, F; Emami, S; Hasanpour, Z; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50020749 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50020749&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90644903 242042314 CHEMBL3286947 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50107748 O=C(COc1ccc2ccc(=O)oc2c1)N1CCC(Cc2ccccc2)CC1 InChI=1S/C23H23NO4/c25-22(16-27-20-8-6-19-7-9-23(26)28-21(19)15-20)24-12-10-18(11-13-24)14-17-4-2-1-3-5-17/h1-9,15,18H,10-14,16H2 AFYUSUGJPGFUQV-UHFFFAOYSA-N 50020731 CHEMBL3286948 Cholinesterase 46000 ChEMBL 10.1016/j.ejmech.2014.05.056 10.7270/Q27D2WQV 24941128 Alipour, M; Khoobi, M; Moradi, A; Nadri, H; Homayouni Moghadam, F; Emami, S; Hasanpour, Z; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50020731 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50020731&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 2705112 103931476 CHEMBL3286948 ZINC44281278 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50107750 O=C(COc1ccc2ccc(=O)oc2c1)NC1CCN(Cc2ccccc2)CC1 InChI=1S/C23H24N2O4/c26-22(16-28-20-8-6-18-7-9-23(27)29-21(18)14-20)24-19-10-12-25(13-11-19)15-17-4-2-1-3-5-17/h1-9,14,19H,10-13,15-16H2,(H,24,26) MVCKXQFHISXNGD-UHFFFAOYSA-N 50020730 CHEMBL1469070 Cholinesterase 42000 ChEMBL 10.1016/j.ejmech.2014.05.056 10.7270/Q27D2WQV 24941128 Alipour, M; Khoobi, M; Moradi, A; Nadri, H; Homayouni Moghadam, F; Emami, S; Hasanpour, Z; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50020730 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50020730&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 4907863 103931475 CHEMBL1469070 ZINC29470652 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50107770 COc1ccc(CCNC(=O)COc2ccc3ccc(=O)oc3c2)cc1OC InChI=1S/C21H21NO6/c1-25-17-7-3-14(11-19(17)26-2)9-10-22-20(23)13-27-16-6-4-15-5-8-21(24)28-18(15)12-16/h3-8,11-12H,9-10,13H2,1-2H3,(H,22,23) SMAHNNPUOLFRRS-UHFFFAOYSA-N 50020732 CHEMBL3286949 Cholinesterase 163000 ChEMBL 10.1016/j.ejmech.2014.05.056 10.7270/Q27D2WQV 24941128 Alipour, M; Khoobi, M; Moradi, A; Nadri, H; Homayouni Moghadam, F; Emami, S; Hasanpour, Z; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50020732 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50020732&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 2705140 103931477 CHEMBL3286949 ZINC29468540 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50107771 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 7300 ChEMBL 10.1016/j.ejmech.2014.05.056 10.7270/Q27D2WQV 24941128 Alipour, M; Khoobi, M; Moradi, A; Nadri, H; Homayouni Moghadam, F; Emami, S; Hasanpour, Z; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50182522 C[C@H](N(C)C)C1=CC[C@H]2[C@@H]3CC[C@H]4[C@@H](OC(C)=O)[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)NC(=O)C=C(C)C InChI=1S/C30H48N2O3/c1-18(2)17-27(34)31-26-14-16-30(6)24-13-15-29(5)22(19(3)32(7)8)11-12-23(29)21(24)9-10-25(30)28(26)35-20(4)33/h11,17,19,21,23-26,28H,9-10,12-16H2,1-8H3,(H,31,34)/t19-,21-,23-,24-,25-,26-,28+,29+,30+/m0/s1 SYWAOYCXRQDRLP-ULERWODGSA-N 50242345 CHEMBL460447::[(20S)-20-(N,N-dimethylamino)-3 beta-(senecioylamino)-5 alpha-pregn-16-en-4 beta-yl acetate] Cholinesterase 10000 ChEMBL 10.1021/np000466v 10.7270/Q20R9P54 11421762 Kalauni, SK; Choudhary, MI; Shaheen, F; Manandhar, MD; Atta-ur-Rahman, A; Gewali, MB; Khalid, A Tribhuvan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50242345 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50242345&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10051046 104099035 CHEMBL460447 ZINC27443193 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50182524 CNC(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1 InChI=1S/C15H21N3O2/c1-15-7-8-17(3)13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2/h5-6,9,13H,7-8H2,1-4H3,(H,16,19)/t13-,15+/m1/s1 PIJVFDBKTWXHHD-HIFRSBDPSA-N 50004000 (3aS,8aR)-1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol-5-yl methylcarbamate::Antilirium::CHEMBL94::Eserine::Physostol::physostigmine Cholinesterase 857 ChEMBL 10.1021/np000466v 10.7270/Q20R9P54 11421762 Kalauni, SK; Choudhary, MI; Shaheen, F; Manandhar, MD; Atta-ur-Rahman, A; Gewali, MB; Khalid, A Tribhuvan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50004000 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50004000&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5983 103917788 27953 CHEMBL94 DB00981 6598 C06535 ZINC33971762 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50182525 CN[C@@H](C)C1=CC[C@H]2[C@@H]3CC[C@H]4[C@@H](OC(C)=O)[C@@H](NC(=O)C(\C)=C\C)[C@H](C[C@]4(C)[C@H]3CC[C@]12C)OC(C)=O InChI=1S/C31H48N2O5/c1-9-17(2)29(36)33-27-26(37-19(4)34)16-31(7)24-14-15-30(6)22(18(3)32-8)12-13-23(30)21(24)10-11-25(31)28(27)38-20(5)35/h9,12,18,21,23-28,32H,10-11,13-16H2,1-8H3,(H,33,36)/b17-9+/t18-,21-,23-,24-,25-,26-,27-,28+,30+,31+/m0/s1 RDGDPUWHVFLIIR-MIFLDMCISA-N 50242346 CHEMBL500603::[(20S)-20-(N-methylamino)-3beta-(tigloylamino)-5alpha-pregn-16-en-2 beta,4 beta-diacetate] Cholinesterase 25000 ChEMBL 10.1021/np000466v 10.7270/Q20R9P54 11421762 Kalauni, SK; Choudhary, MI; Shaheen, F; Manandhar, MD; Atta-ur-Rahman, A; Gewali, MB; Khalid, A Tribhuvan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50242346 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50242346&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10075640 104099036 CHEMBL500603 ZINC42805093 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50257817 Cc1[nH]nc2Oc3nc4CCCCc4c(N)c3C(c12)c1cccc(c1)[N+]([O-])=O 50038382 CHEMBL3361111 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2014.10.049 10.7270/Q2T72K1Q 25462245 Khoobi, M; Ghanoni, F; Nadri, H; Moradi, A; Pirali Hamedani, M; Homayouni Moghadam, F; Emami, S; Vosooghi, M; Zadmard, R; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50038382 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50038382&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118987676 313067231 CHEMBL3361111 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50257818 Cc1[nH]nc2Oc3nc4CCCCc4c(N)c3C(c12)c1ccc(F)cc1 50038383 CHEMBL3361110 Cholinesterase 25000 ChEMBL 10.1016/j.ejmech.2014.10.049 10.7270/Q2T72K1Q 25462245 Khoobi, M; Ghanoni, F; Nadri, H; Moradi, A; Pirali Hamedani, M; Homayouni Moghadam, F; Emami, S; Vosooghi, M; Zadmard, R; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50038383 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50038383&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118987677 313067232 CHEMBL3361110 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50257819 Cc1[nH]nc2Oc3nc4CCCCc4c(N)c3C(c12)c1ccccc1F 50038384 CHEMBL3361109 Cholinesterase 33000 ChEMBL 10.1016/j.ejmech.2014.10.049 10.7270/Q2T72K1Q 25462245 Khoobi, M; Ghanoni, F; Nadri, H; Moradi, A; Pirali Hamedani, M; Homayouni Moghadam, F; Emami, S; Vosooghi, M; Zadmard, R; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50038384 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50038384&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118987678 313067233 CHEMBL3361109 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50257820 Cc1[nH]nc2Oc3nc4CCCCc4c(N)c3C(c12)c1ccc(C)cc1 50038385 CHEMBL3361108 Cholinesterase 4500 ChEMBL 10.1016/j.ejmech.2014.10.049 10.7270/Q2T72K1Q 25462245 Khoobi, M; Ghanoni, F; Nadri, H; Moradi, A; Pirali Hamedani, M; Homayouni Moghadam, F; Emami, S; Vosooghi, M; Zadmard, R; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50038385 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50038385&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118987679 313067234 CHEMBL3361108 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50257834 COc1ccc(cc1)C1c2c(C)[nH]nc2Oc2nc3CCCCc3c(N)c12 50038393 CHEMBL3361112 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2014.10.049 10.7270/Q2T72K1Q 25462245 Khoobi, M; Ghanoni, F; Nadri, H; Moradi, A; Pirali Hamedani, M; Homayouni Moghadam, F; Emami, S; Vosooghi, M; Zadmard, R; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50038393 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50038393&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118987686 313067242 CHEMBL3361112 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50257835 COc1ccccc1C1c2c(C)[nH]nc2Oc2nc3CCCCc3c(N)c12 50038392 CHEMBL3361113 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2014.10.049 10.7270/Q2T72K1Q 25462245 Khoobi, M; Ghanoni, F; Nadri, H; Moradi, A; Pirali Hamedani, M; Homayouni Moghadam, F; Emami, S; Vosooghi, M; Zadmard, R; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50038392 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50038392&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118987685 313067241 CHEMBL3361113 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50257836 COc1ccc(OC)c(c1)C1c2c(C)[nH]nc2Oc2nc3CCCCc3c(N)c12 50038391 CHEMBL3361114 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2014.10.049 10.7270/Q2T72K1Q 25462245 Khoobi, M; Ghanoni, F; Nadri, H; Moradi, A; Pirali Hamedani, M; Homayouni Moghadam, F; Emami, S; Vosooghi, M; Zadmard, R; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50038391 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50038391&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118987684 313067240 CHEMBL3361114 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50257837 COc1ccc(cc1OC)C1c2c(C)[nH]nc2Oc2nc3CCCCc3c(N)c12 50038390 CHEMBL3352904 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2014.10.049 10.7270/Q2T72K1Q 25462245 Khoobi, M; Ghanoni, F; Nadri, H; Moradi, A; Pirali Hamedani, M; Homayouni Moghadam, F; Emami, S; Vosooghi, M; Zadmard, R; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50038390 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50038390&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118987683 313067239 CHEMBL3352904 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50257838 COc1cc(cc(OC)c1OC)C1c2c(C)[nH]nc2Oc2nc3CCCCc3c(N)c12 50038389 CHEMBL3361115 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2014.10.049 10.7270/Q2T72K1Q 25462245 Khoobi, M; Ghanoni, F; Nadri, H; Moradi, A; Pirali Hamedani, M; Homayouni Moghadam, F; Emami, S; Vosooghi, M; Zadmard, R; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50038389 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50038389&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118987682 313067238 CHEMBL3361115 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50257839 Cc1[nH]nc2Oc3nc4CCCCc4c(N)c3C(c12)c1cccc(Cl)c1Cl 50038388 CHEMBL3361116 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2014.10.049 10.7270/Q2T72K1Q 25462245 Khoobi, M; Ghanoni, F; Nadri, H; Moradi, A; Pirali Hamedani, M; Homayouni Moghadam, F; Emami, S; Vosooghi, M; Zadmard, R; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50038388 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50038388&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118987681 313067237 CHEMBL3361116 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50257840 Cc1[nH]nc2Oc3nc4CCCCc4c(N)c3C(c12)c1cccc2ccccc12 50038387 CHEMBL3361117 Cholinesterase 15000 ChEMBL 10.1016/j.ejmech.2014.10.049 10.7270/Q2T72K1Q 25462245 Khoobi, M; Ghanoni, F; Nadri, H; Moradi, A; Pirali Hamedani, M; Homayouni Moghadam, F; Emami, S; Vosooghi, M; Zadmard, R; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50038387 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50038387&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118987680 313067236 CHEMBL3361117 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50257841 Cc1[nH]nc2Oc3nc4CCCCc4c(N)c3C(c3cccs3)c12 50038386 CHEMBL3361118 Cholinesterase 16000 ChEMBL 10.1016/j.ejmech.2014.10.049 10.7270/Q2T72K1Q 25462245 Khoobi, M; Ghanoni, F; Nadri, H; Moradi, A; Pirali Hamedani, M; Homayouni Moghadam, F; Emami, S; Vosooghi, M; Zadmard, R; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50038386 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50038386&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118724704 313067235 CHEMBL3361118 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50257842 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 350 ChEMBL 10.1016/j.ejmech.2014.10.049 10.7270/Q2T72K1Q 25462245 Khoobi, M; Ghanoni, F; Nadri, H; Moradi, A; Pirali Hamedani, M; Homayouni Moghadam, F; Emami, S; Vosooghi, M; Zadmard, R; Foroumadi, A; Shafiee, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50277712 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 4.0 ChEMBL 10.1016/j.bmc.2014.06.030 10.7270/Q2VT1TQC 25017625 Alza, NP; Richmond, V; Baier, CJ; Freire, E; Baggio, R; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50277713 C[C@@H](CC[C@H]1C(CO)=CC[C@H]2C(C)(C)CCC[C@]12C)CC(=O)OCCCCCCN1CCOCC1 InChI=1S/C30H53NO4/c1-24(22-28(33)35-19-8-6-5-7-16-31-17-20-34-21-18-31)10-12-26-25(23-32)11-13-27-29(2,3)14-9-15-30(26,27)4/h11,24,26-27,32H,5-10,12-23H2,1-4H3/t24-,26-,27-,30+/m0/s1 FOJCSWWFCQQLBD-WJLKJTLYSA-N 50050561 CHEMBL3309351 Cholinesterase >50000 ChEMBL 10.1016/j.bmc.2014.06.030 10.7270/Q2VT1TQC 25017625 Alza, NP; Richmond, V; Baier, CJ; Freire, E; Baggio, R; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50050561 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50050561&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118705768 313069299 CHEMBL3309351 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50277714 C[C@@H](CC[C@H]1C(CO)=CC[C@H]2C(C)(C)CCC[C@]12C)CC(=O)OCCCCCN1CCOCC1 InChI=1S/C29H51NO4/c1-23(21-27(32)34-18-7-5-6-15-30-16-19-33-20-17-30)9-11-25-24(22-31)10-12-26-28(2,3)13-8-14-29(25,26)4/h10,23,25-26,31H,5-9,11-22H2,1-4H3/t23-,25-,26-,29+/m0/s1 CSPKTLAJYMQZEM-UEQJIGKFSA-N 50050562 CHEMBL3309350 Cholinesterase >50000 ChEMBL 10.1016/j.bmc.2014.06.030 10.7270/Q2VT1TQC 25017625 Alza, NP; Richmond, V; Baier, CJ; Freire, E; Baggio, R; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50050562 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50050562&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118705767 313069300 CHEMBL3309350 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50277715 C[C@@H](CC[C@H]1C(CO)=CC[C@H]2C(C)(C)CCC[C@]12C)CC(=O)OCCCCN1CCOCC1 InChI=1S/C28H49NO4/c1-22(20-26(31)33-17-6-5-14-29-15-18-32-19-16-29)8-10-24-23(21-30)9-11-25-27(2,3)12-7-13-28(24,25)4/h9,22,24-25,30H,5-8,10-21H2,1-4H3/t22-,24-,25-,28+/m0/s1 UFWGYDLSUPDOLS-JCUKEYOKSA-N 50050563 CHEMBL3309349 Cholinesterase >50000 ChEMBL 10.1016/j.bmc.2014.06.030 10.7270/Q2VT1TQC 25017625 Alza, NP; Richmond, V; Baier, CJ; Freire, E; Baggio, R; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50050563 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50050563&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118705766 313069301 CHEMBL3309349 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50277716 C[C@@H](CC[C@H]1C(CO)=CC[C@H]2C(C)(C)CCC[C@]12C)CC(=O)OCCCN1CCOCC1 InChI=1S/C27H47NO4/c1-21(19-25(30)32-16-6-13-28-14-17-31-18-15-28)7-9-23-22(20-29)8-10-24-26(2,3)11-5-12-27(23,24)4/h8,21,23-24,29H,5-7,9-20H2,1-4H3/t21-,23-,24-,27+/m0/s1 BCZLTPBZTYYAHJ-HZMCFHPPSA-N 50050564 CHEMBL3309348 Cholinesterase >50000 ChEMBL 10.1016/j.bmc.2014.06.030 10.7270/Q2VT1TQC 25017625 Alza, NP; Richmond, V; Baier, CJ; Freire, E; Baggio, R; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50050564 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50050564&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118705765 313069302 CHEMBL3309348 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50277717 C[C@@H](CC[C@H]1C(CO)=CC[C@H]2C(C)(C)CCC[C@]12C)CC(=O)OCCN1CCOCC1 InChI=1S/C26H45NO4/c1-20(18-24(29)31-17-14-27-12-15-30-16-13-27)6-8-22-21(19-28)7-9-23-25(2,3)10-5-11-26(22,23)4/h7,20,22-23,28H,5-6,8-19H2,1-4H3/t20-,22-,23-,26+/m0/s1 GUTXOGKEXFVKRK-PETUGJSASA-N 50050565 CHEMBL3309347 Cholinesterase >50000 ChEMBL 10.1016/j.bmc.2014.06.030 10.7270/Q2VT1TQC 25017625 Alza, NP; Richmond, V; Baier, CJ; Freire, E; Baggio, R; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50050565 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50050565&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118705764 313069303 CHEMBL3309347 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50277718 C[C@@H](CC[C@H]1C(CO)=CC[C@H]2C(C)(C)CCC[C@]12C)CC(=O)OCCCCCCN1CCCCC1 InChI=1S/C31H55NO3/c1-25(23-29(34)35-22-11-6-5-8-19-32-20-9-7-10-21-32)13-15-27-26(24-33)14-16-28-30(2,3)17-12-18-31(27,28)4/h14,25,27-28,33H,5-13,15-24H2,1-4H3/t25-,27-,28-,31+/m0/s1 CDVVFLSSNUTIPQ-AEHZEFANSA-N 50050566 CHEMBL3309346 Cholinesterase 10500 ChEMBL 10.1016/j.bmc.2014.06.030 10.7270/Q2VT1TQC 25017625 Alza, NP; Richmond, V; Baier, CJ; Freire, E; Baggio, R; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50050566 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50050566&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118705763 313069304 CHEMBL3309346 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50277719 C[C@@H](CC[C@H]1C(CO)=CC[C@H]2C(C)(C)CCC[C@]12C)CC(=O)OCCCCCN1CCCCC1 InChI=1S/C30H53NO3/c1-24(22-28(33)34-21-10-6-9-20-31-18-7-5-8-19-31)12-14-26-25(23-32)13-15-27-29(2,3)16-11-17-30(26,27)4/h13,24,26-27,32H,5-12,14-23H2,1-4H3/t24-,26-,27-,30+/m0/s1 PUNNLRDMZGQTJQ-WJLKJTLYSA-N 50050567 CHEMBL3311550 Cholinesterase 24800 ChEMBL 10.1016/j.bmc.2014.06.030 10.7270/Q2VT1TQC 25017625 Alza, NP; Richmond, V; Baier, CJ; Freire, E; Baggio, R; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50050567 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50050567&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118707337 313069305 CHEMBL3311550 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283189 CCN(CC)CCCOc1ccc2nc3-c4ccccc4CCn3c(=O)c2c1 InChI=1S/C23H27N3O2/c1-3-25(4-2)13-7-15-28-18-10-11-21-20(16-18)23(27)26-14-12-17-8-5-6-9-19(17)22(26)24-21/h5-6,8-11,16H,3-4,7,12-15H2,1-2H3 VCKXKSQVWHZQHR-UHFFFAOYSA-N 50053422 CHEMBL3323043 Cholinesterase 2160 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053422 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053422&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710494 103950103 CHEMBL3323043 ZINC04617921 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283190 O=c1n2CCc3ccccc3-c2nc2ccc(OCCCN3CCc4ccccc4C3)cc12 InChI=1S/C28H27N3O2/c32-28-25-18-23(33-17-5-14-30-15-12-20-6-1-2-8-22(20)19-30)10-11-26(25)29-27-24-9-4-3-7-21(24)13-16-31(27)28/h1-4,6-11,18H,5,12-17,19H2 WGNYJTRBJZWNOW-UHFFFAOYSA-N 50053421 CHEMBL3323044 Cholinesterase 1830 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053421 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053421&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710495 103950102 CHEMBL3323044 ZINC03815729 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283191 O=c1n2CCc3ccccc3-c2nc2ccc(OCCCn3ccnc3)cc12 InChI=1S/C22H20N4O2/c27-22-19-14-17(28-13-3-10-25-12-9-23-15-25)6-7-20(19)24-21-18-5-2-1-4-16(18)8-11-26(21)22/h1-2,4-7,9,12,14-15H,3,8,10-11,13H2 WYDAWNYRRQAAEA-UHFFFAOYSA-N 50053420 CHEMBL3323045 Cholinesterase 8680 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053420 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053420&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710496 103950101 CHEMBL3323045 ZINC13759012 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283192 O=c1n2CCCc3ccccc3-c2nc2ccc(OCCCN3CCCCC3)cc12 InChI=1S/C25H29N3O2/c29-25-22-18-20(30-17-7-15-27-13-4-1-5-14-27)11-12-23(22)26-24-21-10-3-2-8-19(21)9-6-16-28(24)25/h2-3,8,10-12,18H,1,4-7,9,13-17H2 PFYRGBJRPBPVMS-UHFFFAOYSA-N 50053419 CHEMBL3323046 Cholinesterase 2670 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053419 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053419&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710497 103950100 CHEMBL3323046 ZINC04617928 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283193 O=c1n2CCCc3ccccc3-c2nc2ccc(OCCCN3CCCCCC3)cc12 InChI=1S/C26H31N3O2/c30-26-23-19-21(31-18-8-16-28-14-5-1-2-6-15-28)12-13-24(23)27-25-22-11-4-3-9-20(22)10-7-17-29(25)26/h3-4,9,11-13,19H,1-2,5-8,10,14-18H2 XSSSDRLEDOFMQY-UHFFFAOYSA-N 50053569 CHEMBL3323047 Cholinesterase 865 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053569 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053569&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710498 103950249 CHEMBL3323047 ZINC13759225 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283194 O=c1n2CCCc3ccccc3-c2nc2ccc(OCCCN3CCCC3)cc12 InChI=1S/C24H27N3O2/c28-24-21-17-19(29-16-6-14-26-12-3-4-13-26)10-11-22(21)25-23-20-9-2-1-7-18(20)8-5-15-27(23)24/h1-2,7,9-11,17H,3-6,8,12-16H2 ILRYAGJOBSWSSP-UHFFFAOYSA-N 50053570 CHEMBL3323048 Cholinesterase 3610 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053570 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053570&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710499 103950250 CHEMBL3323048 ZINC13759235 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283195 CCN(CC)CCCOc1ccc2nc3-c4ccccc4CCCn3c(=O)c2c1 InChI=1S/C24H29N3O2/c1-3-26(4-2)14-8-16-29-19-12-13-22-21(17-19)24(28)27-15-7-10-18-9-5-6-11-20(18)23(27)25-22/h5-6,9,11-13,17H,3-4,7-8,10,14-16H2,1-2H3 GLVFHGWUKQPBOF-UHFFFAOYSA-N 50053443 CHEMBL3323049 Cholinesterase 5100 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053443 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053443&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710500 103950124 CHEMBL3323049 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283196 O=c1n2CCCc3ccccc3-c2nc2ccc(OCCCN3CCc4ccccc4C3)cc12 InChI=1S/C29H29N3O2/c33-29-26-19-24(34-18-6-15-31-17-14-21-7-1-2-9-23(21)20-31)12-13-27(26)30-28-25-11-4-3-8-22(25)10-5-16-32(28)29/h1-4,7-9,11-13,19H,5-6,10,14-18,20H2 SRUBEYBHGYYIOR-UHFFFAOYSA-N 50053444 CHEMBL3323050 Cholinesterase 1840 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053444 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053444&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710501 103950125 CHEMBL3323050 ZINC21289890 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283197 O=c1n2CCCc3ccccc3-c2nc2ccc(OCCCn3ccnc3)cc12 InChI=1S/C23H22N4O2/c28-23-20-15-18(29-14-4-11-26-13-10-24-16-26)8-9-21(20)25-22-19-7-2-1-5-17(19)6-3-12-27(22)23/h1-2,5,7-10,13,15-16H,3-4,6,11-12,14H2 YGMTUJWKFDIKGP-UHFFFAOYSA-N 50053442 CHEMBL3323051 Cholinesterase 52010 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053442 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053442&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710502 103950123 CHEMBL3323051 ZINC03815726 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283198 O=c1n2CCCc2nc2ccc(OCCCN3CCCCC3)cc12 InChI=1S/C19H25N3O2/c23-19-16-14-15(24-13-5-11-21-9-2-1-3-10-21)7-8-17(16)20-18-6-4-12-22(18)19/h7-8,14H,1-6,9-13H2 FFIZZPFJAXHTDR-UHFFFAOYSA-N 50053441 CHEMBL3323053 Cholinesterase 122000 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053441 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053441&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710504 103950122 CHEMBL3323053 ZINC21289983 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283199 O=c1n2CCCc2nc2ccc(OCCCN3CCCCCC3)cc12 InChI=1S/C20H27N3O2/c24-20-17-15-16(8-9-18(17)21-19-7-5-13-23(19)20)25-14-6-12-22-10-3-1-2-4-11-22/h8-9,15H,1-7,10-14H2 LXPSFEADEMEYEK-UHFFFAOYSA-N 50053445 CHEMBL3323054 Cholinesterase 5220 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053445 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053445&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710505 103950126 CHEMBL3323054 ZINC03815749 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283200 O=c1n2CCCc2nc2ccc(OCCCN3CCCC3)cc12 InChI=1S/C18H23N3O2/c22-18-15-13-14(23-12-4-10-20-8-1-2-9-20)6-7-16(15)19-17-5-3-11-21(17)18/h6-7,13H,1-5,8-12H2 JQHVEQJVOICSCX-UHFFFAOYSA-N 50053446 CHEMBL3323055 Cholinesterase 10550 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053446 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053446&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710506 103950127 CHEMBL3323055 ZINC01540866 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283201 CCN(CC)CCCOc1ccc2nc3CCCn3c(=O)c2c1 InChI=1S/C18H25N3O2/c1-3-20(4-2)10-6-12-23-14-8-9-16-15(13-14)18(22)21-11-5-7-17(21)19-16/h8-9,13H,3-7,10-12H2,1-2H3 DWOXBDXTFVOWJF-UHFFFAOYSA-N 50053440 CHEMBL3323056 Cholinesterase 829 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053440 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053440&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710507 103950121 CHEMBL3323056 ZINC27307936 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283202 O=c1n2CCCc2nc2ccc(OCCCN3CCc4ccccc4C3)cc12 InChI=1S/C23H25N3O2/c27-23-20-15-19(8-9-21(20)24-22-7-3-12-26(22)23)28-14-4-11-25-13-10-17-5-1-2-6-18(17)16-25/h1-2,5-6,8-9,15H,3-4,7,10-14,16H2 NAWSEIOAWKWGFQ-UHFFFAOYSA-N 50053447 CHEMBL3323057 Cholinesterase 776 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053447 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053447&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710508 103950128 CHEMBL3323057 ZINC03815716 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283203 O=c1n2CCCc2nc2ccc(OCCCn3ccnc3)cc12 InChI=1S/C17H18N4O2/c22-17-14-11-13(23-10-2-7-20-9-6-18-12-20)4-5-15(14)19-16-3-1-8-21(16)17/h4-6,9,11-12H,1-3,7-8,10H2 JURKPKKPJKIBGL-UHFFFAOYSA-N 50053448 CHEMBL3323058 Cholinesterase 14650 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053448 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053448&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710509 103950129 CHEMBL3323058 ZINC01540868 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283204 O=c1n2CCCCc2nc2ccc(OCCCN3CCCCC3)cc12 InChI=1S/C20H27N3O2/c24-20-17-15-16(25-14-6-12-22-10-3-1-4-11-22)8-9-18(17)21-19-7-2-5-13-23(19)20/h8-9,15H,1-7,10-14H2 SWZRIMBMJKPHQJ-UHFFFAOYSA-N 50053439 CHEMBL3323059 Cholinesterase 6550 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053439 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053439&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710510 103950120 CHEMBL3323059 ZINC04617924 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283205 O=c1n2CCCCc2nc2ccc(OCCCN3CCCCCC3)cc12 InChI=1S/C21H29N3O2/c25-21-18-16-17(26-15-7-13-23-11-4-1-2-5-12-23)9-10-19(18)22-20-8-3-6-14-24(20)21/h9-10,16H,1-8,11-15H2 ZYVJJXKJIKGMMS-UHFFFAOYSA-N 50053449 CHEMBL3323060 Cholinesterase 1770 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053449 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053449&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710511 103950130 CHEMBL3323060 ZINC03815773 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283206 O=c1n2CCCCc2nc2ccc(OCCCN3CCCC3)cc12 InChI=1S/C19H25N3O2/c23-19-16-14-15(24-13-5-11-21-9-3-4-10-21)7-8-17(16)20-18-6-1-2-12-22(18)19/h7-8,14H,1-6,9-13H2 RXRWWFXXATZQFX-UHFFFAOYSA-N 50053450 CHEMBL3323061 Cholinesterase 16080 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053450 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053450&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710512 103950131 CHEMBL3323061 ZINC13759022 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283207 CCN(CC)CCCOc1ccc2nc3CCCCn3c(=O)c2c1 InChI=1S/C19H27N3O2/c1-3-21(4-2)11-7-13-24-15-9-10-17-16(14-15)19(23)22-12-6-5-8-18(22)20-17/h9-10,14H,3-8,11-13H2,1-2H3 DNOBRQKRZLULQE-UHFFFAOYSA-N 50053438 CHEMBL3323062 Cholinesterase 9140 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053438 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053438&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710513 103950119 CHEMBL3323062 ZINC13759009 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50277822 C[C@@H](CC[C@H]1C(CO)=CC[C@H]2C(C)(C)CCC[C@]12C)CC(=O)OCCCCN1CCCCC1 InChI=1S/C29H51NO3/c1-23(21-27(32)33-20-9-8-19-30-17-6-5-7-18-30)11-13-25-24(22-31)12-14-26-28(2,3)15-10-16-29(25,26)4/h12,23,25-26,31H,5-11,13-22H2,1-4H3/t23-,25-,26-,29+/m0/s1 KLXKCYILAMMDQG-UEQJIGKFSA-N 50050568 CHEMBL3311549 Cholinesterase 37100 ChEMBL 10.1016/j.bmc.2014.06.030 10.7270/Q2VT1TQC 25017625 Alza, NP; Richmond, V; Baier, CJ; Freire, E; Baggio, R; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50050568 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50050568&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118707336 313069306 CHEMBL3311549 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50277823 C[C@@H](CC[C@H]1C(CO)=CC[C@H]2C(C)(C)CCC[C@]12C)CC(=O)OCCCN1CCCCC1 InChI=1S/C28H49NO3/c1-22(20-26(31)32-19-9-18-29-16-6-5-7-17-29)10-12-24-23(21-30)11-13-25-27(2,3)14-8-15-28(24,25)4/h11,22,24-25,30H,5-10,12-21H2,1-4H3/t22-,24-,25-,28+/m0/s1 VRPYULDLXQBWRW-JCUKEYOKSA-N 50050569 CHEMBL3311548 Cholinesterase 34700 ChEMBL 10.1016/j.bmc.2014.06.030 10.7270/Q2VT1TQC 25017625 Alza, NP; Richmond, V; Baier, CJ; Freire, E; Baggio, R; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50050569 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50050569&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118707335 313069307 CHEMBL3311548 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50277824 C[C@@H](CC[C@H]1C(CO)=CC[C@H]2C(C)(C)CCC[C@]12C)CC(=O)OCCN1CCCCC1 InChI=1S/C27H47NO3/c1-21(19-25(30)31-18-17-28-15-6-5-7-16-28)9-11-23-22(20-29)10-12-24-26(2,3)13-8-14-27(23,24)4/h10,21,23-24,29H,5-9,11-20H2,1-4H3/t21-,23-,24-,27+/m0/s1 XOSYYCYRQMXWDG-HZMCFHPPSA-N 50050570 CHEMBL3311547 Cholinesterase >50000 ChEMBL 10.1016/j.bmc.2014.06.030 10.7270/Q2VT1TQC 25017625 Alza, NP; Richmond, V; Baier, CJ; Freire, E; Baggio, R; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50050570 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50050570&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118707334 313069308 CHEMBL3311547 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50277825 CCN(CC)CCCCCCOC(=O)C[C@@H](C)CC[C@H]1C(CO)=CC[C@H]2C(C)(C)CCC[C@]12C InChI=1S/C30H55NO3/c1-7-31(8-2)20-11-9-10-12-21-34-28(33)22-24(3)14-16-26-25(23-32)15-17-27-29(4,5)18-13-19-30(26,27)6/h15,24,26-27,32H,7-14,16-23H2,1-6H3/t24-,26-,27-,30+/m0/s1 XXJJMRALMDGHTA-WJLKJTLYSA-N 50050571 CHEMBL3311546 Cholinesterase 15200 ChEMBL 10.1016/j.bmc.2014.06.030 10.7270/Q2VT1TQC 25017625 Alza, NP; Richmond, V; Baier, CJ; Freire, E; Baggio, R; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50050571 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50050571&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118707333 313069309 CHEMBL3311546 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50277826 CCN(CC)CCCCCOC(=O)C[C@@H](C)CC[C@H]1C(CO)=CC[C@H]2C(C)(C)CCC[C@]12C InChI=1S/C29H53NO3/c1-7-30(8-2)19-10-9-11-20-33-27(32)21-23(3)13-15-25-24(22-31)14-16-26-28(4,5)17-12-18-29(25,26)6/h14,23,25-26,31H,7-13,15-22H2,1-6H3/t23-,25-,26-,29+/m0/s1 OIQUQGHWRGMUNL-UEQJIGKFSA-N 50050572 CHEMBL3311545 Cholinesterase 27200 ChEMBL 10.1016/j.bmc.2014.06.030 10.7270/Q2VT1TQC 25017625 Alza, NP; Richmond, V; Baier, CJ; Freire, E; Baggio, R; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50050572 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50050572&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118707332 313069310 CHEMBL3311545 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50277827 CCN(CC)CCCCOC(=O)C[C@@H](C)CC[C@H]1C(CO)=CC[C@H]2C(C)(C)CCC[C@]12C InChI=1S/C28H51NO3/c1-7-29(8-2)18-9-10-19-32-26(31)20-22(3)12-14-24-23(21-30)13-15-25-27(4,5)16-11-17-28(24,25)6/h13,22,24-25,30H,7-12,14-21H2,1-6H3/t22-,24-,25-,28+/m0/s1 BQYWVWFBJLXJCX-JCUKEYOKSA-N 50050573 CHEMBL3311544 Cholinesterase 23600 ChEMBL 10.1016/j.bmc.2014.06.030 10.7270/Q2VT1TQC 25017625 Alza, NP; Richmond, V; Baier, CJ; Freire, E; Baggio, R; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50050573 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50050573&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118707331 313069311 CHEMBL3311544 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50277828 CCN(CC)CCCOC(=O)C[C@@H](C)CC[C@H]1C(CO)=CC[C@H]2C(C)(C)CCC[C@]12C InChI=1S/C27H49NO3/c1-7-28(8-2)17-10-18-31-25(30)19-21(3)11-13-23-22(20-29)12-14-24-26(4,5)15-9-16-27(23,24)6/h12,21,23-24,29H,7-11,13-20H2,1-6H3/t21-,23-,24-,27+/m0/s1 DXCFTARDAMBCLY-HZMCFHPPSA-N 50050689 CHEMBL3311543 Cholinesterase 18100 ChEMBL 10.1016/j.bmc.2014.06.030 10.7270/Q2VT1TQC 25017625 Alza, NP; Richmond, V; Baier, CJ; Freire, E; Baggio, R; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50050689 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50050689&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118707330 103947810 CHEMBL3311543 ZINC04293721 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50277829 CCN(CC)CCOC(=O)C[C@@H](C)CC[C@H]1C(CO)=CC[C@H]2C(C)(C)CCC[C@]12C InChI=1S/C26H47NO3/c1-7-27(8-2)16-17-30-24(29)18-20(3)10-12-22-21(19-28)11-13-23-25(4,5)14-9-15-26(22,23)6/h11,20,22-23,28H,7-10,12-19H2,1-6H3/t20-,22-,23-,26+/m0/s1 KZPFRVRONUBYMU-PETUGJSASA-N 50050690 CHEMBL3311542 Cholinesterase 39900 ChEMBL 10.1016/j.bmc.2014.06.030 10.7270/Q2VT1TQC 25017625 Alza, NP; Richmond, V; Baier, CJ; Freire, E; Baggio, R; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50050690 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50050690&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118707329 103947811 CHEMBL3311542 ZINC13755641 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50277830 C[C@@H](CC[C@H]1C(CO)=CC[C@H]2C(C)(C)CCC[C@]12C)CC(=O)OCCCCCCN1CCCC1 InChI=1S/C30H53NO3/c1-24(22-28(33)34-21-10-6-5-7-18-31-19-8-9-20-31)12-14-26-25(23-32)13-15-27-29(2,3)16-11-17-30(26,27)4/h13,24,26-27,32H,5-12,14-23H2,1-4H3/t24-,26-,27-,30+/m0/s1 JXHKDMRGJSLLTN-WJLKJTLYSA-N 50050691 CHEMBL3311541 Cholinesterase 10600 ChEMBL 10.1016/j.bmc.2014.06.030 10.7270/Q2VT1TQC 25017625 Alza, NP; Richmond, V; Baier, CJ; Freire, E; Baggio, R; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50050691 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50050691&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118707328 103947812 CHEMBL3311541 ZINC13755629 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50277831 C[C@@H](CC[C@H]1C(CO)=CC[C@H]2C(C)(C)CCC[C@]12C)CC(=O)OCCCCCN1CCCC1 InChI=1S/C29H51NO3/c1-23(21-27(32)33-20-9-5-6-17-30-18-7-8-19-30)11-13-25-24(22-31)12-14-26-28(2,3)15-10-16-29(25,26)4/h12,23,25-26,31H,5-11,13-22H2,1-4H3/t23-,25-,26-,29+/m0/s1 HXOKBNPDNJPLDR-UEQJIGKFSA-N 50050692 CHEMBL3311540 Cholinesterase 22100 ChEMBL 10.1016/j.bmc.2014.06.030 10.7270/Q2VT1TQC 25017625 Alza, NP; Richmond, V; Baier, CJ; Freire, E; Baggio, R; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50050692 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50050692&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118707327 103947813 CHEMBL3311540 ZINC13755635 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50277832 C[C@@H](CC[C@H]1C(CO)=CC[C@H]2C(C)(C)CCC[C@]12C)CC(=O)OCCCCN1CCCC1 InChI=1S/C28H49NO3/c1-22(20-26(31)32-19-8-7-18-29-16-5-6-17-29)10-12-24-23(21-30)11-13-25-27(2,3)14-9-15-28(24,25)4/h11,22,24-25,30H,5-10,12-21H2,1-4H3/t22-,24-,25-,28+/m0/s1 PSQOHCXMGXRDON-JCUKEYOKSA-N 50050693 CHEMBL3311539 Cholinesterase 10300 ChEMBL 10.1016/j.bmc.2014.06.030 10.7270/Q2VT1TQC 25017625 Alza, NP; Richmond, V; Baier, CJ; Freire, E; Baggio, R; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50050693 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50050693&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 102140461 103947814 CHEMBL3311539 ZINC13755631 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50277833 C[C@@H](CC[C@H]1C(CO)=CC[C@H]2C(C)(C)CCC[C@]12C)CC(=O)OCCCN1CCCC1 InChI=1S/C27H47NO3/c1-21(19-25(30)31-18-8-17-28-15-5-6-16-28)9-11-23-22(20-29)10-12-24-26(2,3)13-7-14-27(23,24)4/h10,21,23-24,29H,5-9,11-20H2,1-4H3/t21-,23-,24-,27+/m0/s1 QZIKVFKIXMKOSX-HZMCFHPPSA-N 50050694 CHEMBL3311458 Cholinesterase 43800 ChEMBL 10.1016/j.bmc.2014.06.030 10.7270/Q2VT1TQC 25017625 Alza, NP; Richmond, V; Baier, CJ; Freire, E; Baggio, R; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50050694 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50050694&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118707274 103947815 CHEMBL3311458 ZINC13755643 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50277834 C[C@@H](CC[C@H]1C(CO)=CC[C@H]2C(C)(C)CCC[C@]12C)CC(=O)OCCN1CCCC1 InChI=1S/C26H45NO3/c1-20(18-24(29)30-17-16-27-14-5-6-15-27)8-10-22-21(19-28)9-11-23-25(2,3)12-7-13-26(22,23)4/h9,20,22-23,28H,5-8,10-19H2,1-4H3/t20-,22-,23-,26+/m0/s1 NVCOFRQWSVVFME-PETUGJSASA-N 50050695 CHEMBL3311457 Cholinesterase 17000 ChEMBL 10.1016/j.bmc.2014.06.030 10.7270/Q2VT1TQC 25017625 Alza, NP; Richmond, V; Baier, CJ; Freire, E; Baggio, R; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50050695 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50050695&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118707273 103947816 CHEMBL3311457 ZINC13755637 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50277835 C[C@@H](CC[C@H]1C(CO)=CC[C@H]2C(C)(C)CCC[C@]12C)CC(O)=O InChI=1S/C20H34O3/c1-14(12-18(22)23)6-8-16-15(13-21)7-9-17-19(2,3)10-5-11-20(16,17)4/h7,14,16-17,21H,5-6,8-13H2,1-4H3,(H,22,23)/t14-,16-,17-,20+/m0/s1 HSPKTTDVALANJO-JWWIWJDOSA-N 50050696 CHEMBL3311456 Cholinesterase 171100 ChEMBL 10.1016/j.bmc.2014.06.030 10.7270/Q2VT1TQC 25017625 Alza, NP; Richmond, V; Baier, CJ; Freire, E; Baggio, R; Murray, AP Universidad Nacional del Sur http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50050696 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50050696&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 102140462 103947817 CHEMBL3311456 ZINC13755633 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283208 O=c1n2CCCCc2nc2ccc(OCCCN3CCc4ccccc4C3)cc12 InChI=1S/C24H27N3O2/c28-24-21-16-20(9-10-22(21)25-23-8-3-4-13-27(23)24)29-15-5-12-26-14-11-18-6-1-2-7-19(18)17-26/h1-2,6-7,9-10,16H,3-5,8,11-15,17H2 OHYQAMLTLFYMHA-UHFFFAOYSA-N 50053451 CHEMBL3323063 Cholinesterase 5490 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053451 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053451&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710514 103950132 CHEMBL3323063 ZINC13758992 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283209 O=c1n2CCCCc2nc2ccc(OCCCn3ccnc3)cc12 InChI=1S/C18H20N4O2/c23-18-15-12-14(24-11-3-8-21-10-7-19-13-21)5-6-16(15)20-17-4-1-2-9-22(17)18/h5-7,10,12-13H,1-4,8-9,11H2 NOIILUZHCRLIDA-UHFFFAOYSA-N 50053452 CHEMBL3323064 Cholinesterase 50050 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053452 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053452&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710515 103950133 CHEMBL3323064 ZINC13759014 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283210 O=c1n2CCCCCc2nc2ccc(OCCCN3CCCCC3)cc12 InChI=1S/C21H29N3O2/c25-21-18-16-17(26-15-7-13-23-11-4-2-5-12-23)9-10-19(18)22-20-8-3-1-6-14-24(20)21/h9-10,16H,1-8,11-15H2 DYDMQTJZQBAGEY-UHFFFAOYSA-N 50053437 CHEMBL3323065 Cholinesterase 12730 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053437 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053437&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710516 103950118 CHEMBL3323065 ZINC13759016 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283211 O=c1n2CCCCCc2nc2ccc(OCCCN3CCCCCC3)cc12 InChI=1S/C22H31N3O2/c26-22-19-17-18(27-16-8-14-24-12-5-1-2-6-13-24)10-11-20(19)23-21-9-4-3-7-15-25(21)22/h10-11,17H,1-9,12-16H2 UHHRCQCMWYTYSN-UHFFFAOYSA-N 50053453 CHEMBL3323066 Cholinesterase 1800 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053453 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053453&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710517 103950134 CHEMBL3323066 ZINC13759006 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283221 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 3.7 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283222 O=c1n2Cc3ccccc3-c2nc2ccc(OCCCN3CCCCC3)cc12 InChI=1S/C23H25N3O2/c27-23-20-15-18(28-14-6-13-25-11-4-1-5-12-25)9-10-21(20)24-22-19-8-3-2-7-17(19)16-26(22)23/h2-3,7-10,15H,1,4-6,11-14,16H2 GDJCEVNDAZNLPF-UHFFFAOYSA-N 50053434 CHEMBL3323036 Cholinesterase 4140 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053434 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053434&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 101902496 103950115 CHEMBL3323036 ZINC12365480 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283223 O=c1n2Cc3ccccc3-c2nc2ccc(OCCCN3CCCCCC3)cc12 InChI=1S/C24H27N3O2/c28-24-21-16-19(29-15-7-14-26-12-5-1-2-6-13-26)10-11-22(21)25-23-20-9-4-3-8-18(20)17-27(23)24/h3-4,8-11,16H,1-2,5-7,12-15,17H2 PAUUUEWXSGQDRD-UHFFFAOYSA-N 50053433 CHEMBL3323037 Cholinesterase 1870 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053433 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053433&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710488 103950114 CHEMBL3323037 ZINC13758998 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283224 O=c1n2Cc3ccccc3-c2nc2ccc(OCCCN3CCCC3)cc12 InChI=1S/C22H23N3O2/c26-22-19-14-17(27-13-5-12-24-10-3-4-11-24)8-9-20(19)23-21-18-7-2-1-6-16(18)15-25(21)22/h1-2,6-9,14H,3-5,10-13,15H2 QYRYFILGDDFGJJ-UHFFFAOYSA-N 50053431 CHEMBL3323038 Cholinesterase 2400 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053431 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053431&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710489 103950112 CHEMBL3323038 ZINC03815713 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283225 CCN(CC)CCCOc1ccc2nc3-c4ccccc4Cn3c(=O)c2c1 InChI=1S/C22H25N3O2/c1-3-24(4-2)12-7-13-27-17-10-11-20-19(14-17)22(26)25-15-16-8-5-6-9-18(16)21(25)23-20/h5-6,8-11,14H,3-4,7,12-13,15H2,1-2H3 MIPWRXSZLNVAKQ-UHFFFAOYSA-N 50053429 CHEMBL3323039 Cholinesterase 1880 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053429 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053429&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710490 103950110 CHEMBL3323039 ZINC01540864 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283226 O=c1n2Cc3ccccc3-c2nc2ccc(OCCCN3CCc4ccccc4C3)cc12 InChI=1S/C27H25N3O2/c31-27-24-16-22(32-15-5-13-29-14-12-19-6-1-2-7-20(19)17-29)10-11-25(24)28-26-23-9-4-3-8-21(23)18-30(26)27/h1-4,6-11,16H,5,12-15,17-18H2 VKOZVVGTANTLFS-UHFFFAOYSA-N 50053428 CHEMBL3323040 Cholinesterase 1730 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053428 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053428&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710491 103950109 CHEMBL3323040 ZINC04617927 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283227 O=c1n2Cc3ccccc3-c2nc2ccc(OCCCn3ccnc3)cc12 InChI=1S/C21H18N4O2/c26-21-18-12-16(27-11-3-9-24-10-8-22-14-24)6-7-19(18)23-20-17-5-2-1-4-15(17)13-25(20)21/h1-2,4-8,10,12,14H,3,9,11,13H2 FNPVIOSBFNALDE-UHFFFAOYSA-N 50053427 CHEMBL3323041 Cholinesterase 9110 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053427 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053427&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710492 103950108 CHEMBL3323041 ZINC03815730 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283228 O=c1n2CCc3ccccc3-c2nc2ccc(OCCCN3CCCCC3)cc12 InChI=1S/C24H27N3O2/c28-24-21-17-19(29-16-6-14-26-12-4-1-5-13-26)9-10-22(21)25-23-20-8-3-2-7-18(20)11-15-27(23)24/h2-3,7-10,17H,1,4-6,11-16H2 MIQVJQGPYICMPP-UHFFFAOYSA-N 50053426 CHEMBL3323042 Cholinesterase 955 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053426 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053426&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710493 103950107 CHEMBL3323042 ZINC12365505 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283230 O=c1n2CCc3ccccc3-c2nc2ccc(OCCCN3CCCCCC3)cc12 InChI=1S/C25H29N3O2/c29-25-22-18-20(30-17-7-15-27-13-5-1-2-6-14-27)10-11-23(22)26-24-21-9-4-3-8-19(21)12-16-28(24)25/h3-4,8-11,18H,1-2,5-7,12-17H2 CMHSZUJWIWDLDH-UHFFFAOYSA-N 50053425 CHEMBL3323020 Cholinesterase 584 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053425 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053425&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710471 103950106 CHEMBL3323020 ZINC21289950 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283231 O=c1n2CCc3ccccc3-c2nc2ccc(OCCCN3CCCC3)cc12 InChI=1S/C23H25N3O2/c27-23-20-16-18(28-15-5-13-25-11-3-4-12-25)8-9-21(20)24-22-19-7-2-1-6-17(19)10-14-26(22)23/h1-2,6-9,16H,3-5,10-15H2 HNMLEEQDOJHSLD-UHFFFAOYSA-N 50053423 CHEMBL3323021 Cholinesterase 955 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053423 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053423&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710472 103950104 CHEMBL3323021 ZINC13759011 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283240 O=c1n2CCCCCc2nc2ccc(OCCCN3CCCC3)cc12 InChI=1S/C20H27N3O2/c24-20-17-15-16(25-14-6-12-22-10-4-5-11-22)8-9-18(17)21-19-7-2-1-3-13-23(19)20/h8-9,15H,1-7,10-14H2 CPAVPSHQFQQOQC-UHFFFAOYSA-N 50053454 CHEMBL3323067 Cholinesterase 12190 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053454 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053454&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710518 103950135 CHEMBL3323067 ZINC21289933 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283242 CCN(CC)CCCOc1ccc2nc3CCCCCn3c(=O)c2c1 InChI=1S/C20H29N3O2/c1-3-22(4-2)12-8-14-25-16-10-11-18-17(15-16)20(24)23-13-7-5-6-9-19(23)21-18/h10-11,15H,3-9,12-14H2,1-2H3 KNXGHTSSGIZTSA-UHFFFAOYSA-N 50053436 CHEMBL3323068 Cholinesterase 10750 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053436 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053436&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710519 103950117 CHEMBL3323068 ZINC13758996 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283245 O=c1n2CCCCCc2nc2ccc(OCCCN3CCc4ccccc4C3)cc12 InChI=1S/C25H29N3O2/c29-25-22-17-21(10-11-23(22)26-24-9-2-1-5-14-28(24)25)30-16-6-13-27-15-12-19-7-3-4-8-20(19)18-27/h3-4,7-8,10-11,17H,1-2,5-6,9,12-16,18H2 GIAHRJPZCNIJBQ-UHFFFAOYSA-N 50053532 CHEMBL3323069 Cholinesterase 3030 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053532 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053532&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710520 313069726 CHEMBL3323069 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283246 O=c1n2CCCCCc2nc2ccc(OCCCn3ccnc3)cc12 InChI=1S/C19H22N4O2/c24-19-16-13-15(25-12-4-9-22-11-8-20-14-22)6-7-17(16)21-18-5-2-1-3-10-23(18)19/h6-8,11,13-14H,1-5,9-10,12H2 IEJALPDEEYDFTC-UHFFFAOYSA-N 50053567 CHEMBL3323070 Cholinesterase 59750 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053567 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053567&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710521 103950247 CHEMBL3323070 ZINC13759229 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283250 O=c1n2CCCc2nc2ccc(OCCCCCCCCCN3CCCCC3)cc12 InChI=1S/C25H37N3O2/c29-25-22-20-21(13-14-23(22)26-24-12-11-18-28(24)25)30-19-10-5-3-1-2-4-7-15-27-16-8-6-9-17-27/h13-14,20H,1-12,15-19H2 KYOYXRRRLHKOKN-UHFFFAOYSA-N 50053568 CHEMBL3323071 Cholinesterase 8600 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053568 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053568&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710522 103950248 CHEMBL3323071 ZINC13759246 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283251 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 3.7 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283252 O=c1n2Cc3ccccc3-c2nc2ccc(OCCCN3CCCCC3)cc12 InChI=1S/C23H25N3O2/c27-23-20-15-18(28-14-6-13-25-11-4-1-5-12-25)9-10-21(20)24-22-19-8-3-2-7-17(19)16-26(22)23/h2-3,7-10,15H,1,4-6,11-14,16H2 GDJCEVNDAZNLPF-UHFFFAOYSA-N 50053434 CHEMBL3323036 Cholinesterase 4140 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053434 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053434&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 101902496 103950115 CHEMBL3323036 ZINC12365480 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283253 O=c1n2Cc3ccccc3-c2nc2ccc(OCCCN3CCCCCC3)cc12 InChI=1S/C24H27N3O2/c28-24-21-16-19(29-15-7-14-26-12-5-1-2-6-13-26)10-11-22(21)25-23-20-9-4-3-8-18(20)17-27(23)24/h3-4,8-11,16H,1-2,5-7,12-15,17H2 PAUUUEWXSGQDRD-UHFFFAOYSA-N 50053433 CHEMBL3323037 Cholinesterase 1875 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053433 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053433&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710488 103950114 CHEMBL3323037 ZINC13758998 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283256 O=c1n2Cc3ccccc3-c2nc2ccc(OCCCN3CCCC3)cc12 InChI=1S/C22H23N3O2/c26-22-19-14-17(27-13-5-12-24-10-3-4-11-24)8-9-20(19)23-21-18-7-2-1-6-16(18)15-25(21)22/h1-2,6-9,14H,3-5,10-13,15H2 QYRYFILGDDFGJJ-UHFFFAOYSA-N 50053431 CHEMBL3323038 Cholinesterase 2399 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053431 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053431&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710489 103950112 CHEMBL3323038 ZINC03815713 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283257 CCN(CC)CCCOc1ccc2nc3-c4ccccc4Cn3c(=O)c2c1 InChI=1S/C22H25N3O2/c1-3-24(4-2)12-7-13-27-17-10-11-20-19(14-17)22(26)25-15-16-8-5-6-9-18(16)21(25)23-20/h5-6,8-11,14H,3-4,7,12-13,15H2,1-2H3 MIPWRXSZLNVAKQ-UHFFFAOYSA-N 50053429 CHEMBL3323039 Cholinesterase 1879 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053429 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053429&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710490 103950110 CHEMBL3323039 ZINC01540864 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283259 O=c1n2Cc3ccccc3-c2nc2ccc(OCCCN3CCc4ccccc4C3)cc12 InChI=1S/C27H25N3O2/c31-27-24-16-22(32-15-5-13-29-14-12-19-6-1-2-7-20(19)17-29)10-11-25(24)28-26-23-9-4-3-8-21(23)18-30(26)27/h1-4,6-11,16H,5,12-15,17-18H2 VKOZVVGTANTLFS-UHFFFAOYSA-N 50053428 CHEMBL3323040 Cholinesterase 1726 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053428 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053428&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710491 103950109 CHEMBL3323040 ZINC04617927 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283260 O=c1n2Cc3ccccc3-c2nc2ccc(OCCCn3ccnc3)cc12 InChI=1S/C21H18N4O2/c26-21-18-12-16(27-11-3-9-24-10-8-22-14-24)6-7-19(18)23-20-17-5-2-1-4-15(17)13-25(20)21/h1-2,4-8,10,12,14H,3,9,11,13H2 FNPVIOSBFNALDE-UHFFFAOYSA-N 50053427 CHEMBL3323041 Cholinesterase 9099 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053427 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053427&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710492 103950108 CHEMBL3323041 ZINC03815730 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283261 O=c1n2CCc3ccccc3-c2nc2ccc(OCCCN3CCCCC3)cc12 InChI=1S/C24H27N3O2/c28-24-21-17-19(29-16-6-14-26-12-4-1-5-13-26)9-10-22(21)25-23-20-8-3-2-7-18(20)11-15-27(23)24/h2-3,7-10,17H,1,4-6,11-16H2 MIQVJQGPYICMPP-UHFFFAOYSA-N 50053426 CHEMBL3323042 Cholinesterase 955 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053426 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053426&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710493 103950107 CHEMBL3323042 ZINC12365505 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283266 O=c1n2CCc3ccccc3-c2nc2ccc(OCCCN3CCCCCC3)cc12 InChI=1S/C25H29N3O2/c29-25-22-18-20(30-17-7-15-27-13-5-1-2-6-14-27)10-11-23(22)26-24-21-9-4-3-8-19(21)12-16-28(24)25/h3-4,8-11,18H,1-2,5-7,12-17H2 CMHSZUJWIWDLDH-UHFFFAOYSA-N 50053425 CHEMBL3323020 Cholinesterase 585 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053425 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053425&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710471 103950106 CHEMBL3323020 ZINC21289950 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283267 O=c1n2CCc3ccccc3-c2nc2ccc(OCCCN3CCCC3)cc12 InChI=1S/C23H25N3O2/c27-23-20-16-18(28-15-5-13-25-11-3-4-12-25)8-9-21(20)24-22-19-7-2-1-6-17(19)10-14-26(22)23/h1-2,6-9,16H,3-5,10-15H2 HNMLEEQDOJHSLD-UHFFFAOYSA-N 50053423 CHEMBL3323021 Cholinesterase 955 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053423 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053423&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710472 103950104 CHEMBL3323021 ZINC13759011 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283268 CCN(CC)CCCOc1ccc2nc3-c4ccccc4CCn3c(=O)c2c1 InChI=1S/C23H27N3O2/c1-3-25(4-2)13-7-15-28-18-10-11-21-20(16-18)23(27)26-14-12-17-8-5-6-9-19(17)22(26)24-21/h5-6,8-11,16H,3-4,7,12-15H2,1-2H3 VCKXKSQVWHZQHR-UHFFFAOYSA-N 50053422 CHEMBL3323043 Cholinesterase 2158 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053422 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053422&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710494 103950103 CHEMBL3323043 ZINC04617921 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283269 O=c1n2CCc3ccccc3-c2nc2ccc(OCCCN3CCc4ccccc4C3)cc12 InChI=1S/C28H27N3O2/c32-28-25-18-23(33-17-5-14-30-15-12-20-6-1-2-8-22(20)19-30)10-11-26(25)29-27-24-9-4-3-7-21(24)13-16-31(27)28/h1-4,6-11,18H,5,12-17,19H2 WGNYJTRBJZWNOW-UHFFFAOYSA-N 50053421 CHEMBL3323044 Cholinesterase 1832 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053421 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053421&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710495 103950102 CHEMBL3323044 ZINC03815729 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283270 O=c1n2CCc3ccccc3-c2nc2ccc(OCCCn3ccnc3)cc12 InChI=1S/C22H20N4O2/c27-22-19-14-17(28-13-3-10-25-12-9-23-15-25)6-7-20(19)24-21-18-5-2-1-4-16(18)8-11-26(21)22/h1-2,4-7,9,12,14-15H,3,8,10-11,13H2 WYDAWNYRRQAAEA-UHFFFAOYSA-N 50053420 CHEMBL3323045 Cholinesterase 8690 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053420 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053420&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710496 103950101 CHEMBL3323045 ZINC13759012 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283272 O=c1n2CCCc3ccccc3-c2nc2ccc(OCCCN3CCCCC3)cc12 InChI=1S/C25H29N3O2/c29-25-22-18-20(30-17-7-15-27-13-4-1-5-14-27)11-12-23(22)26-24-21-10-3-2-8-19(21)9-6-16-28(24)25/h2-3,8,10-12,18H,1,4-7,9,13-17H2 PFYRGBJRPBPVMS-UHFFFAOYSA-N 50053419 CHEMBL3323046 Cholinesterase 2673 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053419 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053419&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710497 103950100 CHEMBL3323046 ZINC04617928 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283274 O=c1n2CCCc3ccccc3-c2nc2ccc(OCCCN3CCCCCC3)cc12 InChI=1S/C26H31N3O2/c30-26-23-19-21(31-18-8-16-28-14-5-1-2-6-15-28)12-13-24(23)27-25-22-11-4-3-9-20(22)10-7-17-29(25)26/h3-4,9,11-13,19H,1-2,5-8,10,14-18H2 XSSSDRLEDOFMQY-UHFFFAOYSA-N 50053569 CHEMBL3323047 Cholinesterase 865 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053569 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053569&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710498 103950249 CHEMBL3323047 ZINC13759225 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283275 O=c1n2CCCc3ccccc3-c2nc2ccc(OCCCN3CCCC3)cc12 InChI=1S/C24H27N3O2/c28-24-21-17-19(29-16-6-14-26-12-3-4-13-26)10-11-22(21)25-23-20-9-2-1-7-18(20)8-5-15-27(23)24/h1-2,7,9-11,17H,3-6,8,12-16H2 ILRYAGJOBSWSSP-UHFFFAOYSA-N 50053570 CHEMBL3323048 Cholinesterase 3606 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053570 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053570&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710499 103950250 CHEMBL3323048 ZINC13759235 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283276 CCN(CC)CCCOc1ccc2nc3-c4ccccc4CCCn3c(=O)c2c1 InChI=1S/C24H29N3O2/c1-3-26(4-2)14-8-16-29-19-12-13-22-21(17-19)24(28)27-15-7-10-18-9-5-6-11-20(18)23(27)25-22/h5-6,9,11-13,17H,3-4,7-8,10,14-16H2,1-2H3 GLVFHGWUKQPBOF-UHFFFAOYSA-N 50053443 CHEMBL3323049 Cholinesterase 5093 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053443 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053443&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710500 103950124 CHEMBL3323049 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283277 O=c1n2CCCc3ccccc3-c2nc2ccc(OCCCN3CCc4ccccc4C3)cc12 InChI=1S/C29H29N3O2/c33-29-26-19-24(34-18-6-15-31-17-14-21-7-1-2-9-23(21)20-31)12-13-27(26)30-28-25-11-4-3-8-22(25)10-5-16-32(28)29/h1-4,7-9,11-13,19H,5-6,10,14-18,20H2 SRUBEYBHGYYIOR-UHFFFAOYSA-N 50053444 CHEMBL3323050 Cholinesterase 1841 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053444 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053444&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710501 103950125 CHEMBL3323050 ZINC21289890 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283278 O=c1n2CCCc3ccccc3-c2nc2ccc(OCCCn3ccnc3)cc12 InChI=1S/C23H22N4O2/c28-23-20-15-18(29-14-4-11-26-13-10-24-16-26)8-9-21(20)25-22-19-7-2-1-5-17(19)6-3-12-27(22)23/h1-2,5,7-10,13,15-16H,3-4,6,11-12,14H2 YGMTUJWKFDIKGP-UHFFFAOYSA-N 50053442 CHEMBL3323051 Cholinesterase 52000 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053442 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053442&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710502 103950123 CHEMBL3323051 ZINC03815726 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283279 O=c1n2CCCc2nc2ccc(OCCCN3CCCCC3)cc12 InChI=1S/C19H25N3O2/c23-19-16-14-15(24-13-5-11-21-9-2-1-3-10-21)7-8-17(16)20-18-6-4-12-22(18)19/h7-8,14H,1-6,9-13H2 FFIZZPFJAXHTDR-UHFFFAOYSA-N 50053441 CHEMBL3323053 Cholinesterase 122462 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053441 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053441&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710504 103950122 CHEMBL3323053 ZINC21289983 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283280 O=c1n2CCCc2nc2ccc(OCCCN3CCCCCC3)cc12 InChI=1S/C20H27N3O2/c24-20-17-15-16(8-9-18(17)21-19-7-5-13-23(19)20)25-14-6-12-22-10-3-1-2-4-11-22/h8-9,15H,1-7,10-14H2 LXPSFEADEMEYEK-UHFFFAOYSA-N 50053445 CHEMBL3323054 Cholinesterase 5224 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053445 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053445&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710505 103950126 CHEMBL3323054 ZINC03815749 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283281 O=c1n2CCCc2nc2ccc(OCCCN3CCCC3)cc12 InChI=1S/C18H23N3O2/c22-18-15-13-14(23-12-4-10-20-8-1-2-9-20)6-7-16(15)19-17-5-3-11-21(17)18/h6-7,13H,1-5,8-12H2 JQHVEQJVOICSCX-UHFFFAOYSA-N 50053446 CHEMBL3323055 Cholinesterase 10544 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053446 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053446&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710506 103950127 CHEMBL3323055 ZINC01540866 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283282 CCN(CC)CCCOc1ccc2nc3CCCn3c(=O)c2c1 InChI=1S/C18H25N3O2/c1-3-20(4-2)10-6-12-23-14-8-9-16-15(13-14)18(22)21-11-5-7-17(21)19-16/h8-9,13H,3-7,10-12H2,1-2H3 DWOXBDXTFVOWJF-UHFFFAOYSA-N 50053440 CHEMBL3323056 Cholinesterase 828 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053440 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053440&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710507 103950121 CHEMBL3323056 ZINC27307936 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283283 O=c1n2CCCc2nc2ccc(OCCCN3CCc4ccccc4C3)cc12 InChI=1S/C23H25N3O2/c27-23-20-15-19(8-9-21(20)24-22-7-3-12-26(22)23)28-14-4-11-25-13-10-17-5-1-2-6-18(17)16-25/h1-2,5-6,8-9,15H,3-4,7,10-14,16H2 NAWSEIOAWKWGFQ-UHFFFAOYSA-N 50053447 CHEMBL3323057 Cholinesterase 776 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053447 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053447&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710508 103950128 CHEMBL3323057 ZINC03815716 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283284 O=c1n2CCCc2nc2ccc(OCCCn3ccnc3)cc12 InChI=1S/C17H18N4O2/c22-17-14-11-13(23-10-2-7-20-9-6-18-12-20)4-5-15(14)19-16-3-1-8-21(16)17/h4-6,9,11-12H,1-3,7-8,10H2 JURKPKKPJKIBGL-UHFFFAOYSA-N 50053448 CHEMBL3323058 Cholinesterase 14655 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053448 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053448&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710509 103950129 CHEMBL3323058 ZINC01540868 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283285 O=c1n2CCCCc2nc2ccc(OCCCN3CCCCC3)cc12 InChI=1S/C20H27N3O2/c24-20-17-15-16(25-14-6-12-22-10-3-1-4-11-22)8-9-18(17)21-19-7-2-5-13-23(19)20/h8-9,15H,1-7,10-14H2 SWZRIMBMJKPHQJ-UHFFFAOYSA-N 50053439 CHEMBL3323059 Cholinesterase 6546 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053439 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053439&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710510 103950120 CHEMBL3323059 ZINC04617924 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283286 O=c1n2CCCCc2nc2ccc(OCCCN3CCCCCC3)cc12 InChI=1S/C21H29N3O2/c25-21-18-16-17(26-15-7-13-23-11-4-1-2-5-12-23)9-10-19(18)22-20-8-3-6-14-24(20)21/h9-10,16H,1-8,11-15H2 ZYVJJXKJIKGMMS-UHFFFAOYSA-N 50053449 CHEMBL3323060 Cholinesterase 1770 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053449 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053449&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710511 103950130 CHEMBL3323060 ZINC03815773 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283287 O=c1n2CCCCc2nc2ccc(OCCCN3CCCC3)cc12 InChI=1S/C19H25N3O2/c23-19-16-14-15(24-13-5-11-21-9-3-4-10-21)7-8-17(16)20-18-6-1-2-12-22(18)19/h7-8,14H,1-6,9-13H2 RXRWWFXXATZQFX-UHFFFAOYSA-N 50053450 CHEMBL3323061 Cholinesterase 16069 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053450 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053450&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710512 103950131 CHEMBL3323061 ZINC13759022 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283288 CCN(CC)CCCOc1ccc2nc3CCCCn3c(=O)c2c1 InChI=1S/C19H27N3O2/c1-3-21(4-2)11-7-13-24-15-9-10-17-16(14-15)19(23)22-12-6-5-8-18(22)20-17/h9-10,14H,3-8,11-13H2,1-2H3 DNOBRQKRZLULQE-UHFFFAOYSA-N 50053438 CHEMBL3323062 Cholinesterase 9141 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053438 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053438&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710513 103950119 CHEMBL3323062 ZINC13759009 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283289 O=c1n2CCCCc2nc2ccc(OCCCN3CCc4ccccc4C3)cc12 InChI=1S/C24H27N3O2/c28-24-21-16-20(9-10-22(21)25-23-8-3-4-13-27(23)24)29-15-5-12-26-14-11-18-6-1-2-7-19(18)17-26/h1-2,6-7,9-10,16H,3-5,8,11-15,17H2 OHYQAMLTLFYMHA-UHFFFAOYSA-N 50053451 CHEMBL3323063 Cholinesterase 5483 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053451 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053451&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710514 103950132 CHEMBL3323063 ZINC13758992 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283290 O=c1n2CCCCc2nc2ccc(OCCCn3ccnc3)cc12 InChI=1S/C18H20N4O2/c23-18-15-12-14(24-11-3-8-21-10-7-19-13-21)5-6-16(15)20-17-4-1-2-9-22(17)18/h5-7,10,12-13H,1-4,8-9,11H2 NOIILUZHCRLIDA-UHFFFAOYSA-N 50053452 CHEMBL3323064 Cholinesterase 50000 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053452 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053452&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710515 103950133 CHEMBL3323064 ZINC13759014 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283291 O=c1n2CCCCCc2nc2ccc(OCCCN3CCCCC3)cc12 InChI=1S/C21H29N3O2/c25-21-18-16-17(26-15-7-13-23-11-4-2-5-12-23)9-10-19(18)22-20-8-3-1-6-14-24(20)21/h9-10,16H,1-8,11-15H2 DYDMQTJZQBAGEY-UHFFFAOYSA-N 50053437 CHEMBL3323065 Cholinesterase 12735 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053437 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053437&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710516 103950118 CHEMBL3323065 ZINC13759016 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283292 O=c1n2CCCCCc2nc2ccc(OCCCN3CCCCCC3)cc12 InChI=1S/C22H31N3O2/c26-22-19-17-18(27-16-8-14-24-12-5-1-2-6-13-24)10-11-20(19)23-21-9-4-3-7-15-25(21)22/h10-11,17H,1-9,12-16H2 UHHRCQCMWYTYSN-UHFFFAOYSA-N 50053453 CHEMBL3323066 Cholinesterase 1803 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053453 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053453&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710517 103950134 CHEMBL3323066 ZINC13759006 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283293 O=c1n2CCCCCc2nc2ccc(OCCCN3CCCC3)cc12 InChI=1S/C20H27N3O2/c24-20-17-15-16(25-14-6-12-22-10-4-5-11-22)8-9-18(17)21-19-7-2-1-3-13-23(19)20/h8-9,15H,1-7,10-14H2 CPAVPSHQFQQOQC-UHFFFAOYSA-N 50053454 CHEMBL3323067 Cholinesterase 12190 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053454 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053454&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710518 103950135 CHEMBL3323067 ZINC21289933 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283294 CCN(CC)CCCOc1ccc2nc3CCCCCn3c(=O)c2c1 InChI=1S/C20H29N3O2/c1-3-22(4-2)12-8-14-25-16-10-11-18-17(15-16)20(24)23-13-7-5-6-9-19(23)21-18/h10-11,15H,3-9,12-14H2,1-2H3 KNXGHTSSGIZTSA-UHFFFAOYSA-N 50053436 CHEMBL3323068 Cholinesterase 10740 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053436 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053436&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710519 103950117 CHEMBL3323068 ZINC13758996 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283295 O=c1n2CCCCCc2nc2ccc(OCCCN3CCc4ccccc4C3)cc12 InChI=1S/C25H29N3O2/c29-25-22-17-21(10-11-23(22)26-24-9-2-1-5-14-28(24)25)30-16-6-13-27-15-12-19-7-3-4-8-20(19)18-27/h3-4,7-8,10-11,17H,1-2,5-6,9,12-16,18H2 GIAHRJPZCNIJBQ-UHFFFAOYSA-N 50053532 CHEMBL3323069 Cholinesterase 3027 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053532 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053532&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710520 313069726 CHEMBL3323069 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283296 O=c1n2CCCCCc2nc2ccc(OCCCn3ccnc3)cc12 InChI=1S/C19H22N4O2/c24-19-16-13-15(25-12-4-9-22-11-8-20-14-22)6-7-17(16)21-18-5-2-1-3-10-23(18)19/h6-8,11,13-14H,1-5,9-10,12H2 IEJALPDEEYDFTC-UHFFFAOYSA-N 50053567 CHEMBL3323070 Cholinesterase 59704 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053567 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053567&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710521 103950247 CHEMBL3323070 ZINC13759229 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50283297 O=c1n2CCCc2nc2ccc(OCCCCCCCCCN3CCCCC3)cc12 InChI=1S/C25H37N3O2/c29-25-22-20-21(13-14-23(22)26-24-12-11-18-28(24)25)30-19-10-5-3-1-2-4-7-15-27-16-8-6-9-17-27/h13-14,20H,1-12,15-19H2 KYOYXRRRLHKOKN-UHFFFAOYSA-N 50053568 CHEMBL3323071 Cholinesterase 8511 ChEMBL 10.1016/j.bmc.2014.06.045 10.7270/Q25X2BK0 25047936 Darras, FH; Wehle, S; Huang, G; Sotriffer, CA; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053568 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053568&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710522 103950248 CHEMBL3323071 ZINC13759246 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50294443 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 40 ChEMBL 10.1016/j.bmcl.2014.12.084 10.7270/Q2P55Q6T 25597007 Digiacomo, M; Chen, Z; Wang, S; Lapucci, A; Macchia, M; Yang, X; Chu, J; Han, Y; Pi, R; Rapposelli, S Universit£ di Pisa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50294462 OC(CNC(=O)CCCCC1CCSS1)CNc1c2CCCCc2nc2cc(Cl)ccc12 InChI=1S/C24H32ClN3O2S2/c25-16-9-10-20-22(13-16)28-21-7-3-2-6-19(21)24(20)27-15-17(29)14-26-23(30)8-4-1-5-18-11-12-31-32-18/h9-10,13,17-18,29H,1-8,11-12,14-15H2,(H,26,30)(H,27,28) QCXDJUMPSGXJCM-UHFFFAOYSA-N 50061237 CHEMBL3393740 Cholinesterase 1030 ChEMBL 10.1016/j.bmcl.2014.12.084 10.7270/Q2P55Q6T 25597007 Digiacomo, M; Chen, Z; Wang, S; Lapucci, A; Macchia, M; Yang, X; Chu, J; Han, Y; Pi, R; Rapposelli, S Universit£ di Pisa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50061237 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50061237&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118725629 313070773 CHEMBL3393740 C02051 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50294466 OC(CNC(=O)CCCCC1CCSS1)CNc1c2CCCCc2nc2ccccc12 InChI=1S/C24H33N3O2S2/c28-17(15-25-23(29)12-6-1-7-18-13-14-30-31-18)16-26-24-19-8-2-4-10-21(19)27-22-11-5-3-9-20(22)24/h2,4,8,10,17-18,28H,1,3,5-7,9,11-16H2,(H,25,29)(H,26,27) PDYJCWAZIZYPDT-UHFFFAOYSA-N 50061238 CHEMBL3393739 Cholinesterase 1180 ChEMBL 10.1016/j.bmcl.2014.12.084 10.7270/Q2P55Q6T 25597007 Digiacomo, M; Chen, Z; Wang, S; Lapucci, A; Macchia, M; Yang, X; Chu, J; Han, Y; Pi, R; Rapposelli, S Universit£ di Pisa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50061238 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50061238&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118725628 313070774 CHEMBL3393739 C02051 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50294468 COc1cc(\C=C\C(=O)NCC(O)CNc2c3CCCCc3nc3cc(Cl)ccc23)ccc1O InChI=1S/C26H28ClN3O4/c1-34-24-12-16(6-10-23(24)32)7-11-25(33)28-14-18(31)15-29-26-19-4-2-3-5-21(19)30-22-13-17(27)8-9-20(22)26/h6-13,18,31-32H,2-5,14-15H2,1H3,(H,28,33)(H,29,30)/b11-7+ PRAUMCUHZYERBF-YRNVUSSQSA-N 50061239 CHEMBL3393738 Cholinesterase 710 ChEMBL 10.1016/j.bmcl.2014.12.084 10.7270/Q2P55Q6T 25597007 Digiacomo, M; Chen, Z; Wang, S; Lapucci, A; Macchia, M; Yang, X; Chu, J; Han, Y; Pi, R; Rapposelli, S Universit£ di Pisa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50061239 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50061239&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118725627 313070775 CHEMBL3393738 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50294469 COc1cc(\C=C\C(=O)NCC(O)CNc2c3CCCCc3nc3ccccc23)ccc1O InChI=1S/C26H29N3O4/c1-33-24-14-17(10-12-23(24)31)11-13-25(32)27-15-18(30)16-28-26-19-6-2-4-8-21(19)29-22-9-5-3-7-20(22)26/h2,4,6,8,10-14,18,30-31H,3,5,7,9,15-16H2,1H3,(H,27,32)(H,28,29)/b13-11+ RDJOOCOIKQABAX-ACCUITESSA-N 50061240 CHEMBL3393737 Cholinesterase 310 ChEMBL 10.1016/j.bmcl.2014.12.084 10.7270/Q2P55Q6T 25597007 Digiacomo, M; Chen, Z; Wang, S; Lapucci, A; Macchia, M; Yang, X; Chu, J; Han, Y; Pi, R; Rapposelli, S Universit£ di Pisa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50061240 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50061240&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118725626 313070776 CHEMBL3393737 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50294472 OC(CNC(=O)\C=C\c1ccc(O)c(O)c1)CNc1c2CCCCc2nc2cc(Cl)ccc12 InChI=1S/C25H26ClN3O4/c26-16-7-8-19-21(12-16)29-20-4-2-1-3-18(20)25(19)28-14-17(30)13-27-24(33)10-6-15-5-9-22(31)23(32)11-15/h5-12,17,30-32H,1-4,13-14H2,(H,27,33)(H,28,29)/b10-6+ FCDQKYLJUPTKRI-UXBLZVDNSA-N 50061274 CHEMBL3393736 Cholinesterase 360 ChEMBL 10.1016/j.bmcl.2014.12.084 10.7270/Q2P55Q6T 25597007 Digiacomo, M; Chen, Z; Wang, S; Lapucci, A; Macchia, M; Yang, X; Chu, J; Han, Y; Pi, R; Rapposelli, S Universit£ di Pisa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50061274 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50061274&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118725625 103956837 CHEMBL3393736 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50294473 OC(CNC(=O)\C=C\c1ccc(O)c(O)c1)CNc1c2CCCCc2nc2ccccc12 InChI=1S/C25H27N3O4/c29-17(14-26-24(32)12-10-16-9-11-22(30)23(31)13-16)15-27-25-18-5-1-3-7-20(18)28-21-8-4-2-6-19(21)25/h1,3,5,7,9-13,17,29-31H,2,4,6,8,14-15H2,(H,26,32)(H,27,28)/b12-10+ RLKXGYRMBHDXLP-ZRDIBKRKSA-N 50061294 CHEMBL3393735 Cholinesterase 1010 ChEMBL 10.1016/j.bmcl.2014.12.084 10.7270/Q2P55Q6T 25597007 Digiacomo, M; Chen, Z; Wang, S; Lapucci, A; Macchia, M; Yang, X; Chu, J; Han, Y; Pi, R; Rapposelli, S Universit£ di Pisa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50061294 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50061294&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118725624 103956857 CHEMBL3393735 ZINC27309915 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50280784 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 5380 ChEMBL 10.1016/j.ejmech.2014.01.017 10.7270/Q2H996T1 25036795 Akrami, H; Mirjalili, BF; Khoobi, M; Nadri, H; Moradi, A; Sakhteman, A; Emami, S; Foroumadi, A; Shafiee, A Yazd University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50280816 ClCc1ccc(C[n+]2ccc(\C=C3\C(=O)Nc4ccccc34)cc2)cc1 InChI=1S/C22H17ClN2O/c23-14-17-5-7-18(8-6-17)15-25-11-9-16(10-12-25)13-20-19-3-1-2-4-21(19)24-22(20)26/h1-13H,14-15H2/p+1 LXCMYAUVBPCFEY-UHFFFAOYSA-O 50052202 CHEMBL3318410 Cholinesterase 1000 ChEMBL 10.1016/j.ejmech.2014.01.017 10.7270/Q2H996T1 25036795 Akrami, H; Mirjalili, BF; Khoobi, M; Nadri, H; Moradi, A; Sakhteman, A; Emami, S; Foroumadi, A; Shafiee, A Yazd University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50052202 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50052202&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118708870 313069517 CHEMBL3318410 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50280817 Clc1ccc(C[n+]2ccc(\C=C3\C(=O)Nc4ccccc34)cc2)c(Cl)c1 InChI=1S/C21H14Cl2N2O/c22-16-6-5-15(19(23)12-16)13-25-9-7-14(8-10-25)11-18-17-3-1-2-4-20(17)24-21(18)26/h1-12H,13H2/p+1 KLVIZKGMBNFEFD-UHFFFAOYSA-O 50052203 CHEMBL3318409 Cholinesterase 2500 ChEMBL 10.1016/j.ejmech.2014.01.017 10.7270/Q2H996T1 25036795 Akrami, H; Mirjalili, BF; Khoobi, M; Nadri, H; Moradi, A; Sakhteman, A; Emami, S; Foroumadi, A; Shafiee, A Yazd University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50052203 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50052203&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118708868 313069518 CHEMBL3318409 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50280852 O=C1Nc2ccccc2\C1=C/c1cc[n+](Cc2ccccc2)cc1 InChI=1S/C21H16N2O/c24-21-19(18-8-4-5-9-20(18)22-21)14-16-10-12-23(13-11-16)15-17-6-2-1-3-7-17/h1-14H,15H2/p+1 OUUHBSHPTZJUKG-UHFFFAOYSA-O 50052205 CHEMBL3318390 Cholinesterase 4300 ChEMBL 10.1016/j.ejmech.2014.01.017 10.7270/Q2H996T1 25036795 Akrami, H; Mirjalili, BF; Khoobi, M; Nadri, H; Moradi, A; Sakhteman, A; Emami, S; Foroumadi, A; Shafiee, A Yazd University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50052205 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50052205&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118708830 313069520 CHEMBL3318390 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50280853 Fc1ccccc1C[n+]1ccc(\C=C2\C(=O)Nc3ccccc23)cc1 InChI=1S/C21H15FN2O/c22-19-7-3-1-5-16(19)14-24-11-9-15(10-12-24)13-18-17-6-2-4-8-20(17)23-21(18)25/h1-13H,14H2/p+1 CMEGVZCWMNLLLK-UHFFFAOYSA-O 50052206 CHEMBL3318391 Cholinesterase 4270 ChEMBL 10.1016/j.ejmech.2014.01.017 10.7270/Q2H996T1 25036795 Akrami, H; Mirjalili, BF; Khoobi, M; Nadri, H; Moradi, A; Sakhteman, A; Emami, S; Foroumadi, A; Shafiee, A Yazd University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50052206 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50052206&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118708832 313069521 CHEMBL3318391 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50280854 Clc1ccccc1C[n+]1ccc(\C=C2\C(=O)Nc3ccccc23)cc1 InChI=1S/C21H15ClN2O/c22-19-7-3-1-5-16(19)14-24-11-9-15(10-12-24)13-18-17-6-2-4-8-20(17)23-21(18)25/h1-13H,14H2/p+1 XUCJKCQTBJEHFS-UHFFFAOYSA-O 50052204 CHEMBL3318392 Cholinesterase 1370 ChEMBL 10.1016/j.ejmech.2014.01.017 10.7270/Q2H996T1 25036795 Akrami, H; Mirjalili, BF; Khoobi, M; Nadri, H; Moradi, A; Sakhteman, A; Emami, S; Foroumadi, A; Shafiee, A Yazd University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50052204 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50052204&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118708834 313069519 CHEMBL3318392 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50280855 Cc1ccccc1C[n+]1ccc(\C=C2\C(=O)Nc3ccccc23)cc1 InChI=1S/C22H18N2O/c1-16-6-2-3-7-18(16)15-24-12-10-17(11-13-24)14-20-19-8-4-5-9-21(19)23-22(20)25/h2-14H,15H2,1H3/p+1 ZRCHAWWRHSDXJA-UHFFFAOYSA-O 50052207 CHEMBL3318393 Cholinesterase 887 ChEMBL 10.1016/j.ejmech.2014.01.017 10.7270/Q2H996T1 25036795 Akrami, H; Mirjalili, BF; Khoobi, M; Nadri, H; Moradi, A; Sakhteman, A; Emami, S; Foroumadi, A; Shafiee, A Yazd University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50052207 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50052207&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118708836 313069522 CHEMBL3318393 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50280856 Brc1ccccc1C[n+]1ccc(\C=C2\C(=O)Nc3ccccc23)cc1 InChI=1S/C21H15BrN2O/c22-19-7-3-1-5-16(19)14-24-11-9-15(10-12-24)13-18-17-6-2-4-8-20(17)23-21(18)25/h1-13H,14H2/p+1 UWHRTIFFOUOZAB-UHFFFAOYSA-O 50052208 CHEMBL3318394 Cholinesterase 1230 ChEMBL 10.1016/j.ejmech.2014.01.017 10.7270/Q2H996T1 25036795 Akrami, H; Mirjalili, BF; Khoobi, M; Nadri, H; Moradi, A; Sakhteman, A; Emami, S; Foroumadi, A; Shafiee, A Yazd University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50052208 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50052208&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118708838 313069523 CHEMBL3318394 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50280858 [O-][N+](=O)c1ccccc1C[n+]1ccc(\C=C2\C(=O)Nc3ccccc23)cc1 InChI=1S/C21H15N3O3/c25-21-18(17-6-2-3-7-19(17)22-21)13-15-9-11-23(12-10-15)14-16-5-1-4-8-20(16)24(26)27/h1-13H,14H2/p+1 NLTJCPAMIMPQHR-UHFFFAOYSA-O 50052209 CHEMBL3318395 Cholinesterase 1600 ChEMBL 10.1016/j.ejmech.2014.01.017 10.7270/Q2H996T1 25036795 Akrami, H; Mirjalili, BF; Khoobi, M; Nadri, H; Moradi, A; Sakhteman, A; Emami, S; Foroumadi, A; Shafiee, A Yazd University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50052209 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50052209&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118708840 313069524 CHEMBL3318395 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50280859 Fc1cccc(Cl)c1C[n+]1ccc(\C=C2\C(=O)Nc3ccccc23)cc1 InChI=1S/C21H14ClFN2O/c22-18-5-3-6-19(23)17(18)13-25-10-8-14(9-11-25)12-16-15-4-1-2-7-20(15)24-21(16)26/h1-12H,13H2/p+1 OJQHHOKIRQOEEH-UHFFFAOYSA-O 50052210 CHEMBL3318398 Cholinesterase 2000 ChEMBL 10.1016/j.ejmech.2014.01.017 10.7270/Q2H996T1 25036795 Akrami, H; Mirjalili, BF; Khoobi, M; Nadri, H; Moradi, A; Sakhteman, A; Emami, S; Foroumadi, A; Shafiee, A Yazd University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50052210 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50052210&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118708846 313069525 CHEMBL3318398 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50280860 Clc1cccc(Cl)c1C[n+]1ccc(\C=C2\C(=O)Nc3ccccc23)cc1 InChI=1S/C21H14Cl2N2O/c22-18-5-3-6-19(23)17(18)13-25-10-8-14(9-11-25)12-16-15-4-1-2-7-20(15)24-21(16)26/h1-12H,13H2/p+1 PGGNIPYBKWGQBH-UHFFFAOYSA-O 50052211 CHEMBL3318399 Cholinesterase 1500 ChEMBL 10.1016/j.ejmech.2014.01.017 10.7270/Q2H996T1 25036795 Akrami, H; Mirjalili, BF; Khoobi, M; Nadri, H; Moradi, A; Sakhteman, A; Emami, S; Foroumadi, A; Shafiee, A Yazd University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50052211 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50052211&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118708848 312697513 CHEMBL3318399 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50280863 Clc1cccc(C[n+]2ccc(\C=C3\C(=O)Nc4ccccc34)cc2)c1 InChI=1S/C21H15ClN2O/c22-17-5-3-4-16(12-17)14-24-10-8-15(9-11-24)13-19-18-6-1-2-7-20(18)23-21(19)25/h1-13H,14H2/p+1 OWFVGFOBIKSUON-UHFFFAOYSA-O 50052212 CHEMBL3318400 Cholinesterase 1350 ChEMBL 10.1016/j.ejmech.2014.01.017 10.7270/Q2H996T1 25036795 Akrami, H; Mirjalili, BF; Khoobi, M; Nadri, H; Moradi, A; Sakhteman, A; Emami, S; Foroumadi, A; Shafiee, A Yazd University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50052212 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50052212&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118708850 313069526 CHEMBL3318400 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50280864 Brc1cccc(C[n+]2ccc(\C=C3\C(=O)Nc4ccccc34)cc2)c1 InChI=1S/C21H15BrN2O/c22-17-5-3-4-16(12-17)14-24-10-8-15(9-11-24)13-19-18-6-1-2-7-20(18)23-21(19)25/h1-13H,14H2/p+1 SROROAWBHZEENT-UHFFFAOYSA-O 50052213 CHEMBL3318401 Cholinesterase 1740 ChEMBL 10.1016/j.ejmech.2014.01.017 10.7270/Q2H996T1 25036795 Akrami, H; Mirjalili, BF; Khoobi, M; Nadri, H; Moradi, A; Sakhteman, A; Emami, S; Foroumadi, A; Shafiee, A Yazd University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50052213 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50052213&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118708852 313069527 CHEMBL3318401 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50280865 [Cl-].Cc1cccc(C[n+]2ccc(\C=C3\C(=O)Nc4ccccc34)cc2)c1 InChI=1S/C22H18N2O.ClH/c1-16-5-4-6-18(13-16)15-24-11-9-17(10-12-24)14-20-19-7-2-3-8-21(19)23-22(20)25;/h2-14H,15H2,1H3;1H CEJGQFJRWQAZLM-UHFFFAOYSA-N 50052214 CHEMBL3318402 Cholinesterase 1700 ChEMBL 10.1016/j.ejmech.2014.01.017 10.7270/Q2H996T1 25036795 Akrami, H; Mirjalili, BF; Khoobi, M; Nadri, H; Moradi, A; Sakhteman, A; Emami, S; Foroumadi, A; Shafiee, A Yazd University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50052214 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50052214&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118708853 103949110 CHEMBL3318402 ZINC13757003 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50280866 [Cl-].COc1cccc(C[n+]2ccc(\C=C3\C(=O)Nc4ccccc34)cc2)c1 InChI=1S/C22H18N2O2.ClH/c1-26-18-6-4-5-17(13-18)15-24-11-9-16(10-12-24)14-20-19-7-2-3-8-21(19)23-22(20)25;/h2-14H,15H2,1H3;1H QKQIGHNZOKXRPS-UHFFFAOYSA-N 50052215 CHEMBL3318403 Cholinesterase 2800 ChEMBL 10.1016/j.ejmech.2014.01.017 10.7270/Q2H996T1 25036795 Akrami, H; Mirjalili, BF; Khoobi, M; Nadri, H; Moradi, A; Sakhteman, A; Emami, S; Foroumadi, A; Shafiee, A Yazd University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50052215 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50052215&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118708855 103949111 CHEMBL3318403 ZINC13756990 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50280867 [Cl-].Fc1cccc(C[n+]2ccc(\C=C3\C(=O)Nc4ccccc34)cc2)c1 InChI=1S/C21H15FN2O.ClH/c22-17-5-3-4-16(12-17)14-24-10-8-15(9-11-24)13-19-18-6-1-2-7-20(18)23-21(19)25;/h1-13H,14H2;1H JOKDSLSSNUMELQ-UHFFFAOYSA-N 50052216 CHEMBL3318404 Cholinesterase 4500 ChEMBL 10.1016/j.ejmech.2014.01.017 10.7270/Q2H996T1 25036795 Akrami, H; Mirjalili, BF; Khoobi, M; Nadri, H; Moradi, A; Sakhteman, A; Emami, S; Foroumadi, A; Shafiee, A Yazd University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50052216 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50052216&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118708857 103949112 CHEMBL3318404 ZINC13757017 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50280869 [Cl-].Fc1ccc(C[n+]2ccc(\C=C3\C(=O)Nc4ccccc34)cc2)cc1 InChI=1S/C21H15FN2O.ClH/c22-17-7-5-16(6-8-17)14-24-11-9-15(10-12-24)13-19-18-3-1-2-4-20(18)23-21(19)25;/h1-13H,14H2;1H GKEFWAQNLOCHAC-UHFFFAOYSA-N 50052217 CHEMBL3318405 Cholinesterase 3100 ChEMBL 10.1016/j.ejmech.2014.01.017 10.7270/Q2H996T1 25036795 Akrami, H; Mirjalili, BF; Khoobi, M; Nadri, H; Moradi, A; Sakhteman, A; Emami, S; Foroumadi, A; Shafiee, A Yazd University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50052217 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50052217&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118708859 103949113 CHEMBL3318405 ZINC13756970 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50280870 [Cl-].Clc1ccc(C[n+]2ccc(\C=C3\C(=O)Nc4ccccc34)cc2)cc1 InChI=1S/C21H15ClN2O.ClH/c22-17-7-5-16(6-8-17)14-24-11-9-15(10-12-24)13-19-18-3-1-2-4-20(18)23-21(19)25;/h1-13H,14H2;1H WFFPXZJTXVMSAP-UHFFFAOYSA-N 50052218 CHEMBL3318406 Cholinesterase 2200 ChEMBL 10.1016/j.ejmech.2014.01.017 10.7270/Q2H996T1 25036795 Akrami, H; Mirjalili, BF; Khoobi, M; Nadri, H; Moradi, A; Sakhteman, A; Emami, S; Foroumadi, A; Shafiee, A Yazd University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50052218 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50052218&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118708861 103949114 CHEMBL3318406 ZINC13756983 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50280871 [Cl-].Brc1ccc(C[n+]2ccc(\C=C3\C(=O)Nc4ccccc34)cc2)cc1 InChI=1S/C21H15BrN2O.ClH/c22-17-7-5-16(6-8-17)14-24-11-9-15(10-12-24)13-19-18-3-1-2-4-20(18)23-21(19)25;/h1-13H,14H2;1H LWBWOEUKAIPLNW-UHFFFAOYSA-N 50052219 CHEMBL3318407 Cholinesterase 1900 ChEMBL 10.1016/j.ejmech.2014.01.017 10.7270/Q2H996T1 25036795 Akrami, H; Mirjalili, BF; Khoobi, M; Nadri, H; Moradi, A; Sakhteman, A; Emami, S; Foroumadi, A; Shafiee, A Yazd University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50052219 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50052219&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118708863 103949115 CHEMBL3318407 ZINC13757025 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50280872 [Cl-].COc1ccc(C[n+]2ccc(\C=C3\C(=O)Nc4ccccc34)cc2)cc1 InChI=1S/C22H18N2O2.ClH/c1-26-18-8-6-17(7-9-18)15-24-12-10-16(11-13-24)14-20-19-4-2-3-5-21(19)23-22(20)25;/h2-14H,15H2,1H3;1H KEADSVMFJAHGKH-UHFFFAOYSA-N 50052220 CHEMBL3318396 Cholinesterase 7900 ChEMBL 10.1016/j.ejmech.2014.01.017 10.7270/Q2H996T1 25036795 Akrami, H; Mirjalili, BF; Khoobi, M; Nadri, H; Moradi, A; Sakhteman, A; Emami, S; Foroumadi, A; Shafiee, A Yazd University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50052220 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50052220&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118708841 103949116 CHEMBL3318396 ZINC13756984 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50280874 [Cl-].[O-][N+](=O)c1ccc(C[n+]2ccc(\C=C3\C(=O)Nc4ccccc34)cc2)cc1 InChI=1S/C21H15N3O3.ClH/c25-21-19(18-3-1-2-4-20(18)22-21)13-15-9-11-23(12-10-15)14-16-5-7-17(8-6-16)24(26)27;/h1-13H,14H2;1H CTTNYBQTFXMEQW-UHFFFAOYSA-N 50052221 CHEMBL3318397 Cholinesterase 7500 ChEMBL 10.1016/j.ejmech.2014.01.017 10.7270/Q2H996T1 25036795 Akrami, H; Mirjalili, BF; Khoobi, M; Nadri, H; Moradi, A; Sakhteman, A; Emami, S; Foroumadi, A; Shafiee, A Yazd University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50052221 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50052221&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118708843 103949117 CHEMBL3318397 ZINC13757000 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50280878 [Cl-].Clc1ccc(C[n+]2ccc(\C=C3\C(=O)Nc4ccccc34)cc2)cc1Cl InChI=1S/C21H14Cl2N2O.ClH/c22-18-6-5-15(12-19(18)23)13-25-9-7-14(8-10-25)11-17-16-3-1-2-4-20(16)24-21(17)26;/h1-12H,13H2;1H PLAYAOBOEZLPGS-UHFFFAOYSA-N 50052222 CHEMBL3318408 Cholinesterase 3300 ChEMBL 10.1016/j.ejmech.2014.01.017 10.7270/Q2H996T1 25036795 Akrami, H; Mirjalili, BF; Khoobi, M; Nadri, H; Moradi, A; Sakhteman, A; Emami, S; Foroumadi, A; Shafiee, A Yazd University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50052222 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50052222&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118708865 103949118 CHEMBL3318408 ZINC13757011 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50301537 COc1cc2oc(cc(=O)c2c(OC)c1OC)-c1ccc(OCC(=O)NCCCNc2c3CCCCc3nc3cc(Cl)ccc23)cc1 InChI=1S/C36H36ClN3O7/c1-43-31-19-30-33(36(45-3)35(31)44-2)28(41)18-29(47-30)21-9-12-23(13-10-21)46-20-32(42)38-15-6-16-39-34-24-7-4-5-8-26(24)40-27-17-22(37)11-14-25(27)34/h9-14,17-19H,4-8,15-16,20H2,1-3H3,(H,38,42)(H,39,40) OBCLASMEKFCULV-UHFFFAOYSA-N 50065381 CHEMBL3403872 Cholinesterase 549 ChEMBL 10.1016/j.bmcl.2015.02.015 10.7270/Q29G5PGP 25724825 Liao, S; Deng, H; Huang, S; Yang, J; Wang, S; Yin, B; Zheng, T; Zhang, D; Liu, J; Gao, G; Ma, J; Deng, Z Wenzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50065381 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50065381&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118730040 103960313 CHEMBL3403872 ZINC36330452 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50301538 COc1cc2oc(cc(=O)c2c(OC)c1OC)-c1ccc(OCC(=O)NCCCCNc2c3CCCCc3nc3cc(Cl)ccc23)cc1 InChI=1S/C37H38ClN3O7/c1-44-32-20-31-34(37(46-3)36(32)45-2)29(42)19-30(48-31)22-10-13-24(14-11-22)47-21-33(43)39-16-6-7-17-40-35-25-8-4-5-9-27(25)41-28-18-23(38)12-15-26(28)35/h10-15,18-20H,4-9,16-17,21H2,1-3H3,(H,39,43)(H,40,41) WQLUUKSZHSICTA-UHFFFAOYSA-N 50065380 CHEMBL3403873 Cholinesterase 1242 ChEMBL 10.1016/j.bmcl.2015.02.015 10.7270/Q29G5PGP 25724825 Liao, S; Deng, H; Huang, S; Yang, J; Wang, S; Yin, B; Zheng, T; Zhang, D; Liu, J; Gao, G; Ma, J; Deng, Z Wenzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50065380 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50065380&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118730041 103960312 CHEMBL3403873 ZINC36330454 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50301539 COc1cc2oc(cc(=O)c2c(OC)c1OC)-c1ccc(OCC(=O)NCCCCCNc2c3CCCCc3nc3cc(Cl)ccc23)cc1 InChI=1S/C38H40ClN3O7/c1-45-33-21-32-35(38(47-3)37(33)46-2)30(43)20-31(49-32)23-11-14-25(15-12-23)48-22-34(44)40-17-7-4-8-18-41-36-26-9-5-6-10-28(26)42-29-19-24(39)13-16-27(29)36/h11-16,19-21H,4-10,17-18,22H2,1-3H3,(H,40,44)(H,41,42) JMBDUGUBNUJHAR-UHFFFAOYSA-N 50065361 CHEMBL3403874 Cholinesterase 463 ChEMBL 10.1016/j.bmcl.2015.02.015 10.7270/Q29G5PGP 25724825 Liao, S; Deng, H; Huang, S; Yang, J; Wang, S; Yin, B; Zheng, T; Zhang, D; Liu, J; Gao, G; Ma, J; Deng, Z Wenzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50065361 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50065361&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118730042 313045049 CHEMBL3403874 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50301540 COc1cc2oc(cc(=O)c2c(OC)c1OC)-c1ccc(OCC(=O)NCCCCCCNc2c3CCCCc3nc3cc(Cl)ccc23)cc1 InChI=1S/C39H42ClN3O7/c1-46-34-22-33-36(39(48-3)38(34)47-2)31(44)21-32(50-33)24-12-15-26(16-13-24)49-23-35(45)41-18-8-4-5-9-19-42-37-27-10-6-7-11-29(27)43-30-20-25(40)14-17-28(30)37/h12-17,20-22H,4-11,18-19,23H2,1-3H3,(H,41,45)(H,42,43) PGNONTQJYACCOC-UHFFFAOYSA-N 50065355 CHEMBL3400187 Cholinesterase 321 ChEMBL 10.1016/j.bmcl.2015.02.015 10.7270/Q29G5PGP 25724825 Liao, S; Deng, H; Huang, S; Yang, J; Wang, S; Yin, B; Zheng, T; Zhang, D; Liu, J; Gao, G; Ma, J; Deng, Z Wenzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50065355 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50065355&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118730043 103960288 CHEMBL3400187 ZINC26577989 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50301541 COc1cc2oc(cc(=O)c2c(OC)c1OC)-c1cccc(OCC(=O)NCCCNc2c3CCCCc3nc3cc(Cl)ccc23)c1 InChI=1S/C36H36ClN3O7/c1-43-31-19-30-33(36(45-3)35(31)44-2)28(41)18-29(47-30)21-8-6-9-23(16-21)46-20-32(42)38-14-7-15-39-34-24-10-4-5-11-26(24)40-27-17-22(37)12-13-25(27)34/h6,8-9,12-13,16-19H,4-5,7,10-11,14-15,20H2,1-3H3,(H,38,42)(H,39,40) AIDUIQUGINXQDF-UHFFFAOYSA-N 50065379 CHEMBL3403875 Cholinesterase 819 ChEMBL 10.1016/j.bmcl.2015.02.015 10.7270/Q29G5PGP 25724825 Liao, S; Deng, H; Huang, S; Yang, J; Wang, S; Yin, B; Zheng, T; Zhang, D; Liu, J; Gao, G; Ma, J; Deng, Z Wenzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50065379 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50065379&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118730044 103960311 CHEMBL3403875 ZINC22939040 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50301542 COc1cc2oc(cc(=O)c2c(OC)c1OC)-c1cccc(OCC(=O)NCCCCNc2c3CCCCc3nc3cc(Cl)ccc23)c1 InChI=1S/C37H38ClN3O7/c1-44-32-20-31-34(37(46-3)36(32)45-2)29(42)19-30(48-31)22-9-8-10-24(17-22)47-21-33(43)39-15-6-7-16-40-35-25-11-4-5-12-27(25)41-28-18-23(38)13-14-26(28)35/h8-10,13-14,17-20H,4-7,11-12,15-16,21H2,1-3H3,(H,39,43)(H,40,41) NYWLZADYCPAMIA-UHFFFAOYSA-N 50065378 CHEMBL3403876 Cholinesterase 1021 ChEMBL 10.1016/j.bmcl.2015.02.015 10.7270/Q29G5PGP 25724825 Liao, S; Deng, H; Huang, S; Yang, J; Wang, S; Yin, B; Zheng, T; Zhang, D; Liu, J; Gao, G; Ma, J; Deng, Z Wenzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50065378 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50065378&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118730045 103960310 CHEMBL3403876 ZINC36330328 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50301543 COc1cc2oc(cc(=O)c2c(OC)c1OC)-c1cccc(OCC(=O)NCCCCCNc2c3CCCCc3nc3cc(Cl)ccc23)c1 InChI=1S/C38H40ClN3O7/c1-45-33-21-32-35(38(47-3)37(33)46-2)30(43)20-31(49-32)23-10-9-11-25(18-23)48-22-34(44)40-16-7-4-8-17-41-36-26-12-5-6-13-28(26)42-29-19-24(39)14-15-27(29)36/h9-11,14-15,18-21H,4-8,12-13,16-17,22H2,1-3H3,(H,40,44)(H,41,42) PTARNCBWLXCSJW-UHFFFAOYSA-N 50065354 CHEMBL3403877 Cholinesterase 291 ChEMBL 10.1016/j.bmcl.2015.02.015 10.7270/Q29G5PGP 25724825 Liao, S; Deng, H; Huang, S; Yang, J; Wang, S; Yin, B; Zheng, T; Zhang, D; Liu, J; Gao, G; Ma, J; Deng, Z Wenzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50065354 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50065354&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118730046 103960287 CHEMBL3403877 ZINC26577542 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50301544 COc1cc2oc(cc(=O)c2c(OC)c1OC)-c1cccc(OCC(=O)NCCCCCCNc2c3CCCCc3nc3cc(Cl)ccc23)c1 InChI=1S/C39H42ClN3O7/c1-46-34-22-33-36(39(48-3)38(34)47-2)31(44)21-32(50-33)24-11-10-12-26(19-24)49-23-35(45)41-17-8-4-5-9-18-42-37-27-13-6-7-14-29(27)43-30-20-25(40)15-16-28(30)37/h10-12,15-16,19-22H,4-9,13-14,17-18,23H2,1-3H3,(H,41,45)(H,42,43) FADJQYHZGWQLHV-UHFFFAOYSA-N 50065332 CHEMBL3403878 Cholinesterase 969 ChEMBL 10.1016/j.bmcl.2015.02.015 10.7270/Q29G5PGP 25724825 Liao, S; Deng, H; Huang, S; Yang, J; Wang, S; Yin, B; Zheng, T; Zhang, D; Liu, J; Gao, G; Ma, J; Deng, Z Wenzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50065332 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50065332&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118730047 313071381 CHEMBL3403878 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50301545 COc1cc2oc(cc(=O)c2c(OC)c1OC)-c1ccc(O)cc1 InChI=1S/C18H16O6/c1-21-15-9-14-16(18(23-3)17(15)22-2)12(20)8-13(24-14)10-4-6-11(19)7-5-10/h4-9,19H,1-3H3 PJRWXHDCKWSIRU-UHFFFAOYSA-N 50064136 CHEBI:79510::CHEMBL74490::NSC-53906 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2015.02.015 10.7270/Q29G5PGP 25724825 Liao, S; Deng, H; Huang, S; Yang, J; Wang, S; Yin, B; Zheng, T; Zhang, D; Liu, J; Gao, G; Ma, J; Deng, Z Wenzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50064136 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50064136&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 243759 103959236 67357 CHEMBL74490 C14986 ZINC95803508 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50301546 COc1cc2oc(cc(=O)c2c(OC)c1OC)-c1cccc(O)c1 InChI=1S/C18H16O6/c1-21-15-9-14-16(18(23-3)17(15)22-2)12(20)8-13(24-14)10-5-4-6-11(19)7-10/h4-9,19H,1-3H3 XJRUMVMLCXYKTP-UHFFFAOYSA-N 50064137 CHEMBL3401031 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2015.02.015 10.7270/Q29G5PGP 25724825 Liao, S; Deng, H; Huang, S; Yang, J; Wang, S; Yin, B; Zheng, T; Zhang, D; Liu, J; Gao, G; Ma, J; Deng, Z Wenzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50064137 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50064137&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10471696 313071222 CHEMBL3401031 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50301547 Nc1c2CCCCc2nc2cc(Cl)ccc12 InChI=1S/C13H13ClN2/c14-8-5-6-10-12(7-8)16-11-4-2-1-3-9(11)13(10)15/h5-7H,1-4H2,(H2,15,16) GQZMDBQRGRRPMS-UHFFFAOYSA-N 8987 6-chloro-1,2,3,4-tetrahydroacridin-9-amine::6-chlorotacrine::6-chlorotacrine.HCl::CHEMBL486698::Tacrine Analogue 4 Cholinesterase 17 ChEMBL 10.1016/j.bmcl.2015.02.015 10.7270/Q29G5PGP 25724825 Liao, S; Deng, H; Huang, S; Yang, J; Wang, S; Yin, B; Zheng, T; Zhang, D; Liu, J; Gao, G; Ma, J; Deng, Z Wenzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8987 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8987&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10399068 46509202 CHEMBL486698 ZINC00005689 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50305978 Clc1cccc(CN2CCC(CC2)NCCCCCCN2C(=O)c3ccccc3C2=O)c1 InChI=1S/C26H32ClN3O2/c27-21-9-7-8-20(18-21)19-29-16-12-22(13-17-29)28-14-5-1-2-6-15-30-25(31)23-10-3-4-11-24(23)26(30)32/h3-4,7-11,18,22,28H,1-2,5-6,12-17,19H2 WLECTSFFDYHRGT-UHFFFAOYSA-N 50068288 CHEMBL3402295 Cholinesterase 2730 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068288 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068288&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729050 103962558 CHEMBL3402295 ZINC27547790 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50305980 Clc1cccc(CN2CCC(CC2)NCCCN2C(=O)c3ccccc3C2=O)c1 InChI=1S/C23H26ClN3O2/c24-18-6-3-5-17(15-18)16-26-13-9-19(10-14-26)25-11-4-12-27-22(28)20-7-1-2-8-21(20)23(27)29/h1-3,5-8,15,19,25H,4,9-14,16H2 KUBIZMMWMILEGF-UHFFFAOYSA-N 50068289 CHEMBL3402294 Cholinesterase 4530 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068289 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068289&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729049 103962559 CHEMBL3402294 ZINC13782133 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50305981 Fc1ccccc1CN1CCC(CC1)NCCCCCCCCN1C(=O)c2ccccc2C1=O InChI=1S/C28H36FN3O2/c29-26-14-8-5-11-22(26)21-31-19-15-23(16-20-31)30-17-9-3-1-2-4-10-18-32-27(33)24-12-6-7-13-25(24)28(32)34/h5-8,11-14,23,30H,1-4,9-10,15-21H2 LPUHGKXTOHAWQT-UHFFFAOYSA-N 50068290 CHEMBL3402293 Cholinesterase 1870 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068290 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068290&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729048 103962560 CHEMBL3402293 ZINC27549387 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50305982 Fc1ccccc1CN1CCC(CC1)NCCCCCCN1C(=O)c2ccccc2C1=O InChI=1S/C26H32FN3O2/c27-24-12-6-3-9-20(24)19-29-17-13-21(14-18-29)28-15-7-1-2-8-16-30-25(31)22-10-4-5-11-23(22)26(30)32/h3-6,9-12,21,28H,1-2,7-8,13-19H2 ITVZKRSKOYVPEM-UHFFFAOYSA-N 50068291 CHEMBL3402292 Cholinesterase 4000 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068291 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068291&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729047 103962561 CHEMBL3402292 ZINC13782124 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50305983 Fc1ccccc1CN1CCC(CC1)NCCCN1C(=O)c2ccccc2C1=O InChI=1S/C23H26FN3O2/c24-21-9-4-1-6-17(21)16-26-14-10-18(11-15-26)25-12-5-13-27-22(28)19-7-2-3-8-20(19)23(27)29/h1-4,6-9,18,25H,5,10-16H2 PCAWBSTVWSSTOC-UHFFFAOYSA-N 50068292 CHEMBL3402291 Cholinesterase 10520 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068292 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068292&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729046 103962562 CHEMBL3402291 ZINC13782121 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50305984 O=C1N(CCCCCCCCNC2CCN(Cc3ccccc3)CC2)C(=O)c2ccccc12 InChI=1S/C28H37N3O2/c32-27-25-14-8-9-15-26(25)28(33)31(27)19-11-4-2-1-3-10-18-29-24-16-20-30(21-17-24)22-23-12-6-5-7-13-23/h5-9,12-15,24,29H,1-4,10-11,16-22H2 BHKIRWHWXZUESZ-UHFFFAOYSA-N 50068293 CHEMBL3400171 Cholinesterase 1980 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068293 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068293&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729045 103962563 CHEMBL3400171 ZINC13782138 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50305985 O=C1N(CCCCCCNC2CCN(Cc3ccccc3)CC2)C(=O)c2ccccc12 InChI=1S/C26H33N3O2/c30-25-23-12-6-7-13-24(23)26(31)29(25)17-9-2-1-8-16-27-22-14-18-28(19-15-22)20-21-10-4-3-5-11-21/h3-7,10-13,22,27H,1-2,8-9,14-20H2 IPLRZZABEVUDRB-UHFFFAOYSA-N 50068294 CHEMBL3402290 Cholinesterase 12850 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068294 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068294&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729044 103962564 CHEMBL3402290 ZINC27550204 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50305986 O=C1N(CCCNC2CCN(Cc3ccccc3)CC2)C(=O)c2ccccc12 InChI=1S/C23H27N3O2/c27-22-20-9-4-5-10-21(20)23(28)26(22)14-6-13-24-19-11-15-25(16-12-19)17-18-7-2-1-3-8-18/h1-5,7-10,19,24H,6,11-17H2 JUIGHVDBLCBOOZ-UHFFFAOYSA-N 50068295 CHEMBL3402288 Cholinesterase 51800 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068295 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068295&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729042 103962565 CHEMBL3402288 ZINC13782129 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50306021 Oc1ccc(CN2CCC(CC2)NCCCCCCCCn2ccc3ccccc23)cc1 InChI=1S/C28H39N3O/c32-27-13-11-24(12-14-27)23-30-20-16-26(17-21-30)29-18-7-3-1-2-4-8-19-31-22-15-25-9-5-6-10-28(25)31/h5-6,9-15,22,26,29,32H,1-4,7-8,16-21,23H2 CTHQAQXTQVMTHO-UHFFFAOYSA-N 50068342 CHEMBL3402312 Cholinesterase 1330 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068342 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068342&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729066 313072027 CHEMBL3402312 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50306022 COc1ccc(CN2CCC(CC2)NCCCCCCn2ccc3ccccc23)cc1 InChI=1S/C27H37N3O/c1-31-26-12-10-23(11-13-26)22-29-19-15-25(16-20-29)28-17-6-2-3-7-18-30-21-14-24-8-4-5-9-27(24)30/h4-5,8-14,21,25,28H,2-3,6-7,15-20,22H2,1H3 DSSKSXWTFVEWSX-UHFFFAOYSA-N 50068344 CHEMBL3402313 Cholinesterase 520 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068344 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068344&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729067 313072028 CHEMBL3402313 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50306023 COc1ccc(CN2CCC(CC2)NCCCCCCCCn2ccc3ccccc23)cc1 InChI=1S/C29H41N3O/c1-33-28-14-12-25(13-15-28)24-31-21-17-27(18-22-31)30-19-8-4-2-3-5-9-20-32-23-16-26-10-6-7-11-29(26)32/h6-7,10-16,23,27,30H,2-5,8-9,17-22,24H2,1H3 CINIBMUXJKWCTM-UHFFFAOYSA-N 50068345 CHEMBL3402314 Cholinesterase 340 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068345 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068345&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729068 313072029 CHEMBL3402314 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50306024 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 8130 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50306025 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 4460 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50306026 COc1ccc(CN2CCC(CC2)NCCCCCCN2C(=O)c3ccccc3C2=O)cc1 InChI=1S/C27H35N3O3/c1-33-23-12-10-21(11-13-23)20-29-18-14-22(15-19-29)28-16-6-2-3-7-17-30-26(31)24-8-4-5-9-25(24)27(30)32/h4-5,8-13,22,28H,2-3,6-7,14-20H2,1H3 RSLDIQFSTJRHCO-UHFFFAOYSA-N 50068346 CHEMBL3402301 Cholinesterase 7390 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068346 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068346&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729055 313072030 CHEMBL3402301 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50306027 COc1ccc(CN2CCC(CC2)NCCCN2C(=O)c3ccccc3C2=O)cc1 InChI=1S/C24H29N3O3/c1-30-20-9-7-18(8-10-20)17-26-15-11-19(12-16-26)25-13-4-14-27-23(28)21-5-2-3-6-22(21)24(27)29/h2-3,5-10,19,25H,4,11-17H2,1H3 PKTCEZVBXVNNHH-UHFFFAOYSA-N 50068347 CHEMBL3402300 Cholinesterase 26800 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068347 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068347&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729054 313072031 CHEMBL3402300 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50306028 Oc1ccc(CN2CCC(CC2)NCCCCCCCCN2C(=O)c3ccccc3C2=O)cc1 InChI=1S/C28H37N3O3/c32-24-13-11-22(12-14-24)21-30-19-15-23(16-20-30)29-17-7-3-1-2-4-8-18-31-27(33)25-9-5-6-10-26(25)28(31)34/h5-6,9-14,23,29,32H,1-4,7-8,15-21H2 JCIZQGGVQLJNSL-UHFFFAOYSA-N 50068334 CHEMBL3402299 Cholinesterase 810 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068334 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068334&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729053 313072023 CHEMBL3402299 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50306029 Oc1ccc(CN2CCC(CC2)NCCCCCCN2C(=O)c3ccccc3C2=O)cc1 InChI=1S/C26H33N3O3/c30-22-11-9-20(10-12-22)19-28-17-13-21(14-18-28)27-15-5-1-2-6-16-29-25(31)23-7-3-4-8-24(23)26(29)32/h3-4,7-12,21,27,30H,1-2,5-6,13-19H2 HJXILFWTTCAHNL-UHFFFAOYSA-N 50068338 CHEMBL3402298 Cholinesterase 2320 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068338 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068338&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729052 313072024 CHEMBL3402298 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50306030 Oc1ccc(CN2CCC(CC2)NCCCN2C(=O)c3ccccc3C2=O)cc1 InChI=1S/C23H27N3O3/c27-19-8-6-17(7-9-19)16-25-14-10-18(11-15-25)24-12-3-13-26-22(28)20-4-1-2-5-21(20)23(26)29/h1-2,4-9,18,24,27H,3,10-16H2 DNYWYCCLRXNZRJ-UHFFFAOYSA-N 50068339 CHEMBL3402297 Cholinesterase 9370 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068339 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068339&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729051 313072025 CHEMBL3402297 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50306031 Clc1cccc(CN2CCC(CC2)NCCCCCCCCN2C(=O)c3ccccc3C2=O)c1 InChI=1S/C28H36ClN3O2/c29-23-11-9-10-22(20-23)21-31-18-14-24(15-19-31)30-16-7-3-1-2-4-8-17-32-27(33)25-12-5-6-13-26(25)28(32)34/h5-6,9-13,20,24,30H,1-4,7-8,14-19,21H2 GHBHHSZWICSFCD-UHFFFAOYSA-N 50068348 CHEMBL3402296 Cholinesterase 720 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068348 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068348&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 85468770 313072032 CHEMBL3402296 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50306032 Oc1ccc(CN2CCC(CC2)NCCCCCCn2ccc3ccccc23)cc1 InChI=1S/C26H35N3O/c30-25-11-9-22(10-12-25)21-28-18-14-24(15-19-28)27-16-5-1-2-6-17-29-20-13-23-7-3-4-8-26(23)29/h3-4,7-13,20,24,27,30H,1-2,5-6,14-19,21H2 ARYOIHAPPNVHGP-UHFFFAOYSA-N 50068349 CHEMBL3402311 Cholinesterase 1780 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068349 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068349&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729065 313072033 CHEMBL3402311 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50306033 Clc1cccc(CN2CCC(CC2)NCCCCCCCCn2ccc3ccccc23)c1 InChI=1S/C28H38ClN3/c29-26-12-9-10-24(22-26)23-31-19-15-27(16-20-31)30-17-7-3-1-2-4-8-18-32-21-14-25-11-5-6-13-28(25)32/h5-6,9-14,21-22,27,30H,1-4,7-8,15-20,23H2 FEZSAHGZTGVKNU-UHFFFAOYSA-N 50068296 CHEMBL3402310 Cholinesterase 750 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068296 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068296&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729064 103962566 CHEMBL3402310 ZINC13782134 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50306034 Clc1cccc(CN2CCC(CC2)NCCCCCCn2ccc3ccccc23)c1 InChI=1S/C26H34ClN3/c27-24-10-7-8-22(20-24)21-29-17-13-25(14-18-29)28-15-5-1-2-6-16-30-19-12-23-9-3-4-11-26(23)30/h3-4,7-12,19-20,25,28H,1-2,5-6,13-18,21H2 SZEUNMXCEYPGMI-UHFFFAOYSA-N 50068297 CHEMBL3402309 Cholinesterase 830 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068297 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068297&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729063 103962567 CHEMBL3402309 ZINC13782128 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50306035 Fc1ccccc1CN1CCC(CC1)NCCCCCCCCn1ccc2ccccc12 InChI=1S/C28H38FN3/c29-27-13-7-5-12-25(27)23-31-20-16-26(17-21-31)30-18-9-3-1-2-4-10-19-32-22-15-24-11-6-8-14-28(24)32/h5-8,11-15,22,26,30H,1-4,9-10,16-21,23H2 NUEJCXRCGLPRBU-UHFFFAOYSA-N 50068299 CHEMBL3402308 Cholinesterase 930 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068299 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068299&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729062 103962569 CHEMBL3402308 ZINC27547838 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50306038 Fc1ccccc1CN1CCC(CC1)NCCCCCCn1ccc2ccccc12 InChI=1S/C26H34FN3/c27-25-11-5-3-10-23(25)21-29-18-14-24(15-19-29)28-16-7-1-2-8-17-30-20-13-22-9-4-6-12-26(22)30/h3-6,9-13,20,24,28H,1-2,7-8,14-19,21H2 ISEKSDTZKHMDQP-UHFFFAOYSA-N 50068300 CHEMBL3402307 Cholinesterase 3410 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068300 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068300&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729061 103962570 CHEMBL3402307 ZINC13782132 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50306041 C(CCCCn1ccc2ccccc12)CCCNC1CCN(Cc2ccccc2)CC1 InChI=1S/C28H39N3/c1(2-4-11-20-31-23-16-26-14-8-9-15-28(26)31)3-10-19-29-27-17-21-30(22-18-27)24-25-12-6-5-7-13-25/h5-9,12-16,23,27,29H,1-4,10-11,17-22,24H2 YCTJTIRKQYGPIX-UHFFFAOYSA-N 50068301 CHEMBL3402306 Cholinesterase 1080 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068301 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068301&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729060 103962571 CHEMBL3402306 ZINC13782125 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50306045 C(CCCn1ccc2ccccc12)CCNC1CCN(Cc2ccccc2)CC1 InChI=1S/C26H35N3/c1(2-9-18-29-21-14-24-12-6-7-13-26(24)29)8-17-27-25-15-19-28(20-16-25)22-23-10-4-3-5-11-23/h3-7,10-14,21,25,27H,1-2,8-9,15-20,22H2 QUBQVMGEJKDABO-UHFFFAOYSA-N 50068302 CHEMBL3402305 Cholinesterase 15300 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068302 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068302&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729059 103962572 CHEMBL3402305 ZINC13782136 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50306052 C(CCNC1CCN(Cc2ccccc2)CC1)CCn1ccc2ccccc12 InChI=1S/C25H33N3/c1-3-9-22(10-4-1)21-27-18-14-24(15-19-27)26-16-7-2-8-17-28-20-13-23-11-5-6-12-25(23)28/h1,3-6,9-13,20,24,26H,2,7-8,14-19,21H2 IVHLTIDBEQJESR-UHFFFAOYSA-N 50068306 CHEMBL3402304 Cholinesterase 1830 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068306 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068306&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729058 313072021 CHEMBL3402304 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50306053 C(CNC1CCN(Cc2ccccc2)CC1)Cn1ccc2ccccc12 InChI=1S/C23H29N3/c1-2-7-20(8-3-1)19-25-16-12-22(13-17-25)24-14-6-15-26-18-11-21-9-4-5-10-23(21)26/h1-5,7-11,18,22,24H,6,12-17,19H2 WTLUCPJUIZKXNV-UHFFFAOYSA-N 50068350 CHEMBL3402303 Cholinesterase 2.0 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068350 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068350&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729057 313072034 CHEMBL3402303 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50306054 COc1ccc(CN2CCC(CC2)NCCCCCCCCN2C(=O)c3ccccc3C2=O)cc1 InChI=1S/C29H39N3O3/c1-35-25-14-12-23(13-15-25)22-31-20-16-24(17-21-31)30-18-8-4-2-3-5-9-19-32-28(33)26-10-6-7-11-27(26)29(32)34/h6-7,10-15,24,30H,2-5,8-9,16-22H2,1H3 XGSVNQWVLYUGCM-UHFFFAOYSA-N 50068319 CHEMBL3402302 Cholinesterase 5650 ChEMBL 10.1016/j.bmc.2015.03.051 10.7270/Q2CZ38VB 25868744 Wieckowska, A; Wieckowski, K; Bajda, M; Brus, B; Salat, K; Czerwinska, P; Gobec, S; Filipek, B; Malawska, B Jagiellonian University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50068319 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50068319&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729056 313072022 CHEMBL3402302 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296561 COc1cc(CNCCN2CCC(Cc3ccccc3)CC2)cc(OC)c1OC InChI=1S/C24H34N2O3/c1-27-22-16-21(17-23(28-2)24(22)29-3)18-25-11-14-26-12-9-20(10-13-26)15-19-7-5-4-6-8-19/h4-8,16-17,20,25H,9-15,18H2,1-3H3 GZGXHVNIGFUOQL-UHFFFAOYSA-N 50062924 CHEMBL3397872 Cholinesterase 53 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062924 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062924&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727064 313070843 CHEMBL3397872 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296562 COc1cc(CNCCCN2CCC(Cc3ccccc3)CC2)cc(OC)c1OC InChI=1S/C25H36N2O3/c1-28-23-17-22(18-24(29-2)25(23)30-3)19-26-12-7-13-27-14-10-21(11-15-27)16-20-8-5-4-6-9-20/h4-6,8-9,17-18,21,26H,7,10-16,19H2,1-3H3 FUKQGROBAPBARO-UHFFFAOYSA-N 50062926 CHEMBL3397873 Cholinesterase 23 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062926 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062926&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727065 313070844 CHEMBL3397873 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296563 COc1cc(CNCCCCN2CCC(Cc3ccccc3)CC2)cc(OC)c1OC InChI=1S/C26H38N2O3/c1-29-24-18-23(19-25(30-2)26(24)31-3)20-27-13-7-8-14-28-15-11-22(12-16-28)17-21-9-5-4-6-10-21/h4-6,9-10,18-19,22,27H,7-8,11-17,20H2,1-3H3 YOORCNHQMNRHDQ-UHFFFAOYSA-N 50062927 CHEMBL3397874 Cholinesterase 17 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062927 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062927&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727066 313070845 CHEMBL3397874 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296565 COc1ccc(CNCCN2CCC(Cc3ccccc3)CC2)cc1OC InChI=1S/C23H32N2O2/c1-26-22-9-8-21(17-23(22)27-2)18-24-12-15-25-13-10-20(11-14-25)16-19-6-4-3-5-7-19/h3-9,17,20,24H,10-16,18H2,1-2H3 XOPJZLZGIBSYMY-UHFFFAOYSA-N 50062928 CHEMBL3397875 Cholinesterase 78 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062928 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062928&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727067 313070846 CHEMBL3397875 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296568 COc1ccc(CNCCCN2CCC(Cc3ccccc3)CC2)cc1OC InChI=1S/C24H34N2O2/c1-27-23-10-9-22(18-24(23)28-2)19-25-13-6-14-26-15-11-21(12-16-26)17-20-7-4-3-5-8-20/h3-5,7-10,18,21,25H,6,11-17,19H2,1-2H3 YIGNCFUWSRKQQO-UHFFFAOYSA-N 50062929 CHEMBL3397054 Cholinesterase 190 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062929 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062929&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727068 313070847 CHEMBL3397054 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296594 COc1ccc(CNCCCCN2CCC(Cc3ccccc3)CC2)cc1OC InChI=1S/C25H36N2O2/c1-28-24-11-10-23(19-25(24)29-2)20-26-14-6-7-15-27-16-12-22(13-17-27)18-21-8-4-3-5-9-21/h3-5,8-11,19,22,26H,6-7,12-18,20H2,1-2H3 MZAVKGDSSQMEGG-UHFFFAOYSA-N 50062935 CHEMBL3397876 Cholinesterase 49 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062935 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062935&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727069 313070852 CHEMBL3397876 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296595 COc1cc(CNCCN2CCC(Cc3ccccc3)CC2)ccc1O InChI=1S/C22H30N2O2/c1-26-22-16-20(7-8-21(22)25)17-23-11-14-24-12-9-19(10-13-24)15-18-5-3-2-4-6-18/h2-8,16,19,23,25H,9-15,17H2,1H3 LPFRMUJEZJZSTA-UHFFFAOYSA-N 50062934 CHEMBL3397877 Cholinesterase 4.2 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062934 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062934&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727070 313070851 CHEMBL3397877 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296598 COc1cc(CNCCCN2CCC(Cc3ccccc3)CC2)ccc1O InChI=1S/C23H32N2O2/c1-27-23-17-21(8-9-22(23)26)18-24-12-5-13-25-14-10-20(11-15-25)16-19-6-3-2-4-7-19/h2-4,6-9,17,20,24,26H,5,10-16,18H2,1H3 OHQYAUCGQQKTST-UHFFFAOYSA-N 50062932 CHEMBL3397878 Cholinesterase 7.6 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062932 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062932&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727071 313070850 CHEMBL3397878 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296599 COc1cc(CNCCCCN2CCC(Cc3ccccc3)CC2)ccc1O InChI=1S/C24H34N2O2/c1-28-24-18-22(9-10-23(24)27)19-25-13-5-6-14-26-15-11-21(12-16-26)17-20-7-3-2-4-8-20/h2-4,7-10,18,21,25,27H,5-6,11-17,19H2,1H3 RYPUHFMWTFTCBW-UHFFFAOYSA-N 50062931 CHEMBL3397879 Cholinesterase 3.9 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062931 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062931&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727072 313070849 CHEMBL3397879 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296601 C(CN1CCC(Cc2ccccc2)CC1)NCc1cccnc1 InChI=1S/C20H27N3/c1-2-5-18(6-3-1)15-19-8-12-23(13-9-19)14-11-22-17-20-7-4-10-21-16-20/h1-7,10,16,19,22H,8-9,11-15,17H2 LYFDSSBMWRKDAF-UHFFFAOYSA-N 50062930 CHEMBL3397880 Cholinesterase 101 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062930 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062930&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727073 313070848 CHEMBL3397880 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296603 C(CNCc1cccnc1)CN1CCC(Cc2ccccc2)CC1 InChI=1S/C21H29N3/c1-2-6-19(7-3-1)16-20-9-14-24(15-10-20)13-5-12-23-18-21-8-4-11-22-17-21/h1-4,6-8,11,17,20,23H,5,9-10,12-16,18H2 CYQPFLVAVHFJMK-UHFFFAOYSA-N 50062831 CHEMBL3397881 Cholinesterase 82 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062831 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062831&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 22676613 313070821 CHEMBL3397881 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296608 C(CCN1CCC(Cc2ccccc2)CC1)CNCc1cccnc1 InChI=1S/C22H31N3/c1-2-7-20(8-3-1)17-21-10-15-25(16-11-21)14-5-4-12-23-18-22-9-6-13-24-19-22/h1-3,6-9,13,19,21,23H,4-5,10-12,14-18H2 ZLBMXPTWYHDMQZ-UHFFFAOYSA-N 50062832 CHEMBL3397882 Cholinesterase 34 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062832 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062832&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727074 313070822 CHEMBL3397882 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296609 COc1cc(CNCCN2CCN(Cc3ccccc3)CC2)cc(OC)c1OC InChI=1S/C23H33N3O3/c1-27-21-15-20(16-22(28-2)23(21)29-3)17-24-9-10-25-11-13-26(14-12-25)18-19-7-5-4-6-8-19/h4-8,15-16,24H,9-14,17-18H2,1-3H3 LDXKONPNYPZIOS-UHFFFAOYSA-N 50062833 CHEMBL3397883 Cholinesterase 75 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062833 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062833&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727075 313070823 CHEMBL3397883 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296610 COc1cc(CNCCCN2CCN(Cc3ccccc3)CC2)cc(OC)c1OC InChI=1S/C24H35N3O3/c1-28-22-16-21(17-23(29-2)24(22)30-3)18-25-10-7-11-26-12-14-27(15-13-26)19-20-8-5-4-6-9-20/h4-6,8-9,16-17,25H,7,10-15,18-19H2,1-3H3 WBKHJLODCOJLLW-UHFFFAOYSA-N 50062834 CHEMBL3397884 Cholinesterase 42 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062834 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062834&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727076 313070824 CHEMBL3397884 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296613 COc1cc(CNCCCCN2CCN(Cc3ccccc3)CC2)cc(OC)c1OC InChI=1S/C25H37N3O3/c1-29-23-17-22(18-24(30-2)25(23)31-3)19-26-11-7-8-12-27-13-15-28(16-14-27)20-21-9-5-4-6-10-21/h4-6,9-10,17-18,26H,7-8,11-16,19-20H2,1-3H3 QXYZKJMGHWZKST-UHFFFAOYSA-N 50062835 CHEMBL3397885 Cholinesterase 33 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062835 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062835&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727077 313070825 CHEMBL3397885 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296615 COc1ccc(CNCCN2CCN(Cc3ccccc3)CC2)cc1OC InChI=1S/C22H31N3O2/c1-26-21-9-8-20(16-22(21)27-2)17-23-10-11-24-12-14-25(15-13-24)18-19-6-4-3-5-7-19/h3-9,16,23H,10-15,17-18H2,1-2H3 JSQVVVUPJGZFME-UHFFFAOYSA-N 50062836 CHEMBL3397886 Cholinesterase 274 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062836 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062836&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727078 313070826 CHEMBL3397886 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296616 COc1ccc(CNCCCN2CCN(Cc3ccccc3)CC2)cc1OC InChI=1S/C23H33N3O2/c1-27-22-10-9-21(17-23(22)28-2)18-24-11-6-12-25-13-15-26(16-14-25)19-20-7-4-3-5-8-20/h3-5,7-10,17,24H,6,11-16,18-19H2,1-2H3 DLHUNBURFRYDHH-UHFFFAOYSA-N 50062837 CHEMBL3397887 Cholinesterase 331 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062837 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062837&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727079 313070827 CHEMBL3397887 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296617 COc1ccc(CNCCCCN2CCN(Cc3ccccc3)CC2)cc1OC InChI=1S/C24H35N3O2/c1-28-23-11-10-22(18-24(23)29-2)19-25-12-6-7-13-26-14-16-27(17-15-26)20-21-8-4-3-5-9-21/h3-5,8-11,18,25H,6-7,12-17,19-20H2,1-2H3 DYKJJWRPCDXUAO-UHFFFAOYSA-N 50062838 CHEMBL3397888 Cholinesterase 142 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062838 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062838&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727080 313070828 CHEMBL3397888 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296618 COc1cc(CNCCN2CCN(Cc3ccccc3)CC2)ccc1O InChI=1S/C21H29N3O2/c1-26-21-15-19(7-8-20(21)25)16-22-9-10-23-11-13-24(14-12-23)17-18-5-3-2-4-6-18/h2-8,15,22,25H,9-14,16-17H2,1H3 FQDQKWAIZXUMPN-UHFFFAOYSA-N 50062839 CHEMBL3397889 Cholinesterase 18 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062839 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062839&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727081 313070829 CHEMBL3397889 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296625 COc1cc(CNCCCN2CCN(Cc3ccccc3)CC2)ccc1O InChI=1S/C22H31N3O2/c1-27-22-16-20(8-9-21(22)26)17-23-10-5-11-24-12-14-25(15-13-24)18-19-6-3-2-4-7-19/h2-4,6-9,16,23,26H,5,10-15,17-18H2,1H3 ZWTDIOBSVNMFTJ-UHFFFAOYSA-N 50062840 CHEMBL3397890 Cholinesterase 19 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062840 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062840&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727082 313070830 CHEMBL3397890 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296626 COc1cc(CNCCCCN2CCN(Cc3ccccc3)CC2)ccc1O InChI=1S/C23H33N3O2/c1-28-23-17-21(9-10-22(23)27)18-24-11-5-6-12-25-13-15-26(16-14-25)19-20-7-3-2-4-8-20/h2-4,7-10,17,24,27H,5-6,11-16,18-19H2,1H3 JSTOJTBNCIRTCM-UHFFFAOYSA-N 50062841 CHEMBL3397894 Cholinesterase 14 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062841 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062841&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727086 313070831 CHEMBL3397894 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296630 C(CN1CCN(Cc2ccccc2)CC1)NCc1cccnc1 InChI=1S/C19H26N4/c1-2-5-18(6-3-1)17-23-13-11-22(12-14-23)10-9-21-16-19-7-4-8-20-15-19/h1-8,15,21H,9-14,16-17H2 NRWKYXOLVHWDFT-UHFFFAOYSA-N 50062842 CHEMBL3397893 Cholinesterase 129 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062842 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062842&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727085 313070832 CHEMBL3397893 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296635 C(CNCc1cccnc1)CN1CCN(Cc2ccccc2)CC1 InChI=1S/C20H28N4/c1-2-6-19(7-3-1)18-24-14-12-23(13-15-24)11-5-10-22-17-20-8-4-9-21-16-20/h1-4,6-9,16,22H,5,10-15,17-18H2 PNPSNOWLDWVGCO-UHFFFAOYSA-N 50062843 CHEMBL3397891 Cholinesterase 209 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062843 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062843&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727083 313070833 CHEMBL3397891 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296639 C(CCN1CCN(Cc2ccccc2)CC1)CNCc1cccnc1 InChI=1S/C21H30N4/c1-2-7-20(8-3-1)19-25-15-13-24(14-16-25)12-5-4-10-22-17-21-9-6-11-23-18-21/h1-3,6-9,11,18,22H,4-5,10,12-17,19H2 ANHDBWBWWHIYNZ-UHFFFAOYSA-N 50062844 CHEMBL3397892 Cholinesterase 104 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062844 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062844&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727084 313070834 CHEMBL3397892 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296641 COc1cc(CNCCN2CCN(CC(c3ccccc3)c3ccccc3)CC2)cc(OC)c1OC InChI=1S/C30H39N3O3/c1-34-28-20-24(21-29(35-2)30(28)36-3)22-31-14-15-32-16-18-33(19-17-32)23-27(25-10-6-4-7-11-25)26-12-8-5-9-13-26/h4-13,20-21,27,31H,14-19,22-23H2,1-3H3 AMJVDNYNAVCRAH-UHFFFAOYSA-N 50062910 CHEMBL3397895 Cholinesterase 67 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062910 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062910&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727087 313045029 CHEMBL3397895 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296643 COc1cc(CNCCCN2CCN(CC(c3ccccc3)c3ccccc3)CC2)cc(OC)c1OC InChI=1S/C31H41N3O3/c1-35-29-21-25(22-30(36-2)31(29)37-3)23-32-15-10-16-33-17-19-34(20-18-33)24-28(26-11-6-4-7-12-26)27-13-8-5-9-14-27/h4-9,11-14,21-22,28,32H,10,15-20,23-24H2,1-3H3 HZRJARBNGRXUJE-UHFFFAOYSA-N 50062911 CHEMBL3397896 Cholinesterase 210 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062911 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062911&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727088 313045030 CHEMBL3397896 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296646 COc1cc(CNCCCCN2CCN(CC(c3ccccc3)c3ccccc3)CC2)cc(OC)c1OC InChI=1S/C32H43N3O3/c1-36-30-22-26(23-31(37-2)32(30)38-3)24-33-16-10-11-17-34-18-20-35(21-19-34)25-29(27-12-6-4-7-13-27)28-14-8-5-9-15-28/h4-9,12-15,22-23,29,33H,10-11,16-21,24-25H2,1-3H3 GLWPPAZJNWEESS-UHFFFAOYSA-N 50062913 CHEMBL3397897 Cholinesterase 83 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062913 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062913&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727089 313045031 CHEMBL3397897 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296647 COc1ccc(CNCCN2CCN(CC(c3ccccc3)c3ccccc3)CC2)cc1OC InChI=1S/C29H37N3O2/c1-33-28-14-13-24(21-29(28)34-2)22-30-15-16-31-17-19-32(20-18-31)23-27(25-9-5-3-6-10-25)26-11-7-4-8-12-26/h3-14,21,27,30H,15-20,22-23H2,1-2H3 LKXSPUNMWHCHGA-UHFFFAOYSA-N 50062914 CHEMBL3397898 Cholinesterase 275 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062914 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062914&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727090 313045032 CHEMBL3397898 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296648 COc1ccc(CNCCCN2CCN(CC(c3ccccc3)c3ccccc3)CC2)cc1OC InChI=1S/C30H39N3O2/c1-34-29-15-14-25(22-30(29)35-2)23-31-16-9-17-32-18-20-33(21-19-32)24-28(26-10-5-3-6-11-26)27-12-7-4-8-13-27/h3-8,10-15,22,28,31H,9,16-21,23-24H2,1-2H3 KKEANOFZLPUNFS-UHFFFAOYSA-N 50062916 CHEMBL3397899 Cholinesterase 18 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062916 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062916&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727091 313070835 CHEMBL3397899 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296649 COc1ccc(CNCCCCN2CCN(CC(c3ccccc3)c3ccccc3)CC2)cc1OC InChI=1S/C31H41N3O2/c1-35-30-16-15-26(23-31(30)36-2)24-32-17-9-10-18-33-19-21-34(22-20-33)25-29(27-11-5-3-6-12-27)28-13-7-4-8-14-28/h3-8,11-16,23,29,32H,9-10,17-22,24-25H2,1-2H3 GICFMZYANSOSTQ-UHFFFAOYSA-N 50062917 CHEMBL3397900 Cholinesterase 327 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062917 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062917&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727092 313070836 CHEMBL3397900 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296650 COc1cc(CNCCN2CCN(CC(c3ccccc3)c3ccccc3)CC2)ccc1O InChI=1S/C28H35N3O2/c1-33-28-20-23(12-13-27(28)32)21-29-14-15-30-16-18-31(19-17-30)22-26(24-8-4-2-5-9-24)25-10-6-3-7-11-25/h2-13,20,26,29,32H,14-19,21-22H2,1H3 SPPAIANETHKJJR-UHFFFAOYSA-N 50062918 CHEMBL3397901 Cholinesterase 86 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062918 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062918&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727093 313070837 CHEMBL3397901 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296651 COc1cc(CNCCCN2CCN(CC(c3ccccc3)c3ccccc3)CC2)ccc1O InChI=1S/C29H37N3O2/c1-34-29-21-24(13-14-28(29)33)22-30-15-8-16-31-17-19-32(20-18-31)23-27(25-9-4-2-5-10-25)26-11-6-3-7-12-26/h2-7,9-14,21,27,30,33H,8,15-20,22-23H2,1H3 SJDXEGQZULRZSG-UHFFFAOYSA-N 50062919 CHEMBL3397902 Cholinesterase 19 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062919 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062919&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727094 313070838 CHEMBL3397902 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296654 COc1cc(CNCCCCN2CCN(CC(c3ccccc3)c3ccccc3)CC2)ccc1O InChI=1S/C30H39N3O2/c1-35-30-22-25(14-15-29(30)34)23-31-16-8-9-17-32-18-20-33(21-19-32)24-28(26-10-4-2-5-11-26)27-12-6-3-7-13-27/h2-7,10-15,22,28,31,34H,8-9,16-21,23-24H2,1H3 ZQXAXSPALASPJA-UHFFFAOYSA-N 50062920 CHEMBL3397903 Cholinesterase 4.2 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062920 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062920&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727095 313070839 CHEMBL3397903 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296655 C(CN1CCN(CC(c2ccccc2)c2ccccc2)CC1)NCc1cccnc1 InChI=1S/C26H32N4/c1-3-9-24(10-4-1)26(25-11-5-2-6-12-25)22-30-18-16-29(17-19-30)15-14-28-21-23-8-7-13-27-20-23/h1-13,20,26,28H,14-19,21-22H2 QNBPDELLJBJFAS-UHFFFAOYSA-N 50062921 CHEMBL3397904 Cholinesterase 64 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062921 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062921&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727096 313070840 CHEMBL3397904 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296657 C(CNCc1cccnc1)CN1CCN(CC(c2ccccc2)c2ccccc2)CC1 InChI=1S/C27H34N4/c1-3-10-25(11-4-1)27(26-12-5-2-6-13-26)23-31-19-17-30(18-20-31)16-8-15-29-22-24-9-7-14-28-21-24/h1-7,9-14,21,27,29H,8,15-20,22-23H2 IQMUSOSXSKWCIX-UHFFFAOYSA-N 50062922 CHEMBL3397905 Cholinesterase 28 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062922 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062922&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727097 313070841 CHEMBL3397905 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296658 C(CCN1CCN(CC(c2ccccc2)c2ccccc2)CC1)CNCc1cccnc1 InChI=1S/C28H36N4/c1-3-11-26(12-4-1)28(27-13-5-2-6-14-27)24-32-20-18-31(19-21-32)17-8-7-15-29-22-25-10-9-16-30-23-25/h1-6,9-14,16,23,28-29H,7-8,15,17-22,24H2 JPYYXDCUWPMBRI-UHFFFAOYSA-N 50062923 CHEMBL3397906 Cholinesterase 81 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062923 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062923&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118727098 313070842 CHEMBL3397906 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50296659 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 1911 ChEMBL 10.1016/j.bmc.2014.12.057 10.7270/Q2DJ5H90 25624107 Meena, P; Nemaysh, V; Khatri, M; Manral, A; Luthra, PM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50301300 Cl.CN(CCCCCCCN1C(=O)c2ccccc2C1=O)Cc1ccccc1F InChI=1S/C23H27FN2O2.ClH/c1-25(17-18-11-5-8-14-21(18)24)15-9-3-2-4-10-16-26-22(27)19-12-6-7-13-20(19)23(26)28;/h5-8,11-14H,2-4,9-10,15-17H2,1H3;1H QCNWBOUREJBNJI-UHFFFAOYSA-N 50065053 CHEMBL3402714 Cholinesterase 7157 ChEMBL 10.1016/j.bmc.2015.01.045 10.7270/Q2PN979Q 25707322 Guzior, N; Bajda, M; Rakoczy, J; Brus, B; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50065053 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50065053&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729295 103960008 CHEMBL3402714 ZINC13779979 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50301301 Cl.CN(CCCCCCN1C(=O)c2ccccc2C1=O)Cc1ccccc1F InChI=1S/C22H25FN2O2.ClH/c1-24(16-17-10-4-7-13-20(17)23)14-8-2-3-9-15-25-21(26)18-11-5-6-12-19(18)22(25)27;/h4-7,10-13H,2-3,8-9,14-16H2,1H3;1H DUJNRMQGCRHZIP-UHFFFAOYSA-N 50065052 CHEMBL3402713 Cholinesterase 10460 ChEMBL 10.1016/j.bmc.2015.01.045 10.7270/Q2PN979Q 25707322 Guzior, N; Bajda, M; Rakoczy, J; Brus, B; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50065052 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50065052&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729293 103960007 CHEMBL3402713 ZINC13779972 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50301302 Cl.CN(CCCCCCCCN1C(=O)c2ccccc2C1=O)Cc1ccccc1 InChI=1S/C24H30N2O2.ClH/c1-25(19-20-13-7-6-8-14-20)17-11-4-2-3-5-12-18-26-23(27)21-15-9-10-16-22(21)24(26)28;/h6-10,13-16H,2-5,11-12,17-19H2,1H3;1H CIIRXWOHVIWRJD-UHFFFAOYSA-N 50065050 CHEMBL3402710 Cholinesterase 543 ChEMBL 10.1016/j.bmc.2015.01.045 10.7270/Q2PN979Q 25707322 Guzior, N; Bajda, M; Rakoczy, J; Brus, B; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50065050 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50065050&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729287 103960005 CHEMBL3402710 ZINC13779990 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50301303 Cl.CN(CCCCCCCN1C(=O)c2ccccc2C1=O)Cc1ccccc1 InChI=1S/C23H28N2O2.ClH/c1-24(18-19-12-6-5-7-13-19)16-10-3-2-4-11-17-25-22(26)20-14-8-9-15-21(20)23(25)27;/h5-9,12-15H,2-4,10-11,16-18H2,1H3;1H RUVISHZXAUOOOO-UHFFFAOYSA-N 50065049 CHEMBL3402709 Cholinesterase 1011 ChEMBL 10.1016/j.bmc.2015.01.045 10.7270/Q2PN979Q 25707322 Guzior, N; Bajda, M; Rakoczy, J; Brus, B; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50065049 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50065049&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729285 103960004 CHEMBL3402709 ZINC01544340 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50301323 Cl.CN(CCCCCCCCN1C(=O)c2ccccc2C1=O)Cc1ccccc1F InChI=1S/C24H29FN2O2.ClH/c1-26(18-19-12-6-9-15-22(19)25)16-10-4-2-3-5-11-17-27-23(28)20-13-7-8-14-21(20)24(27)29;/h6-9,12-15H,2-5,10-11,16-18H2,1H3;1H RTOUSXFIIKSLTN-UHFFFAOYSA-N 50065054 CHEMBL3402715 Cholinesterase 4678 ChEMBL 10.1016/j.bmc.2015.01.045 10.7270/Q2PN979Q 25707322 Guzior, N; Bajda, M; Rakoczy, J; Brus, B; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50065054 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50065054&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729297 103960009 CHEMBL3402715 ZINC13779980 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50301324 Cl.CN(CCCCCN1C(=O)c2ccccc2C1=O)Cc1cccc(Cl)c1 InChI=1S/C21H23ClN2O2.ClH/c1-23(15-16-8-7-9-17(22)14-16)12-5-2-6-13-24-20(25)18-10-3-4-11-19(18)21(24)26;/h3-4,7-11,14H,2,5-6,12-13,15H2,1H3;1H NPXDZOVIQVCIJS-UHFFFAOYSA-N 50065055 CHEMBL3402717 Cholinesterase 5826 ChEMBL 10.1016/j.bmc.2015.01.045 10.7270/Q2PN979Q 25707322 Guzior, N; Bajda, M; Rakoczy, J; Brus, B; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50065055 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50065055&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729300 103960010 CHEMBL3402717 ZINC13779977 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50301325 Cl.CN(CCCCCCN1C(=O)c2ccccc2C1=O)Cc1cccc(Cl)c1 InChI=1S/C22H25ClN2O2.ClH/c1-24(16-17-9-8-10-18(23)15-17)13-6-2-3-7-14-25-21(26)19-11-4-5-12-20(19)22(25)27;/h4-5,8-12,15H,2-3,6-7,13-14,16H2,1H3;1H CUSLOPYXRUYXIT-UHFFFAOYSA-N 50065056 CHEMBL3402718 Cholinesterase 2435 ChEMBL 10.1016/j.bmc.2015.01.045 10.7270/Q2PN979Q 25707322 Guzior, N; Bajda, M; Rakoczy, J; Brus, B; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50065056 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50065056&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729302 103960011 CHEMBL3402718 ZINC13779981 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50301326 Cl.CN(CCCCCCCN1C(=O)c2ccccc2C1=O)Cc1cccc(Cl)c1 InChI=1S/C23H27ClN2O2.ClH/c1-25(17-18-10-9-11-19(24)16-18)14-7-3-2-4-8-15-26-22(27)20-12-5-6-13-21(20)23(26)28;/h5-6,9-13,16H,2-4,7-8,14-15,17H2,1H3;1H PHWSEVOLBYBKTR-UHFFFAOYSA-N 50065059 CHEMBL3402719 Cholinesterase 1499 ChEMBL 10.1016/j.bmc.2015.01.045 10.7270/Q2PN979Q 25707322 Guzior, N; Bajda, M; Rakoczy, J; Brus, B; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50065059 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50065059&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729304 103960014 CHEMBL3402719 ZINC13779993 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50301327 Cl.CN(CCCCCCCCN1C(=O)c2ccccc2C1=O)Cc1cccc(Cl)c1 InChI=1S/C24H29ClN2O2.ClH/c1-26(18-19-11-10-12-20(25)17-19)15-8-4-2-3-5-9-16-27-23(28)21-13-6-7-14-22(21)24(27)29;/h6-7,10-14,17H,2-5,8-9,15-16,18H2,1H3;1H FXGIWLPZNBGQGB-UHFFFAOYSA-N 50065095 CHEMBL3402720 Cholinesterase 909 ChEMBL 10.1016/j.bmc.2015.01.045 10.7270/Q2PN979Q 25707322 Guzior, N; Bajda, M; Rakoczy, J; Brus, B; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50065095 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50065095&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729306 103960050 29067 CHEMBL3402720 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50301328 O=C1N(Cc2ccc(CNCc3ccccc3)cc2)C(=O)c2ccccc12 InChI=1S/C23H20N2O2/c26-22-20-8-4-5-9-21(20)23(27)25(22)16-19-12-10-18(11-13-19)15-24-14-17-6-2-1-3-7-17/h1-13,24H,14-16H2 NHEZBIVNJZUHDE-UHFFFAOYSA-N 50065106 CHEMBL3402721 Cholinesterase 2080 ChEMBL 10.1016/j.bmc.2015.01.045 10.7270/Q2PN979Q 25707322 Guzior, N; Bajda, M; Rakoczy, J; Brus, B; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50065106 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50065106&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729309 313071365 CHEMBL3402721 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50301329 Fc1ccccc1CNCc1ccc(CN2C(=O)c3ccccc3C2=O)cc1 InChI=1S/C23H19FN2O2/c24-21-8-4-1-5-18(21)14-25-13-16-9-11-17(12-10-16)15-26-22(27)19-6-2-3-7-20(19)23(26)28/h1-12,25H,13-15H2 XSXLOXFMYPJYHQ-UHFFFAOYSA-N 50065102 CHEMBL3402722 Cholinesterase 2899 ChEMBL 10.1016/j.bmc.2015.01.045 10.7270/Q2PN979Q 25707322 Guzior, N; Bajda, M; Rakoczy, J; Brus, B; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50065102 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50065102&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729311 313071363 CHEMBL3402722 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50301330 Clc1cccc(CNCc2ccc(CN3C(=O)c4ccccc4C3=O)cc2)c1 InChI=1S/C23H19ClN2O2/c24-19-5-3-4-18(12-19)14-25-13-16-8-10-17(11-9-16)15-26-22(27)20-6-1-2-7-21(20)23(26)28/h1-12,25H,13-15H2 JCWAUUULZFUOCM-UHFFFAOYSA-N 50065101 CHEMBL3402723 Cholinesterase 1319 ChEMBL 10.1016/j.bmc.2015.01.045 10.7270/Q2PN979Q 25707322 Guzior, N; Bajda, M; Rakoczy, J; Brus, B; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50065101 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50065101&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118729313 313071362 CHEMBL3402723 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50301331 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 1830 ChEMBL 10.1016/j.bmc.2015.01.045 10.7270/Q2PN979Q 25707322 Guzior, N; Bajda, M; Rakoczy, J; Brus, B; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50301332 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 2.0 ChEMBL 10.1016/j.bmc.2015.01.045 10.7270/Q2PN979Q 25707322 Guzior, N; Bajda, M; Rakoczy, J; Brus, B; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325445 COc1cc(N)c(Cl)cc1C(=O)CCC1CCN(CC2CCCCC2)CC1 InChI=1S/C22H33ClN2O2/c1-27-22-14-20(24)19(23)13-18(22)21(26)8-7-16-9-11-25(12-10-16)15-17-5-3-2-4-6-17/h13-14,16-17H,2-12,15,24H2,1H3 FTRZTHFGTILUPE-UHFFFAOYSA-N 50079362 CHEMBL3417009::US9663465, 9 Cholinesterase 3530 ChEMBL 10.1021/acs.jmedchem.5b00115 10.7270/Q2HQ41MH 25793650 Rochais, C; Lecoutey, C; Gaven, F; Giannoni, P; Hamidouche, K; Hedou, D; Dubost, E; Genest, D; Yahiaoui, S; Freret, T; Bouet, V; Dauphin, F; Sopkova de Oliveira Santos, J; Ballandonne, C; Corvaisier, S; Malzert-Fréon, A; Legay, R; Boulouard, M; Claeysen, S; Dallemagne, P CERMN http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079362 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079362&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 86582973 313073953 CHEMBL3417009 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50327570 Cl.COc1ccc2C(=O)\C(COc2c1)=C\c1ccc(OCCN2CCCCC2)cc1 InChI=1S/C24H27NO4.ClH/c1-27-21-9-10-22-23(16-21)29-17-19(24(22)26)15-18-5-7-20(8-6-18)28-14-13-25-11-3-2-4-12-25;/h5-10,15-16H,2-4,11-14,17H2,1H3;1H/b19-15+; CIKJOHHHGOFZTL-QTCZRQAZSA-N 50080156 CHEMBL3416509 Cholinesterase 8200 ChEMBL 10.1016/j.ejmech.2015.04.055 10.7270/Q2P84DM4 25969170 Pourshojaei, Y; Gouranourimi, A; Hekmat, S; Asadipour, A; Rahmani-Nezhad, S; Moradi, A; Nadri, H; Moghadam, FH; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medicinal Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50080156 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50080156&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734129 103980327 CHEMBL3416509 ZINC26396850 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325487 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 7000 ChEMBL 10.1021/acs.jmedchem.5b00115 10.7270/Q2HQ41MH 25793650 Rochais, C; Lecoutey, C; Gaven, F; Giannoni, P; Hamidouche, K; Hedou, D; Dubost, E; Genest, D; Yahiaoui, S; Freret, T; Bouet, V; Dauphin, F; Sopkova de Oliveira Santos, J; Ballandonne, C; Corvaisier, S; Malzert-Fréon, A; Legay, R; Boulouard, M; Claeysen, S; Dallemagne, P CERMN http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325488 COc1cc(N)c(Cl)cc1C(=O)CCC1CCN(CC2CC2)CC1 InChI=1S/C19H27ClN2O2/c1-24-19-11-17(21)16(20)10-15(19)18(23)5-4-13-6-8-22(9-7-13)12-14-2-3-14/h10-11,13-14H,2-9,12,21H2,1H3 DHFMNRHFVSQCPD-UHFFFAOYSA-N 50079363 CHEMBL3414597::US9663465, 6 Cholinesterase 6600 ChEMBL 10.1021/acs.jmedchem.5b00115 10.7270/Q2HQ41MH 25793650 Rochais, C; Lecoutey, C; Gaven, F; Giannoni, P; Hamidouche, K; Hedou, D; Dubost, E; Genest, D; Yahiaoui, S; Freret, T; Bouet, V; Dauphin, F; Sopkova de Oliveira Santos, J; Ballandonne, C; Corvaisier, S; Malzert-Fréon, A; Legay, R; Boulouard, M; Claeysen, S; Dallemagne, P CERMN http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079363 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079363&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734508 313073954 CHEMBL3414597 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325489 COc1cc(N)c(Cl)cc1C(=O)CCC1CCN(CC2CCCC2)CC1 InChI=1S/C21H31ClN2O2/c1-26-21-13-19(23)18(22)12-17(21)20(25)7-6-15-8-10-24(11-9-15)14-16-4-2-3-5-16/h12-13,15-16H,2-11,14,23H2,1H3 RVKSBAURRKECBI-UHFFFAOYSA-N 50079365 CHEMBL3416996::US9663465, 8 Cholinesterase 6910 ChEMBL 10.1021/acs.jmedchem.5b00115 10.7270/Q2HQ41MH 25793650 Rochais, C; Lecoutey, C; Gaven, F; Giannoni, P; Hamidouche, K; Hedou, D; Dubost, E; Genest, D; Yahiaoui, S; Freret, T; Bouet, V; Dauphin, F; Sopkova de Oliveira Santos, J; Ballandonne, C; Corvaisier, S; Malzert-Fréon, A; Legay, R; Boulouard, M; Claeysen, S; Dallemagne, P CERMN http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079365 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079365&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734510 313073956 CHEMBL3416996 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325490 COc1cc(N)c(Cl)cc1C(=O)CCC1CCN(CC2CCCCCC2)CC1 InChI=1S/C23H35ClN2O2/c1-28-23-15-21(25)20(24)14-19(23)22(27)9-8-17-10-12-26(13-11-17)16-18-6-4-2-3-5-7-18/h14-15,17-18H,2-13,16,25H2,1H3 YVCAJCVHBUZCNX-UHFFFAOYSA-N 50079366 CHEMBL3416997::US9663465, 12 Cholinesterase 4000 ChEMBL 10.1021/acs.jmedchem.5b00115 10.7270/Q2HQ41MH 25793650 Rochais, C; Lecoutey, C; Gaven, F; Giannoni, P; Hamidouche, K; Hedou, D; Dubost, E; Genest, D; Yahiaoui, S; Freret, T; Bouet, V; Dauphin, F; Sopkova de Oliveira Santos, J; Ballandonne, C; Corvaisier, S; Malzert-Fréon, A; Legay, R; Boulouard, M; Claeysen, S; Dallemagne, P CERMN http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079366 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079366&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734511 313073957 CHEMBL3416997 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325491 COc1cc(N)c(Cl)cc1C(=O)CCC1CCN(CCC2CCCCC2)CC1 InChI=1S/C23H35ClN2O2/c1-28-23-16-21(25)20(24)15-19(23)22(27)8-7-18-10-13-26(14-11-18)12-9-17-5-3-2-4-6-17/h15-18H,2-14,25H2,1H3 HBJRTZJDKYEAKF-UHFFFAOYSA-N 50079368 CHEMBL3416999::US9663465, 16 Cholinesterase 6340 ChEMBL 10.1021/acs.jmedchem.5b00115 10.7270/Q2HQ41MH 25793650 Rochais, C; Lecoutey, C; Gaven, F; Giannoni, P; Hamidouche, K; Hedou, D; Dubost, E; Genest, D; Yahiaoui, S; Freret, T; Bouet, V; Dauphin, F; Sopkova de Oliveira Santos, J; Ballandonne, C; Corvaisier, S; Malzert-Fréon, A; Legay, R; Boulouard, M; Claeysen, S; Dallemagne, P CERMN http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079368 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079368&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734514 313073959 CHEMBL3416999 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325493 COc1cc(N)c(Cl)cc1C(=O)CCC1CCN(CC2CCCCC2C)CC1 InChI=1S/C23H35ClN2O2/c1-16-5-3-4-6-18(16)15-26-11-9-17(10-12-26)7-8-22(27)19-13-20(24)21(25)14-23(19)28-2/h13-14,16-18H,3-12,15,25H2,1-2H3 FSZQXBYUVRKUIV-UHFFFAOYSA-N 50079369 CHEMBL3417000::US9663465, 11 Cholinesterase 4340 ChEMBL 10.1021/acs.jmedchem.5b00115 10.7270/Q2HQ41MH 25793650 Rochais, C; Lecoutey, C; Gaven, F; Giannoni, P; Hamidouche, K; Hedou, D; Dubost, E; Genest, D; Yahiaoui, S; Freret, T; Bouet, V; Dauphin, F; Sopkova de Oliveira Santos, J; Ballandonne, C; Corvaisier, S; Malzert-Fréon, A; Legay, R; Boulouard, M; Claeysen, S; Dallemagne, P CERMN http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079369 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079369&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734515 313073960 CHEMBL3417000 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325494 COc1cc(N)c(Cl)cc1C(=O)CCC1CCN(Cc2ccccc2)CC1 InChI=1S/C22H27ClN2O2/c1-27-22-14-20(24)19(23)13-18(22)21(26)8-7-16-9-11-25(12-10-16)15-17-5-3-2-4-6-17/h2-6,13-14,16H,7-12,15,24H2,1H3 LVVYCYIWSNRYGP-UHFFFAOYSA-N 50079370 CHEMBL3417001 Cholinesterase 1835 ChEMBL 10.1021/acs.jmedchem.5b00115 10.7270/Q2HQ41MH 25793650 Rochais, C; Lecoutey, C; Gaven, F; Giannoni, P; Hamidouche, K; Hedou, D; Dubost, E; Genest, D; Yahiaoui, S; Freret, T; Bouet, V; Dauphin, F; Sopkova de Oliveira Santos, J; Ballandonne, C; Corvaisier, S; Malzert-Fréon, A; Legay, R; Boulouard, M; Claeysen, S; Dallemagne, P CERMN http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079370 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079370&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734516 313073961 CHEMBL3417001 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325495 COc1cc(N)c(Cl)cc1C(=O)CCC1CCN(Cc2cccnc2)CC1 InChI=1S/C21H26ClN3O2/c1-27-21-12-19(23)18(22)11-17(21)20(26)5-4-15-6-9-25(10-7-15)14-16-3-2-8-24-13-16/h2-3,8,11-13,15H,4-7,9-10,14,23H2,1H3 ITDACBKZDRJEOQ-UHFFFAOYSA-N 50079371 CHEMBL3417002 Cholinesterase 9165 ChEMBL 10.1021/acs.jmedchem.5b00115 10.7270/Q2HQ41MH 25793650 Rochais, C; Lecoutey, C; Gaven, F; Giannoni, P; Hamidouche, K; Hedou, D; Dubost, E; Genest, D; Yahiaoui, S; Freret, T; Bouet, V; Dauphin, F; Sopkova de Oliveira Santos, J; Ballandonne, C; Corvaisier, S; Malzert-Fréon, A; Legay, R; Boulouard, M; Claeysen, S; Dallemagne, P CERMN http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079371 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079371&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734517 313073962 CHEMBL3417002 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325496 COc1cc(N)c(Cl)cc1\C(CCC1CCN(CC2CCCCC2)CC1)=N\O InChI=1S/C22H34ClN3O2/c1-28-22-14-20(24)19(23)13-18(22)21(25-27)8-7-16-9-11-26(12-10-16)15-17-5-3-2-4-6-17/h13-14,16-17,27H,2-12,15,24H2,1H3/b25-21+ AXHPQZJBCUOUAV-NJNXFGOHSA-N 50079373 CHEMBL3417004 Cholinesterase 7080 ChEMBL 10.1021/acs.jmedchem.5b00115 10.7270/Q2HQ41MH 25793650 Rochais, C; Lecoutey, C; Gaven, F; Giannoni, P; Hamidouche, K; Hedou, D; Dubost, E; Genest, D; Yahiaoui, S; Freret, T; Bouet, V; Dauphin, F; Sopkova de Oliveira Santos, J; Ballandonne, C; Corvaisier, S; Malzert-Fréon, A; Legay, R; Boulouard, M; Claeysen, S; Dallemagne, P CERMN http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079373 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079373&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734519 313073964 CHEMBL3417004 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325499 CO\N=C(/CCC1CCN(CC2CCCCC2)CC1)c1cc(Cl)c(N)cc1OC InChI=1S/C23H36ClN3O2/c1-28-23-15-21(25)20(24)14-19(23)22(26-29-2)9-8-17-10-12-27(13-11-17)16-18-6-4-3-5-7-18/h14-15,17-18H,3-13,16,25H2,1-2H3/b26-22+ ZAKCOJKXWMIQSX-XTCLZLMSSA-N 50079376 CHEMBL3417005 Cholinesterase 7420 ChEMBL 10.1021/acs.jmedchem.5b00115 10.7270/Q2HQ41MH 25793650 Rochais, C; Lecoutey, C; Gaven, F; Giannoni, P; Hamidouche, K; Hedou, D; Dubost, E; Genest, D; Yahiaoui, S; Freret, T; Bouet, V; Dauphin, F; Sopkova de Oliveira Santos, J; Ballandonne, C; Corvaisier, S; Malzert-Fréon, A; Legay, R; Boulouard, M; Claeysen, S; Dallemagne, P CERMN http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079376 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079376&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734520 313073967 CHEMBL3417005 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325500 COc1cc(N)c(Cl)cc1C(O)CCC1CCN(CC2CCCCC2)CC1 InChI=1S/C22H35ClN2O2/c1-27-22-14-20(24)19(23)13-18(22)21(26)8-7-16-9-11-25(12-10-16)15-17-5-3-2-4-6-17/h13-14,16-17,21,26H,2-12,15,24H2,1H3 CSNVRKSBTKHYQD-UHFFFAOYSA-N 50079374 CHEMBL3417006 Cholinesterase 3640 ChEMBL 10.1021/acs.jmedchem.5b00115 10.7270/Q2HQ41MH 25793650 Rochais, C; Lecoutey, C; Gaven, F; Giannoni, P; Hamidouche, K; Hedou, D; Dubost, E; Genest, D; Yahiaoui, S; Freret, T; Bouet, V; Dauphin, F; Sopkova de Oliveira Santos, J; Ballandonne, C; Corvaisier, S; Malzert-Fréon, A; Legay, R; Boulouard, M; Claeysen, S; Dallemagne, P CERMN http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079374 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079374&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734521 313073965 CHEMBL3417006 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325501 COc1cc(N)c(Cl)cc1C(=O)OCC1CCN(CC2CCCCC2)CC1 InChI=1S/C21H31ClN2O3/c1-26-20-12-19(23)18(22)11-17(20)21(25)27-14-16-7-9-24(10-8-16)13-15-5-3-2-4-6-15/h11-12,15-16H,2-10,13-14,23H2,1H3 FQTXEUSQQPBRJW-UHFFFAOYSA-N 50079375 CHEMBL3417008::US9663465, 20 Cholinesterase 4100 ChEMBL 10.1021/acs.jmedchem.5b00115 10.7270/Q2HQ41MH 25793650 Rochais, C; Lecoutey, C; Gaven, F; Giannoni, P; Hamidouche, K; Hedou, D; Dubost, E; Genest, D; Yahiaoui, S; Freret, T; Bouet, V; Dauphin, F; Sopkova de Oliveira Santos, J; Ballandonne, C; Corvaisier, S; Malzert-Fréon, A; Legay, R; Boulouard, M; Claeysen, S; Dallemagne, P CERMN http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079375 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079375&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734523 313073966 CHEMBL3417008 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50327607 Cl.COc1ccc2C(=O)\C(COc2c1)=C\c1ccc(OCCCN2CCCCC2)cc1 InChI=1S/C25H29NO4.ClH/c1-28-22-10-11-23-24(17-22)30-18-20(25(23)27)16-19-6-8-21(9-7-19)29-15-5-14-26-12-3-2-4-13-26;/h6-11,16-17H,2-5,12-15,18H2,1H3;1H/b20-16+; WJFHMRFVZKTMKK-QTNJPTFUSA-N 50080158 CHEMBL3416508 Cholinesterase 26350 ChEMBL 10.1016/j.ejmech.2015.04.055 10.7270/Q2P84DM4 25969170 Pourshojaei, Y; Gouranourimi, A; Hekmat, S; Asadipour, A; Rahmani-Nezhad, S; Moradi, A; Nadri, H; Moghadam, FH; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medicinal Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50080158 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50080158&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734127 103980329 CHEMBL3416508 ZINC26394830 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50327614 Cl.Oc1ccc2C(=O)\C(COc2c1)=C\c1ccc(OCCN2CCCCC2)cc1 InChI=1S/C23H25NO4.ClH/c25-19-6-9-21-22(15-19)28-16-18(23(21)26)14-17-4-7-20(8-5-17)27-13-12-24-10-2-1-3-11-24;/h4-9,14-15,25H,1-3,10-13,16H2;1H/b18-14+; DWSXNXIDBLMIKT-LSJACRKWSA-N 50080159 CHEMBL3416507 Cholinesterase 2160 ChEMBL 10.1016/j.ejmech.2015.04.055 10.7270/Q2P84DM4 25969170 Pourshojaei, Y; Gouranourimi, A; Hekmat, S; Asadipour, A; Rahmani-Nezhad, S; Moradi, A; Nadri, H; Moghadam, FH; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medicinal Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50080159 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50080159&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734125 103980330 CHEMBL3416507 ZINC26399905 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50327616 Cl.Oc1ccc2C(=O)\C(COc2c1)=C\c1ccc(OCCN2CCOCC2)cc1 InChI=1S/C22H23NO5.ClH/c24-18-3-6-20-21(14-18)28-15-17(22(20)25)13-16-1-4-19(5-2-16)27-12-9-23-7-10-26-11-8-23;/h1-6,13-14,24H,7-12,15H2;1H/b17-13+; ZTVHBIZRUJWWPP-IWSIBTJSSA-N 50080161 CHEMBL3416506 Cholinesterase 96000 ChEMBL 10.1016/j.ejmech.2015.04.055 10.7270/Q2P84DM4 25969170 Pourshojaei, Y; Gouranourimi, A; Hekmat, S; Asadipour, A; Rahmani-Nezhad, S; Moradi, A; Nadri, H; Moghadam, FH; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medicinal Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50080161 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50080161&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734123 103980332 CHEMBL3416506 ZINC26386394 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50327617 Cl.Oc1ccc2C(=O)\C(COc2c1)=C\c1ccc(OCCCN2CCCCC2)cc1 InChI=1S/C24H27NO4.ClH/c26-20-7-10-22-23(16-20)29-17-19(24(22)27)15-18-5-8-21(9-6-18)28-14-4-13-25-11-2-1-3-12-25;/h5-10,15-16,26H,1-4,11-14,17H2;1H/b19-15+; FXOCHMBJFMOLDJ-QTCZRQAZSA-N 50080163 CHEMBL3416505 Cholinesterase 27370 ChEMBL 10.1016/j.ejmech.2015.04.055 10.7270/Q2P84DM4 25969170 Pourshojaei, Y; Gouranourimi, A; Hekmat, S; Asadipour, A; Rahmani-Nezhad, S; Moradi, A; Nadri, H; Moghadam, FH; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medicinal Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50080163 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50080163&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734121 103980334 CHEMBL3416505 ZINC26395725 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50327672 COc1ccc2C(=O)\C(COc2c1)=C\c1ccc(OCCN2CCOCC2)cc1 InChI=1S/C23H25NO5/c1-26-20-6-7-21-22(15-20)29-16-18(23(21)25)14-17-2-4-19(5-3-17)28-13-10-24-8-11-27-12-9-24/h2-7,14-15H,8-13,16H2,1H3/b18-14+ VZMVUYCLEBBZBG-NBVRZTHBSA-N 50080402 CHEMBL3416510 Cholinesterase 11590 ChEMBL 10.1016/j.ejmech.2015.04.055 10.7270/Q2P84DM4 25969170 Pourshojaei, Y; Gouranourimi, A; Hekmat, S; Asadipour, A; Rahmani-Nezhad, S; Moradi, A; Nadri, H; Moghadam, FH; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medicinal Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50080402 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50080402&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734132 313074169 CHEMBL3416510 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50327675 COc1ccc2C(=O)\C(COc2c1)=C\c1ccc(OCCCN2CCOCC2)cc1 InChI=1S/C24H27NO5/c1-27-21-7-8-22-23(16-21)30-17-19(24(22)26)15-18-3-5-20(6-4-18)29-12-2-9-25-10-13-28-14-11-25/h3-8,15-16H,2,9-14,17H2,1H3/b19-15+ PPOAGNJZGGYOSR-XDJHFCHBSA-N 50080401 CHEMBL3416511 Cholinesterase 101000 ChEMBL 10.1016/j.ejmech.2015.04.055 10.7270/Q2P84DM4 25969170 Pourshojaei, Y; Gouranourimi, A; Hekmat, S; Asadipour, A; Rahmani-Nezhad, S; Moradi, A; Nadri, H; Moghadam, FH; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medicinal Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50080401 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50080401&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734134 313074168 CHEMBL3416511 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50327676 Cl.COc1ccc2C(=O)\C(COc2c1)=C\c1ccc(OCCCN2CCCC2)cc1 InChI=1S/C24H27NO4.ClH/c1-27-21-9-10-22-23(16-21)29-17-19(24(22)26)15-18-5-7-20(8-6-18)28-14-4-13-25-11-2-3-12-25;/h5-10,15-16H,2-4,11-14,17H2,1H3;1H/b19-15+; MGTCBKLQNIGEOG-QTCZRQAZSA-N 50080393 CHEMBL3416512 Cholinesterase 6850 ChEMBL 10.1016/j.ejmech.2015.04.055 10.7270/Q2P84DM4 25969170 Pourshojaei, Y; Gouranourimi, A; Hekmat, S; Asadipour, A; Rahmani-Nezhad, S; Moradi, A; Nadri, H; Moghadam, FH; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medicinal Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50080393 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50080393&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734135 103980564 CHEMBL3416512 ZINC27092455 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50327677 Cl.CCOc1ccc2C(=O)\C(COc2c1)=C\c1ccc(OCCN2CCCCC2)cc1 InChI=1S/C25H29NO4.ClH/c1-2-28-22-10-11-23-24(17-22)30-18-20(25(23)27)16-19-6-8-21(9-7-19)29-15-14-26-12-4-3-5-13-26;/h6-11,16-17H,2-5,12-15,18H2,1H3;1H/b20-16+; YNGVFWOTLAPAHB-QTNJPTFUSA-N 50080392 CHEMBL3416513 Cholinesterase 854 ChEMBL 10.1016/j.ejmech.2015.04.055 10.7270/Q2P84DM4 25969170 Pourshojaei, Y; Gouranourimi, A; Hekmat, S; Asadipour, A; Rahmani-Nezhad, S; Moradi, A; Nadri, H; Moghadam, FH; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medicinal Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50080392 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50080392&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734137 103980563 CHEMBL3416513 ZINC27092481 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50327679 Cl.CCOc1ccc2C(=O)\C(COc2c1)=C\c1ccc(OCCCN2CCOCC2)cc1 InChI=1S/C25H29NO5.ClH/c1-2-29-22-8-9-23-24(17-22)31-18-20(25(23)27)16-19-4-6-21(7-5-19)30-13-3-10-26-11-14-28-15-12-26;/h4-9,16-17H,2-3,10-15,18H2,1H3;1H/b20-16+; BQLDQKGIERTOTP-QTNJPTFUSA-N 50080371 CHEMBL3416514 Cholinesterase 28720 ChEMBL 10.1016/j.ejmech.2015.04.055 10.7270/Q2P84DM4 25969170 Pourshojaei, Y; Gouranourimi, A; Hekmat, S; Asadipour, A; Rahmani-Nezhad, S; Moradi, A; Nadri, H; Moghadam, FH; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medicinal Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50080371 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50080371&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734139 103980542 CHEMBL3416514 ZINC13799979 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50327680 Cl.CCOc1ccc2C(=O)\C(COc2c1)=C\c1ccc(OCCN2CCOCC2)cc1 InChI=1S/C24H27NO5.ClH/c1-2-28-21-7-8-22-23(16-21)30-17-19(24(22)26)15-18-3-5-20(6-4-18)29-14-11-25-9-12-27-13-10-25;/h3-8,15-16H,2,9-14,17H2,1H3;1H/b19-15+; PBXYJPSTGCUORD-QTCZRQAZSA-N 50080318 CHEMBL3416515 Cholinesterase 10200 ChEMBL 10.1016/j.ejmech.2015.04.055 10.7270/Q2P84DM4 25969170 Pourshojaei, Y; Gouranourimi, A; Hekmat, S; Asadipour, A; Rahmani-Nezhad, S; Moradi, A; Nadri, H; Moghadam, FH; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medicinal Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50080318 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50080318&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734141 103980489 CHEMBL3416515 ZINC96258856 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50327681 Cl.CCOc1ccc2C(=O)\C(COc2c1)=C\c1ccc(OCCCN2CCCCC2)cc1 InChI=1S/C26H31NO4.ClH/c1-2-29-23-11-12-24-25(18-23)31-19-21(26(24)28)17-20-7-9-22(10-8-20)30-16-6-15-27-13-4-3-5-14-27;/h7-12,17-18H,2-6,13-16,19H2,1H3;1H/b21-17+; MIFRTSUAZVHAJD-DIRYEVLESA-N 50080232 CHEMBL3416516 Cholinesterase 3100 ChEMBL 10.1016/j.ejmech.2015.04.055 10.7270/Q2P84DM4 25969170 Pourshojaei, Y; Gouranourimi, A; Hekmat, S; Asadipour, A; Rahmani-Nezhad, S; Moradi, A; Nadri, H; Moghadam, FH; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medicinal Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50080232 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50080232&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734143 103980403 CHEMBL3416516 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50327683 Cl.O=C1\C(COc2cc(OCc3ccccc3)ccc12)=C\c1ccc(OCCN2CCOCC2)cc1 InChI=1S/C29H29NO5.ClH/c31-29-24(18-22-6-8-25(9-7-22)33-17-14-30-12-15-32-16-13-30)21-35-28-19-26(10-11-27(28)29)34-20-23-4-2-1-3-5-23;/h1-11,18-19H,12-17,20-21H2;1H/b24-18+; KMOHLABVNPEDLD-NDUABGMUSA-N 50080205 CHEMBL3416517 Cholinesterase 83720 ChEMBL 10.1016/j.ejmech.2015.04.055 10.7270/Q2P84DM4 25969170 Pourshojaei, Y; Gouranourimi, A; Hekmat, S; Asadipour, A; Rahmani-Nezhad, S; Moradi, A; Nadri, H; Moghadam, FH; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medicinal Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50080205 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50080205&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734145 103980376 CHEMBL3416517 ZINC26400356 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50327685 Cl.O=C1\C(COc2cc(OCc3ccccc3)ccc12)=C\c1ccc(OCCN2CCCCC2)cc1 InChI=1S/C30H31NO4.ClH/c32-30-25(19-23-9-11-26(12-10-23)33-18-17-31-15-5-2-6-16-31)22-35-29-20-27(13-14-28(29)30)34-21-24-7-3-1-4-8-24;/h1,3-4,7-14,19-20H,2,5-6,15-18,21-22H2;1H/b25-19+; JRTUNXIDUZJVKD-LUINMZRLSA-N 50080171 CHEMBL3416519 Cholinesterase 2580 ChEMBL 10.1016/j.ejmech.2015.04.055 10.7270/Q2P84DM4 25969170 Pourshojaei, Y; Gouranourimi, A; Hekmat, S; Asadipour, A; Rahmani-Nezhad, S; Moradi, A; Nadri, H; Moghadam, FH; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medicinal Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50080171 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50080171&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734149 103980342 CHEMBL3416519 ZINC26404415 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50327686 Cl.O=C1\C(COc2cc(OCc3ccccc3)ccc12)=C\c1ccc(OCCCN2CCCC2)cc1 InChI=1S/C30H31NO4.ClH/c32-30-25(19-23-9-11-26(12-10-23)33-18-6-17-31-15-4-5-16-31)22-35-29-20-27(13-14-28(29)30)34-21-24-7-2-1-3-8-24;/h1-3,7-14,19-20H,4-6,15-18,21-22H2;1H/b25-19+; UUPYVJMEEFUMAD-LUINMZRLSA-N 50080168 CHEMBL3416520 Cholinesterase 49000 ChEMBL 10.1016/j.ejmech.2015.04.055 10.7270/Q2P84DM4 25969170 Pourshojaei, Y; Gouranourimi, A; Hekmat, S; Asadipour, A; Rahmani-Nezhad, S; Moradi, A; Nadri, H; Moghadam, FH; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medicinal Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50080168 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50080168&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734151 103980339 CHEMBL3416520 ZINC26393507 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50327687 Cl.O=C1\C(COc2cc(OCc3ccccc3)ccc12)=C\c1ccc(OCCCN2CCCCC2)cc1 InChI=1S/C31H33NO4.ClH/c33-31-26(20-24-10-12-27(13-11-24)34-19-7-18-32-16-5-2-6-17-32)23-36-30-21-28(14-15-29(30)31)35-22-25-8-3-1-4-9-25;/h1,3-4,8-15,20-21H,2,5-7,16-19,22-23H2;1H/b26-20+; SRJMIUVQOJNCSW-ZFUDNRMFSA-N 50080165 CHEMBL3416521 Cholinesterase 32400 ChEMBL 10.1016/j.ejmech.2015.04.055 10.7270/Q2P84DM4 25969170 Pourshojaei, Y; Gouranourimi, A; Hekmat, S; Asadipour, A; Rahmani-Nezhad, S; Moradi, A; Nadri, H; Moghadam, FH; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medicinal Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50080165 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50080165&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734153 103980336 CHEMBL3416521 ZINC03108047 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50327688 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 350 ChEMBL 10.1016/j.ejmech.2015.04.055 10.7270/Q2P84DM4 25969170 Pourshojaei, Y; Gouranourimi, A; Hekmat, S; Asadipour, A; Rahmani-Nezhad, S; Moradi, A; Nadri, H; Moghadam, FH; Emami, S; Foroumadi, A; Shafiee, A Tehran University of Medicinal Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50314716 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 35 ChEMBL 10.1016/j.ejmech.2015.01.058 10.7270/Q2154JRN 25656088 Xie, SS; Lan, JS; Wang, XB; Jiang, N; Dong, G; Li, ZR; Wang, KD; Guo, PP; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50314717 Cc1c(C)c2OC(C)(CCc2c(C)c1O)C(=O)NCCCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C37H51N3O3/c1-25-26(2)35-28(27(3)34(25)41)21-22-37(4,43-35)36(42)39-24-16-10-8-6-5-7-9-15-23-38-33-29-17-11-13-19-31(29)40-32-20-14-12-18-30(32)33/h11,13,17,19,41H,5-10,12,14-16,18,20-24H2,1-4H3,(H,38,40)(H,39,42) HEGWZHATVPIKRD-UHFFFAOYSA-N 50073142 CHEMBL3410957 Cholinesterase 263 ChEMBL 10.1016/j.ejmech.2015.01.058 10.7270/Q2154JRN 25656088 Xie, SS; Lan, JS; Wang, XB; Jiang, N; Dong, G; Li, ZR; Wang, KD; Guo, PP; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50073142 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50073142&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118732693 313072790 CHEMBL3410957 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50314718 Cc1c(C)c2OC(C)(CCc2c(C)c1O)C(=O)NCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C35H47N3O3/c1-23-24(2)33-26(25(3)32(23)39)19-20-35(4,41-33)34(40)37-22-14-8-6-5-7-13-21-36-31-27-15-9-11-17-29(27)38-30-18-12-10-16-28(30)31/h9,11,15,17,39H,5-8,10,12-14,16,18-22H2,1-4H3,(H,36,38)(H,37,40) HELQVBTZKVKAPS-UHFFFAOYSA-N 50073112 CHEMBL3410956 Cholinesterase 151 ChEMBL 10.1016/j.ejmech.2015.01.058 10.7270/Q2154JRN 25656088 Xie, SS; Lan, JS; Wang, XB; Jiang, N; Dong, G; Li, ZR; Wang, KD; Guo, PP; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50073112 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50073112&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118732692 313072784 CHEMBL3410956 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50314719 Cc1c(C)c2OC(C)(CCc2c(C)c1O)C(=O)NCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C34H45N3O3/c1-22-23(2)32-25(24(3)31(22)38)18-19-34(4,40-32)33(39)36-21-13-7-5-6-12-20-35-30-26-14-8-10-16-28(26)37-29-17-11-9-15-27(29)30/h8,10,14,16,38H,5-7,9,11-13,15,17-21H2,1-4H3,(H,35,37)(H,36,39) GYANWDNIKGBQDN-UHFFFAOYSA-N 50073113 CHEMBL3410955 Cholinesterase 62 ChEMBL 10.1016/j.ejmech.2015.01.058 10.7270/Q2154JRN 25656088 Xie, SS; Lan, JS; Wang, XB; Jiang, N; Dong, G; Li, ZR; Wang, KD; Guo, PP; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50073113 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50073113&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118732691 313072785 CHEMBL3410955 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50314739 Cc1c(C)c2OC(C)(CCc2c(C)c1O)C(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C33H43N3O3/c1-21-22(2)31-24(23(3)30(21)37)17-18-33(4,39-31)32(38)35-20-12-6-5-11-19-34-29-25-13-7-9-15-27(25)36-28-16-10-8-14-26(28)29/h7,9,13,15,37H,5-6,8,10-12,14,16-20H2,1-4H3,(H,34,36)(H,35,38) ATFSKIZVJOMGAR-UHFFFAOYSA-N 50073114 CHEMBL3410954 Cholinesterase 22 ChEMBL 10.1016/j.ejmech.2015.01.058 10.7270/Q2154JRN 25656088 Xie, SS; Lan, JS; Wang, XB; Jiang, N; Dong, G; Li, ZR; Wang, KD; Guo, PP; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50073114 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50073114&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118732690 313072786 CHEMBL3410954 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50314763 Cc1c(C)c2OC(C)(CCc2c(C)c1O)C(=O)NCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C32H41N3O3/c1-20-21(2)30-23(22(3)29(20)36)16-17-32(4,38-30)31(37)34-19-11-5-10-18-33-28-24-12-6-8-14-26(24)35-27-15-9-7-13-25(27)28/h6,8,12,14,36H,5,7,9-11,13,15-19H2,1-4H3,(H,33,35)(H,34,37) IDTWGEUFPVJYSJ-UHFFFAOYSA-N 50073115 CHEMBL3410953 Cholinesterase 35 ChEMBL 10.1016/j.ejmech.2015.01.058 10.7270/Q2154JRN 25656088 Xie, SS; Lan, JS; Wang, XB; Jiang, N; Dong, G; Li, ZR; Wang, KD; Guo, PP; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50073115 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50073115&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118732689 313072787 CHEMBL3410953 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50314764 Cc1c(C)c2OC(C)(CCc2c(C)c1O)C(=O)NCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C31H39N3O3/c1-19-20(2)29-22(21(3)28(19)35)15-16-31(4,37-29)30(36)33-18-10-9-17-32-27-23-11-5-7-13-25(23)34-26-14-8-6-12-24(26)27/h5,7,11,13,35H,6,8-10,12,14-18H2,1-4H3,(H,32,34)(H,33,36) AGELYORQPXWSGA-UHFFFAOYSA-N 50073116 CHEMBL3410952 Cholinesterase 16 ChEMBL 10.1016/j.ejmech.2015.01.058 10.7270/Q2154JRN 25656088 Xie, SS; Lan, JS; Wang, XB; Jiang, N; Dong, G; Li, ZR; Wang, KD; Guo, PP; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50073116 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50073116&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118732688 313072788 CHEMBL3410952 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50314773 Cc1c(C)c2OC(C)(CCc2c(C)c1O)C(=O)NCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C29H35N3O3/c1-17-18(2)27-20(19(3)26(17)33)13-14-29(4,35-27)28(34)31-16-15-30-25-21-9-5-7-11-23(21)32-24-12-8-6-10-22(24)25/h5,7,9,11,33H,6,8,10,12-16H2,1-4H3,(H,30,32)(H,31,34) GYSSCMBLUIEVHL-UHFFFAOYSA-N 50073117 CHEMBL3410951 Cholinesterase 41 ChEMBL 10.1016/j.ejmech.2015.01.058 10.7270/Q2154JRN 25656088 Xie, SS; Lan, JS; Wang, XB; Jiang, N; Dong, G; Li, ZR; Wang, KD; Guo, PP; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50073117 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50073117&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118732687 313072789 CHEMBL3410951 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50318033 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 1830 ChEMBL 10.1016/j.ejmech.2015.01.027 10.7270/Q23T9JXZ 25621991 Guzior, N; Bajda, M; Skrok, M; Kurpiewska, K; Lewinski, K; Brus, B; Pišlar, A; Kos, J; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50318034 Clc1cccc(CNCCCCCCCCN2C(=O)c3ccccc3C2=O)c1 InChI=1S/C23H27ClN2O2/c24-19-11-9-10-18(16-19)17-25-14-7-3-1-2-4-8-15-26-22(27)20-12-5-6-13-21(20)23(26)28/h5-6,9-13,16,25H,1-4,7-8,14-15,17H2 XMMRXYIBDPVENS-UHFFFAOYSA-N 50075582 CHEMBL3415581 Cholinesterase 1480 ChEMBL 10.1016/j.ejmech.2015.01.027 10.7270/Q23T9JXZ 25621991 Guzior, N; Bajda, M; Skrok, M; Kurpiewska, K; Lewinski, K; Brus, B; Pišlar, A; Kos, J; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50075582 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50075582&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118733345 313048472 CHEMBL3415581 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50318035 Clc1cccc(CNCCCCCCCN2C(=O)c3ccccc3C2=O)c1 InChI=1S/C22H25ClN2O2/c23-18-10-8-9-17(15-18)16-24-13-6-2-1-3-7-14-25-21(26)19-11-4-5-12-20(19)22(25)27/h4-5,8-12,15,24H,1-3,6-7,13-14,16H2 FGKIQUDSHAMYKF-UHFFFAOYSA-N 50075583 CHEMBL3415580 Cholinesterase 2632 ChEMBL 10.1016/j.ejmech.2015.01.027 10.7270/Q23T9JXZ 25621991 Guzior, N; Bajda, M; Skrok, M; Kurpiewska, K; Lewinski, K; Brus, B; Pišlar, A; Kos, J; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50075583 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50075583&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118733344 313073176 CHEMBL3415580 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50318036 Clc1cccc(CNCCCCCCN2C(=O)c3ccccc3C2=O)c1 InChI=1S/C21H23ClN2O2/c22-17-9-7-8-16(14-17)15-23-12-5-1-2-6-13-24-20(25)18-10-3-4-11-19(18)21(24)26/h3-4,7-11,14,23H,1-2,5-6,12-13,15H2 JZLIAEXQDTVQDQ-UHFFFAOYSA-N 50075584 CHEMBL3415579 Cholinesterase 4598 ChEMBL 10.1016/j.ejmech.2015.01.027 10.7270/Q23T9JXZ 25621991 Guzior, N; Bajda, M; Skrok, M; Kurpiewska, K; Lewinski, K; Brus, B; Pišlar, A; Kos, J; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50075584 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50075584&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118733343 313073177 CHEMBL3415579 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50318039 Fc1ccc(CNCCCCCCCCN2C(=O)c3ccccc3C2=O)c(F)c1 InChI=1S/C23H26F2N2O2/c24-18-12-11-17(21(25)15-18)16-26-13-7-3-1-2-4-8-14-27-22(28)19-9-5-6-10-20(19)23(27)29/h5-6,9-12,15,26H,1-4,7-8,13-14,16H2 ZCXKNMJBIIVQIS-UHFFFAOYSA-N 50075585 CHEMBL3415576 Cholinesterase 1059 ChEMBL 10.1016/j.ejmech.2015.01.027 10.7270/Q23T9JXZ 25621991 Guzior, N; Bajda, M; Skrok, M; Kurpiewska, K; Lewinski, K; Brus, B; Pišlar, A; Kos, J; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50075585 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50075585&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118733340 313073178 CHEMBL3415576 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50318040 Fc1ccc(CNCCCCCCCN2C(=O)c3ccccc3C2=O)c(F)c1 InChI=1S/C22H24F2N2O2/c23-17-11-10-16(20(24)14-17)15-25-12-6-2-1-3-7-13-26-21(27)18-8-4-5-9-19(18)22(26)28/h4-5,8-11,14,25H,1-3,6-7,12-13,15H2 VCMCOZQOXDBOJF-UHFFFAOYSA-N 50075586 CHEMBL3415575 Cholinesterase 1865 ChEMBL 10.1016/j.ejmech.2015.01.027 10.7270/Q23T9JXZ 25621991 Guzior, N; Bajda, M; Skrok, M; Kurpiewska, K; Lewinski, K; Brus, B; Pišlar, A; Kos, J; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50075586 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50075586&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118733339 313073179 CHEMBL3415575 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50318041 Fc1ccc(CNCCCCCCN2C(=O)c3ccccc3C2=O)c(F)c1 InChI=1S/C21H22F2N2O2/c22-16-10-9-15(19(23)13-16)14-24-11-5-1-2-6-12-25-20(26)17-7-3-4-8-18(17)21(25)27/h3-4,7-10,13,24H,1-2,5-6,11-12,14H2 RAMACCWHONZEEF-UHFFFAOYSA-N 50075587 CHEMBL3415574 Cholinesterase 8095 ChEMBL 10.1016/j.ejmech.2015.01.027 10.7270/Q23T9JXZ 25621991 Guzior, N; Bajda, M; Skrok, M; Kurpiewska, K; Lewinski, K; Brus, B; Pišlar, A; Kos, J; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50075587 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50075587&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118733338 313073180 CHEMBL3415574 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50318042 Fc1ccc(CNCCCCCCCCN2C(=O)c3ccccc3C2=O)cc1 InChI=1S/C23H27FN2O2/c24-19-13-11-18(12-14-19)17-25-15-7-3-1-2-4-8-16-26-22(27)20-9-5-6-10-21(20)23(26)28/h5-6,9-14,25H,1-4,7-8,15-17H2 ZXFDHNOVGDGIGL-UHFFFAOYSA-N 50075588 CHEMBL3415571 Cholinesterase 1695 ChEMBL 10.1016/j.ejmech.2015.01.027 10.7270/Q23T9JXZ 25621991 Guzior, N; Bajda, M; Skrok, M; Kurpiewska, K; Lewinski, K; Brus, B; Pišlar, A; Kos, J; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50075588 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50075588&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118733335 313073181 CHEMBL3415571 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50318043 Fc1ccc(CNCCCCCCCN2C(=O)c3ccccc3C2=O)cc1 InChI=1S/C22H25FN2O2/c23-18-12-10-17(11-13-18)16-24-14-6-2-1-3-7-15-25-21(26)19-8-4-5-9-20(19)22(25)27/h4-5,8-13,24H,1-3,6-7,14-16H2 UCDNIEFZLVXXCD-UHFFFAOYSA-N 50075589 CHEMBL3415570 Cholinesterase 1581 ChEMBL 10.1016/j.ejmech.2015.01.027 10.7270/Q23T9JXZ 25621991 Guzior, N; Bajda, M; Skrok, M; Kurpiewska, K; Lewinski, K; Brus, B; Pišlar, A; Kos, J; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50075589 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50075589&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 60167502 313073182 CHEMBL3415570 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50318044 Fc1ccc(CNCCCCCCN2C(=O)c3ccccc3C2=O)cc1 InChI=1S/C21H23FN2O2/c22-17-11-9-16(10-12-17)15-23-13-5-1-2-6-14-24-20(25)18-7-3-4-8-19(18)21(24)26/h3-4,7-12,23H,1-2,5-6,13-15H2 KSCFZHJXBZDDOT-UHFFFAOYSA-N 50075590 CHEMBL3415569 Cholinesterase 9196 ChEMBL 10.1016/j.ejmech.2015.01.027 10.7270/Q23T9JXZ 25621991 Guzior, N; Bajda, M; Skrok, M; Kurpiewska, K; Lewinski, K; Brus, B; Pišlar, A; Kos, J; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50075590 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50075590&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118733334 313073183 CHEMBL3415569 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50318045 Fc1ccccc1CNCCCCCCCCN1C(=O)c2ccccc2C1=O InChI=1S/C23H27FN2O2/c24-21-14-8-5-11-18(21)17-25-15-9-3-1-2-4-10-16-26-22(27)19-12-6-7-13-20(19)23(26)28/h5-8,11-14,25H,1-4,9-10,15-17H2 XKDPNCLQBQTTEN-UHFFFAOYSA-N 50075591 CHEMBL3415566 Cholinesterase 2092 ChEMBL 10.1016/j.ejmech.2015.01.027 10.7270/Q23T9JXZ 25621991 Guzior, N; Bajda, M; Skrok, M; Kurpiewska, K; Lewinski, K; Brus, B; Pišlar, A; Kos, J; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50075591 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50075591&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118733331 313073184 CHEMBL3415566 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50318046 Fc1ccccc1CNCCCCCCCN1C(=O)c2ccccc2C1=O InChI=1S/C22H25FN2O2/c23-20-13-7-4-10-17(20)16-24-14-8-2-1-3-9-15-25-21(26)18-11-5-6-12-19(18)22(25)27/h4-7,10-13,24H,1-3,8-9,14-16H2 ABMUIKNLWXQBLZ-UHFFFAOYSA-N 50075592 CHEMBL3415565 Cholinesterase 2377 ChEMBL 10.1016/j.ejmech.2015.01.027 10.7270/Q23T9JXZ 25621991 Guzior, N; Bajda, M; Skrok, M; Kurpiewska, K; Lewinski, K; Brus, B; Pišlar, A; Kos, J; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50075592 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50075592&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118733330 313073185 CHEMBL3415565 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50318048 O=C1N(CCCCCCCCNCc2ccccc2)C(=O)c2ccccc12 InChI=1S/C23H28N2O2/c26-22-20-14-8-9-15-21(20)23(27)25(22)17-11-4-2-1-3-10-16-24-18-19-12-6-5-7-13-19/h5-9,12-15,24H,1-4,10-11,16-18H2 CBPLVCKGKVDMPI-UHFFFAOYSA-N 50075593 CHEMBL3415561 Cholinesterase 1232 ChEMBL 10.1016/j.ejmech.2015.01.027 10.7270/Q23T9JXZ 25621991 Guzior, N; Bajda, M; Skrok, M; Kurpiewska, K; Lewinski, K; Brus, B; Pišlar, A; Kos, J; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50075593 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50075593&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118733326 313073186 CHEMBL3415561 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50318049 O=C1N(CCCCCCCNCc2ccccc2)C(=O)c2ccccc12 InChI=1S/C22H26N2O2/c25-21-19-13-7-8-14-20(19)22(26)24(21)16-10-3-1-2-9-15-23-17-18-11-5-4-6-12-18/h4-8,11-14,23H,1-3,9-10,15-17H2 AFZKLKOFXUIXAC-UHFFFAOYSA-N 50075594 CHEMBL3415560 Cholinesterase 1706 ChEMBL 10.1016/j.ejmech.2015.01.027 10.7270/Q23T9JXZ 25621991 Guzior, N; Bajda, M; Skrok, M; Kurpiewska, K; Lewinski, K; Brus, B; Pišlar, A; Kos, J; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50075594 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50075594&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118733325 313073187 CHEMBL3415560 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50318133 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 2.0 ChEMBL 10.1016/j.ejmech.2015.01.027 10.7270/Q23T9JXZ 25621991 Guzior, N; Bajda, M; Skrok, M; Kurpiewska, K; Lewinski, K; Brus, B; Pišlar, A; Kos, J; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325798 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 20 ChEMBL 10.1016/j.ejmech.2015.03.040 10.7270/Q20R9R4H 25812965 Xie, SS; Wang, X; Jiang, N; Yu, W; Wang, KD; Lan, JS; Li, ZR; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325799 O=c1oc2cc(OCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)ccc2c2CCCCc12 InChI=1S/C35H42N4O3/c40-35-28-9-2-1-8-26(28)27-15-14-25(24-33(27)42-35)41-23-22-39-20-18-38(19-21-39)17-7-16-36-34-29-10-3-5-12-31(29)37-32-13-6-4-11-30(32)34/h3,5,10,12,14-15,24H,1-2,4,6-9,11,13,16-23H2,(H,36,37) OSIQHLHPEJAMTO-UHFFFAOYSA-N 50079500 CHEMBL3417293 Cholinesterase 159 ChEMBL 10.1016/j.ejmech.2015.03.040 10.7270/Q20R9R4H 25812965 Xie, SS; Wang, X; Jiang, N; Yu, W; Wang, KD; Lan, JS; Li, ZR; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079500 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079500&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734706 313073984 CHEMBL3417293 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325800 Nc1cc(=O)oc2cc(OCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)ccc12 InChI=1S/C31H37N5O3/c32-26-21-30(37)39-29-20-22(10-11-23(26)29)38-19-18-36-16-14-35(15-17-36)13-5-12-33-31-24-6-1-3-8-27(24)34-28-9-4-2-7-25(28)31/h1,3,6,8,10-11,20-21H,2,4-5,7,9,12-19,32H2,(H,33,34) SDXXOBJFUGAGFS-UHFFFAOYSA-N 50079501 CHEMBL3417294 Cholinesterase 71 ChEMBL 10.1016/j.ejmech.2015.03.040 10.7270/Q20R9R4H 25812965 Xie, SS; Wang, X; Jiang, N; Yu, W; Wang, KD; Lan, JS; Li, ZR; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079501 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079501&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734707 313073985 CHEMBL3417294 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325801 O=c1cc(-c2ccccc2)c2ccc(OCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)cc2o1 InChI=1S/C37H40N4O3/c42-36-26-32(27-9-2-1-3-10-27)29-16-15-28(25-35(29)44-36)43-24-23-41-21-19-40(20-22-41)18-8-17-38-37-30-11-4-6-13-33(30)39-34-14-7-5-12-31(34)37/h1-4,6,9-11,13,15-16,25-26H,5,7-8,12,14,17-24H2,(H,38,39) JEVDJCMWVBWXEC-UHFFFAOYSA-N 50079502 CHEMBL3417295 Cholinesterase 216 ChEMBL 10.1016/j.ejmech.2015.03.040 10.7270/Q20R9R4H 25812965 Xie, SS; Wang, X; Jiang, N; Yu, W; Wang, KD; Lan, JS; Li, ZR; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079502 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079502&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734708 313073986 CHEMBL3417295 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325802 FC(F)(F)c1cc(=O)oc2cc(OCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)ccc12 InChI=1S/C32H35F3N4O3/c33-32(34,35)26-21-30(40)42-29-20-22(10-11-23(26)29)41-19-18-39-16-14-38(15-17-39)13-5-12-36-31-24-6-1-3-8-27(24)37-28-9-4-2-7-25(28)31/h1,3,6,8,10-11,20-21H,2,4-5,7,9,12-19H2,(H,36,37) KSBYNLFEJIVFPB-UHFFFAOYSA-N 50079503 CHEMBL3417296 Cholinesterase 149 ChEMBL 10.1016/j.ejmech.2015.03.040 10.7270/Q20R9R4H 25812965 Xie, SS; Wang, X; Jiang, N; Yu, W; Wang, KD; Lan, JS; Li, ZR; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079503 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079503&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734709 313073987 CHEMBL3417296 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325803 CCOc1cc(=O)oc2cc(OCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)ccc12 InChI=1S/C33H40N4O4/c1-2-39-30-23-32(38)41-31-22-24(12-13-27(30)31)40-21-20-37-18-16-36(17-19-37)15-7-14-34-33-25-8-3-5-10-28(25)35-29-11-6-4-9-26(29)33/h3,5,8,10,12-13,22-23H,2,4,6-7,9,11,14-21H2,1H3,(H,34,35) FZVNQFHQTVISSR-UHFFFAOYSA-N 50079504 CHEMBL3417297 Cholinesterase 87 ChEMBL 10.1016/j.ejmech.2015.03.040 10.7270/Q20R9R4H 25812965 Xie, SS; Wang, X; Jiang, N; Yu, W; Wang, KD; Lan, JS; Li, ZR; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079504 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079504&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734710 313073988 CHEMBL3417297 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325804 COc1cc(=O)oc2cc(OCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)ccc12 InChI=1S/C32H38N4O4/c1-38-29-22-31(37)40-30-21-23(11-12-26(29)30)39-20-19-36-17-15-35(16-18-36)14-6-13-33-32-24-7-2-4-9-27(24)34-28-10-5-3-8-25(28)32/h2,4,7,9,11-12,21-22H,3,5-6,8,10,13-20H2,1H3,(H,33,34) BCVGDFVUHQSRKG-UHFFFAOYSA-N 50079505 CHEMBL3417298 Cholinesterase 116 ChEMBL 10.1016/j.ejmech.2015.03.040 10.7270/Q20R9R4H 25812965 Xie, SS; Wang, X; Jiang, N; Yu, W; Wang, KD; Lan, JS; Li, ZR; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079505 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079505&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734711 313073989 CHEMBL3417298 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325805 Cc1c(Cl)c(=O)oc2cc(OCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)ccc12 InChI=1S/C32H37ClN4O3/c1-22-24-12-11-23(21-29(24)40-32(38)30(22)33)39-20-19-37-17-15-36(16-18-37)14-6-13-34-31-25-7-2-4-9-27(25)35-28-10-5-3-8-26(28)31/h2,4,7,9,11-12,21H,3,5-6,8,10,13-20H2,1H3,(H,34,35) GDFJHAWHVPWSSH-UHFFFAOYSA-N 50079506 CHEMBL3417299 Cholinesterase 73 ChEMBL 10.1016/j.ejmech.2015.03.040 10.7270/Q20R9R4H 25812965 Xie, SS; Wang, X; Jiang, N; Yu, W; Wang, KD; Lan, JS; Li, ZR; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079506 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079506&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734712 313073990 CHEMBL3417299 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325806 Cc1c(C)c(=O)oc2cc(OCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)ccc12 InChI=1S/C33H40N4O3/c1-23-24(2)33(38)40-31-22-25(12-13-26(23)31)39-21-20-37-18-16-36(17-19-37)15-7-14-34-32-27-8-3-5-10-29(27)35-30-11-6-4-9-28(30)32/h3,5,8,10,12-13,22H,4,6-7,9,11,14-21H2,1-2H3,(H,34,35) QXXGDBDNPIPTRF-UHFFFAOYSA-N 50079508 CHEMBL3417300 Cholinesterase 81 ChEMBL 10.1016/j.ejmech.2015.03.040 10.7270/Q20R9R4H 25812965 Xie, SS; Wang, X; Jiang, N; Yu, W; Wang, KD; Lan, JS; Li, ZR; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079508 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079508&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734713 313073991 CHEMBL3417300 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325807 Cc1cc2ccc(OCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)cc2oc1=O InChI=1S/C32H38N4O3/c1-23-21-24-11-12-25(22-30(24)39-32(23)37)38-20-19-36-17-15-35(16-18-36)14-6-13-33-31-26-7-2-4-9-28(26)34-29-10-5-3-8-27(29)31/h2,4,7,9,11-12,21-22H,3,5-6,8,10,13-20H2,1H3,(H,33,34) LSWKLICEAUQVMA-UHFFFAOYSA-N 50079509 CHEMBL3417301 Cholinesterase 55 ChEMBL 10.1016/j.ejmech.2015.03.040 10.7270/Q20R9R4H 25812965 Xie, SS; Wang, X; Jiang, N; Yu, W; Wang, KD; Lan, JS; Li, ZR; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079509 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079509&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734714 313073992 CHEMBL3417301 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325808 Cc1cc(=O)oc2cc(OCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)ccc12 InChI=1S/C32H38N4O3/c1-23-21-31(37)39-30-22-24(11-12-25(23)30)38-20-19-36-17-15-35(16-18-36)14-6-13-33-32-26-7-2-4-9-28(26)34-29-10-5-3-8-27(29)32/h2,4,7,9,11-12,21-22H,3,5-6,8,10,13-20H2,1H3,(H,33,34) SMGUTCNZXGIUCJ-UHFFFAOYSA-N 50079510 CHEMBL3417302 Cholinesterase 51 ChEMBL 10.1016/j.ejmech.2015.03.040 10.7270/Q20R9R4H 25812965 Xie, SS; Wang, X; Jiang, N; Yu, W; Wang, KD; Lan, JS; Li, ZR; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079510 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079510&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734715 313073993 CHEMBL3417302 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325809 O=c1ccc2ccc(OCCCCCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)cc2o1 InChI=1S/C35H44N4O3/c40-34-17-15-27-14-16-28(26-33(27)42-34)41-25-8-2-1-7-19-38-21-23-39(24-22-38)20-9-18-36-35-29-10-3-5-12-31(29)37-32-13-6-4-11-30(32)35/h3,5,10,12,14-17,26H,1-2,4,6-9,11,13,18-25H2,(H,36,37) ORSILIXUUUCZAS-UHFFFAOYSA-N 50079511 CHEMBL3417303 Cholinesterase 38 ChEMBL 10.1016/j.ejmech.2015.03.040 10.7270/Q20R9R4H 25812965 Xie, SS; Wang, X; Jiang, N; Yu, W; Wang, KD; Lan, JS; Li, ZR; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079511 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079511&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734716 313073994 CHEMBL3417303 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325810 O=c1ccc2ccc(OCCCCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)cc2o1 InChI=1S/C34H42N4O3/c39-33-16-14-26-13-15-27(25-32(26)41-33)40-24-7-1-6-18-37-20-22-38(23-21-37)19-8-17-35-34-28-9-2-4-11-30(28)36-31-12-5-3-10-29(31)34/h2,4,9,11,13-16,25H,1,3,5-8,10,12,17-24H2,(H,35,36) TWJIVHLWRFWASS-UHFFFAOYSA-N 50079512 CHEMBL3417304 Cholinesterase 42 ChEMBL 10.1016/j.ejmech.2015.03.040 10.7270/Q20R9R4H 25812965 Xie, SS; Wang, X; Jiang, N; Yu, W; Wang, KD; Lan, JS; Li, ZR; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079512 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079512&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734717 313073995 CHEMBL3417304 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325811 O=c1ccc2ccc(OCCCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)cc2o1 InChI=1S/C33H40N4O3/c38-32-15-13-25-12-14-26(24-31(25)40-32)39-23-6-5-17-36-19-21-37(22-20-36)18-7-16-34-33-27-8-1-3-10-29(27)35-30-11-4-2-9-28(30)33/h1,3,8,10,12-15,24H,2,4-7,9,11,16-23H2,(H,34,35) IWYTZZGVDJBXMG-UHFFFAOYSA-N 50079513 CHEMBL3417305 Cholinesterase 23 ChEMBL 10.1016/j.ejmech.2015.03.040 10.7270/Q20R9R4H 25812965 Xie, SS; Wang, X; Jiang, N; Yu, W; Wang, KD; Lan, JS; Li, ZR; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079513 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079513&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734718 313073996 CHEMBL3417305 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325812 O=c1ccc2ccc(OCCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)cc2o1 InChI=1S/C32H38N4O3/c37-31-14-12-24-11-13-25(23-30(24)39-31)38-22-6-17-36-20-18-35(19-21-36)16-5-15-33-32-26-7-1-3-9-28(26)34-29-10-4-2-8-27(29)32/h1,3,7,9,11-14,23H,2,4-6,8,10,15-22H2,(H,33,34) OXKYZMPZZYQADV-UHFFFAOYSA-N 50079514 CHEMBL3417306 Cholinesterase 32 ChEMBL 10.1016/j.ejmech.2015.03.040 10.7270/Q20R9R4H 25812965 Xie, SS; Wang, X; Jiang, N; Yu, W; Wang, KD; Lan, JS; Li, ZR; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079514 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079514&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734719 313073997 CHEMBL3417306 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325813 O=c1ccc2ccc(OCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)cc2o1 InChI=1S/C31H36N4O3/c36-30-13-11-23-10-12-24(22-29(23)38-30)37-21-20-35-18-16-34(17-19-35)15-5-14-32-31-25-6-1-3-8-27(25)33-28-9-4-2-7-26(28)31/h1,3,6,8,10-13,22H,2,4-5,7,9,14-21H2,(H,32,33) PIWUWOLYFQAYGB-UHFFFAOYSA-N 50079515 CHEMBL3417307 Cholinesterase 38 ChEMBL 10.1016/j.ejmech.2015.03.040 10.7270/Q20R9R4H 25812965 Xie, SS; Wang, X; Jiang, N; Yu, W; Wang, KD; Lan, JS; Li, ZR; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079515 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079515&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734720 313073998 CHEMBL3417307 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325814 O=c1ccc2ccc(OCCCCCCN3CCN(CCNc4c5CCCCc5nc5ccccc45)CC3)cc2o1 InChI=1S/C34H42N4O3/c39-33-16-14-26-13-15-27(25-32(26)41-33)40-24-8-2-1-7-18-37-20-22-38(23-21-37)19-17-35-34-28-9-3-5-11-30(28)36-31-12-6-4-10-29(31)34/h3,5,9,11,13-16,25H,1-2,4,6-8,10,12,17-24H2,(H,35,36) HZLYSFRTSCJXAA-UHFFFAOYSA-N 50079516 CHEMBL3417308 Cholinesterase 59 ChEMBL 10.1016/j.ejmech.2015.03.040 10.7270/Q20R9R4H 25812965 Xie, SS; Wang, X; Jiang, N; Yu, W; Wang, KD; Lan, JS; Li, ZR; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079516 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079516&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734721 313073999 CHEMBL3417308 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325815 O=c1ccc2ccc(OCCCCCN3CCN(CCNc4c5CCCCc5nc5ccccc45)CC3)cc2o1 InChI=1S/C33H40N4O3/c38-32-15-13-25-12-14-26(24-31(25)40-32)39-23-7-1-6-17-36-19-21-37(22-20-36)18-16-34-33-27-8-2-4-10-29(27)35-30-11-5-3-9-28(30)33/h2,4,8,10,12-15,24H,1,3,5-7,9,11,16-23H2,(H,34,35) CDBHIFNESFKIAT-UHFFFAOYSA-N 50079517 CHEMBL3417309 Cholinesterase 32 ChEMBL 10.1016/j.ejmech.2015.03.040 10.7270/Q20R9R4H 25812965 Xie, SS; Wang, X; Jiang, N; Yu, W; Wang, KD; Lan, JS; Li, ZR; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079517 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079517&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734722 313074000 CHEMBL3417309 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325816 O=c1ccc2ccc(OCCCCN3CCN(CCNc4c5CCCCc5nc5ccccc45)CC3)cc2o1 InChI=1S/C32H38N4O3/c37-31-14-12-24-11-13-25(23-30(24)39-31)38-22-6-5-16-35-18-20-36(21-19-35)17-15-33-32-26-7-1-3-9-28(26)34-29-10-4-2-8-27(29)32/h1,3,7,9,11-14,23H,2,4-6,8,10,15-22H2,(H,33,34) CSMTZEMMWNIZNM-UHFFFAOYSA-N 50079518 CHEMBL3417310 Cholinesterase 21 ChEMBL 10.1016/j.ejmech.2015.03.040 10.7270/Q20R9R4H 25812965 Xie, SS; Wang, X; Jiang, N; Yu, W; Wang, KD; Lan, JS; Li, ZR; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079518 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079518&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734723 313074001 CHEMBL3417310 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325817 O=c1ccc2ccc(OCCCN3CCN(CCNc4c5CCCCc5nc5ccccc45)CC3)cc2o1 InChI=1S/C31H36N4O3/c36-30-13-11-23-10-12-24(22-29(23)38-30)37-21-5-15-34-17-19-35(20-18-34)16-14-32-31-25-6-1-3-8-27(25)33-28-9-4-2-7-26(28)31/h1,3,6,8,10-13,22H,2,4-5,7,9,14-21H2,(H,32,33) RUDSZRKFTPRYSM-UHFFFAOYSA-N 50079522 CHEMBL3417311 Cholinesterase 16 ChEMBL 10.1016/j.ejmech.2015.03.040 10.7270/Q20R9R4H 25812965 Xie, SS; Wang, X; Jiang, N; Yu, W; Wang, KD; Lan, JS; Li, ZR; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079522 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079522&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734724 103971743 CHEMBL3417311 ZINC26846641 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50325818 O=c1ccc2ccc(OCCN3CCN(CCNc4c5CCCCc5nc5ccccc45)CC3)cc2o1 InChI=1S/C30H34N4O3/c35-29-12-10-22-9-11-23(21-28(22)37-29)36-20-19-34-17-15-33(16-18-34)14-13-31-30-24-5-1-3-7-26(24)32-27-8-4-2-6-25(27)30/h1,3,5,7,9-12,21H,2,4,6,8,13-20H2,(H,31,32) UAPFPZISLYDWMP-UHFFFAOYSA-N 50079523 CHEMBL3417312 Cholinesterase 43 ChEMBL 10.1016/j.ejmech.2015.03.040 10.7270/Q20R9R4H 25812965 Xie, SS; Wang, X; Jiang, N; Yu, W; Wang, KD; Lan, JS; Li, ZR; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079523 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079523&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734725 103971744 CHEMBL3417312 ZINC26847865 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324825 CCN(CC)C(=O)Oc1ccc2C(=O)\C(Oc2c1)=C\c1ccc(OCCN2CCCC2)cc1 InChI=1S/C26H30N2O5/c1-3-28(4-2)26(30)32-21-11-12-22-23(18-21)33-24(25(22)29)17-19-7-9-20(10-8-19)31-16-15-27-13-5-6-14-27/h7-12,17-18H,3-6,13-16H2,1-2H3/b24-17- UTVCDZCTKZXXDB-ULJHMMPZSA-N 50079186 CHEMBL3416661 Cholinesterase 7400 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079186 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079186&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734229 103971506 CHEMBL3416661 ZINC03875324 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324826 CCN(CC)C(=O)Oc1ccc2C(=O)\C(Oc2c1)=C\c1ccc(OCCN(C)C)cc1 InChI=1S/C24H28N2O5/c1-5-26(6-2)24(28)30-19-11-12-20-21(16-19)31-22(23(20)27)15-17-7-9-18(10-8-17)29-14-13-25(3)4/h7-12,15-16H,5-6,13-14H2,1-4H3/b22-15- GKGOKWXKCCVRJO-JCMHNJIXSA-N 50079187 CHEMBL3416660 Cholinesterase 9690 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079187 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079187&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734228 103971507 CHEMBL3416660 ZINC13557240 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324827 COc1cc(\C=C2/Oc3cc(OCCCN(C)C)ccc3C2=O)cc(OC)c1OC InChI=1S/C23H27NO6/c1-24(2)9-6-10-29-16-7-8-17-18(14-16)30-19(22(17)25)11-15-12-20(26-3)23(28-5)21(13-15)27-4/h7-8,11-14H,6,9-10H2,1-5H3/b19-11- CEUNFQKQLDXCCA-ODLFYWEKSA-N 50079188 CHEMBL3416659 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079188 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079188&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734227 103971508 CHEMBL3416659 ZINC13557248 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324828 COc1cc(\C=C2/Oc3cc(OCCN4CCCCC4)ccc3C2=O)cc(OC)c1OC InChI=1S/C25H29NO6/c1-28-22-14-17(15-23(29-2)25(22)30-3)13-21-24(27)19-8-7-18(16-20(19)32-21)31-12-11-26-9-5-4-6-10-26/h7-8,13-16H,4-6,9-12H2,1-3H3/b21-13- QMBDDIDQNMQRSU-BKUYFWCQSA-N 50079189 CHEMBL3416658 Cholinesterase 6150 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079189 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079189&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118723576 103971509 CHEMBL3416658 ZINC01539871 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324829 COc1cc(\C=C2/Oc3cc(OCCN4CCCC4)ccc3C2=O)cc(OC)c1OC InChI=1S/C24H27NO6/c1-27-21-13-16(14-22(28-2)24(21)29-3)12-20-23(26)18-7-6-17(15-19(18)31-20)30-11-10-25-8-4-5-9-25/h6-7,12-15H,4-5,8-11H2,1-3H3/b20-12- YDCOHZVNWJNAOQ-NDENLUEZSA-N 50079190 CHEMBL3416657 Cholinesterase 11700 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079190 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079190&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118723596 103971510 CHEMBL3416657 ZINC13557244 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324830 COc1cc(\C=C2/Oc3cc(OCCN(C)C)ccc3C2=O)cc(OC)c1OC InChI=1S/C22H25NO6/c1-23(2)8-9-28-15-6-7-16-17(13-15)29-18(21(16)24)10-14-11-19(25-3)22(27-5)20(12-14)26-4/h6-7,10-13H,8-9H2,1-5H3/b18-10- BJHZXLAYBFSGPK-ZDLGFXPLSA-N 50079191 CHEMBL3416656 Cholinesterase 66400 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079191 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079191&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734226 103971511 CHEMBL3416656 ZINC13557238 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324831 COc1ccc(\C=C2/Oc3cc(OCCCN(C)C)ccc3C2=O)cc1 InChI=1S/C21H23NO4/c1-22(2)11-4-12-25-17-9-10-18-19(14-17)26-20(21(18)23)13-15-5-7-16(24-3)8-6-15/h5-10,13-14H,4,11-12H2,1-3H3/b20-13- SECCREJMPVMHTJ-MOSHPQCFSA-N 50079192 CHEMBL3416655 Cholinesterase 31200 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079192 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079192&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734225 103971512 CHEMBL3416655 ZINC01535217 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324832 COc1ccc(\C=C2/Oc3cc(OCCN4CCCCC4)ccc3C2=O)cc1 InChI=1S/C23H25NO4/c1-26-18-7-5-17(6-8-18)15-22-23(25)20-10-9-19(16-21(20)28-22)27-14-13-24-11-3-2-4-12-24/h5-10,15-16H,2-4,11-14H2,1H3/b22-15- YWHGWLVJNDHIIG-JCMHNJIXSA-N 50079193 CHEMBL3416654 Cholinesterase 6870 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079193 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079193&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 16450276 103971513 CHEMBL3416654 ZINC03941525 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324833 COc1ccc(\C=C2/Oc3cc(OCCN4CCCC4)ccc3C2=O)cc1 InChI=1S/C22H23NO4/c1-25-17-6-4-16(5-7-17)14-21-22(24)19-9-8-18(15-20(19)27-21)26-13-12-23-10-2-3-11-23/h4-9,14-15H,2-3,10-13H2,1H3/b21-14- FLQHOLJEJWYFMG-STZFKDTASA-N 50079194 CHEMBL3416653 Cholinesterase 7190 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079194 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079194&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118723582 103971514 CHEMBL3416653 ZINC13557242 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324834 COc1ccc(\C=C2/Oc3cc(OCCN(C)C)ccc3C2=O)cc1 InChI=1S/C20H21NO4/c1-21(2)10-11-24-16-8-9-17-18(13-16)25-19(20(17)22)12-14-4-6-15(23-3)7-5-14/h4-9,12-13H,10-11H2,1-3H3/b19-12- NOFSIMUUGOTRKN-UNOMPAQXSA-N 50079195 CHEMBL3416652 Cholinesterase 25300 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079195 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079195&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734224 103971515 CHEMBL3416652 ZINC02007462 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324835 CCN(CC)C(=O)Oc1ccc(\C=C2/Oc3cc(OC)ccc3C2=O)cc1 InChI=1S/C21H21NO5/c1-4-22(5-2)21(24)26-15-8-6-14(7-9-15)12-19-20(23)17-11-10-16(25-3)13-18(17)27-19/h6-13H,4-5H2,1-3H3/b19-12- ICYRWEQDPFNPRE-UNOMPAQXSA-N 50079196 CHEMBL3416651 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079196 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079196&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 8486003 103971516 CHEMBL3416651 ZINC03830689 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324836 COc1ccc2C(=O)\C(Oc2c1)=C\c1ccc(O)cc1 InChI=1S/C16H12O4/c1-19-12-6-7-13-14(9-12)20-15(16(13)18)8-10-2-4-11(17)5-3-10/h2-9,17H,1H3/b15-8- MFVPNDADRDUDMC-NVNXTCNLSA-N 50079197 CHEMBL1807491 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079197 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079197&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 642381 103971517 CHEMBL1807491 ZINC02007464 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324837 COc1ccc(\C=C2/Oc3cc(OC)ccc3C2=O)cc1 InChI=1S/C17H14O4/c1-19-12-5-3-11(4-6-12)9-16-17(18)14-8-7-13(20-2)10-15(14)21-16/h3-10H,1-2H3/b16-9- LNLRZAXYLVIPKL-SXGWCWSVSA-N 50079111 CHEMBL3416650 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079111 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079111&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 907771 313073891 CHEMBL3416650 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324838 COc1ccc2C(=O)\C(Oc2c1)=C\c1ccc(OCCCN(C)C)cc1 InChI=1S/C21H23NO4/c1-22(2)11-4-12-25-16-7-5-15(6-8-16)13-20-21(23)18-10-9-17(24-3)14-19(18)26-20/h5-10,13-14H,4,11-12H2,1-3H3/b20-13- OBFHLDQDSGMVTH-MOSHPQCFSA-N 50079112 CHEMBL3416649 Cholinesterase 30400 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079112 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079112&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734223 313073892 CHEMBL3416649 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324839 COc1ccc2C(=O)\C(Oc2c1)=C\c1ccncc1 InChI=1S/C15H11NO3/c1-18-11-2-3-12-13(9-11)19-14(15(12)17)8-10-4-6-16-7-5-10/h2-9H,1H3/b14-8- MQVJEGMQKVDJJK-ZSOIEALJSA-N 50079113 CHEMBL3416648 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079113 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079113&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 2014946 313073893 CHEMBL3416648 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324840 CCN(CC)c1ccc(\C=C2/Oc3cc(OC)ccc3C2=O)cc1 InChI=1S/C20H21NO3/c1-4-21(5-2)15-8-6-14(7-9-15)12-19-20(22)17-11-10-16(23-3)13-18(17)24-19/h6-13H,4-5H2,1-3H3/b19-12- QACJXCXADOJAAW-UNOMPAQXSA-N 50079114 CHEMBL3416647 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079114 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079114&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 95022115 313073894 CHEMBL3416647 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324841 COc1ccc2C(=O)\C(Oc2c1)=C\c1ccc(cc1)N(C)C InChI=1S/C18H17NO3/c1-19(2)13-6-4-12(5-7-13)10-17-18(20)15-9-8-14(21-3)11-16(15)22-17/h4-11H,1-3H3/b17-10- VYGBDEJXWHUVKT-YVLHZVERSA-N 50079115 CHEMBL3416646 Cholinesterase 31800 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079115 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079115&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 6508873 313073895 CHEMBL3416646 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324842 COc1ccc2C(=O)\C(Oc2c1)=C\c1ccc(OCCN2CCCCC2)cc1 InChI=1S/C23H25NO4/c1-26-19-9-10-20-21(16-19)28-22(23(20)25)15-17-5-7-18(8-6-17)27-14-13-24-11-3-2-4-12-24/h5-10,15-16H,2-4,11-14H2,1H3/b22-15- FTUBSYAHZIJVKZ-JCMHNJIXSA-N 50079116 CHEMBL3416645 Cholinesterase 8870 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079116 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079116&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734222 313073896 CHEMBL3416645 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324843 COc1ccc2C(=O)\C(Oc2c1)=C\c1ccc(OCCN2CCCC2)cc1 InChI=1S/C22H23NO4/c1-25-18-8-9-19-20(15-18)27-21(22(19)24)14-16-4-6-17(7-5-16)26-13-12-23-10-2-3-11-23/h4-9,14-15H,2-3,10-13H2,1H3/b21-14- FLVZBUFTVBOTPA-STZFKDTASA-N 50079117 CHEMBL3416644 Cholinesterase 10200 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079117 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079117&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734221 313073897 CHEMBL3416644 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324844 COc1ccc2C(=O)\C(Oc2c1)=C\c1ccc(OCCN(C)C)cc1 InChI=1S/C20H21NO4/c1-21(2)10-11-24-15-6-4-14(5-7-15)12-19-20(22)17-9-8-16(23-3)13-18(17)25-19/h4-9,12-13H,10-11H2,1-3H3/b19-12- YYJRSQYLLCSWEQ-UNOMPAQXSA-N 50079118 CHEMBL3416643 Cholinesterase 25900 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079118 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079118&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734220 313073898 CHEMBL3416643 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324845 COc1ccc(\C=C2/Oc3cc(O)ccc3C2=O)cc1 InChI=1S/C16H12O4/c1-19-12-5-2-10(3-6-12)8-15-16(18)13-7-4-11(17)9-14(13)20-15/h2-9,17H,1H3/b15-8- CVEOFOQULTXCSE-NVNXTCNLSA-N 50079119 CHEMBL1171364 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079119 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079119&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 732043 313073899 CHEMBL1171364 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324846 CN(C)CCCOc1ccc(\C=C2/Oc3cc(O)ccc3C2=O)cc1 InChI=1S/C20H21NO4/c1-21(2)10-3-11-24-16-7-4-14(5-8-16)12-19-20(23)17-9-6-15(22)13-18(17)25-19/h4-9,12-13,22H,3,10-11H2,1-2H3/b19-12- OEDWPXPAOXLGQV-UNOMPAQXSA-N 50079120 CHEMBL3416642 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079120 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079120&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734219 313073900 CHEMBL3416642 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324847 Oc1ccc2C(=O)\C(Oc2c1)=C\c1ccncc1 InChI=1S/C14H9NO3/c16-10-1-2-11-12(8-10)18-13(14(11)17)7-9-3-5-15-6-4-9/h1-8,16H/b13-7- MJUFOAKHQUTODI-QPEQYQDCSA-N 50079121 CHEMBL3416641 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079121 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079121&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1633582 313073901 CHEMBL3416641 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324848 CCN(CC)c1ccc(\C=C2/Oc3cc(O)ccc3C2=O)cc1 InChI=1S/C19H19NO3/c1-3-20(4-2)14-7-5-13(6-8-14)11-18-19(22)16-10-9-15(21)12-17(16)23-18/h5-12,21H,3-4H2,1-2H3/b18-11- PXAQGRIQPRFKND-WQRHYEAKSA-N 50079122 CHEMBL3416640 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079122 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079122&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 75366689 313073902 CHEMBL3416640 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324849 CN(C)c1ccc(\C=C2/Oc3cc(O)ccc3C2=O)cc1 InChI=1S/C17H15NO3/c1-18(2)12-5-3-11(4-6-12)9-16-17(20)14-8-7-13(19)10-15(14)21-16/h3-10,19H,1-2H3/b16-9- XWVDODMZYGXNEU-SXGWCWSVSA-N 50363409 CHEMBL1946828 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50363409 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50363409&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1523065 136967471 CHEMBL1946828 ZINC12543530 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324850 Oc1ccc2C(=O)\C(Oc2c1)=C\c1ccc(OCCN2CCCCC2)cc1 InChI=1S/C22H23NO4/c24-17-6-9-19-20(15-17)27-21(22(19)25)14-16-4-7-18(8-5-16)26-13-12-23-10-2-1-3-11-23/h4-9,14-15,24H,1-3,10-13H2/b21-14- JFLDOESXEQQPLB-STZFKDTASA-N 50079136 CHEMBL3416639 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079136 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079136&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734218 103971456 CHEMBL3416639 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324851 Oc1ccc2C(=O)\C(Oc2c1)=C\c1ccc(OCCN2CCCC2)cc1 InChI=1S/C21H21NO4/c23-16-5-8-18-19(14-16)26-20(21(18)24)13-15-3-6-17(7-4-15)25-12-11-22-9-1-2-10-22/h3-8,13-14,23H,1-2,9-12H2/b20-13- MRYRTTVACQMTDJ-MOSHPQCFSA-N 50079184 CHEMBL3416638 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079184 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079184&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734217 103971504 CHEMBL3416638 ZINC13557250 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324852 CN(C)CCOc1ccc(\C=C2/Oc3cc(O)ccc3C2=O)cc1 InChI=1S/C19H19NO4/c1-20(2)9-10-23-15-6-3-13(4-7-15)11-18-19(22)16-8-5-14(21)12-17(16)24-18/h3-8,11-12,21H,9-10H2,1-2H3/b18-11- FSPHIOFNOMNIRC-WQRHYEAKSA-N 50079185 CHEMBL3416637 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079185 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079185&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search TF1 2BU5,2BU2 118734216 103971505 CHEMBL3416637 ZINC03941524 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324853 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 10620 (S)-3-(1-(dimethylamino)ethyl)phenyl ethyl(methyl)carbamate::3-((1S)-1-(Dimethylamino)ethyl)phenyl N-ethyl N-methyl carbamate::3-(1-(dimethylamino)ethyl)phenyl ethyl(methyl)carbamate::3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::CHEMBL636::ENA-713::Ethyl-methyl-carbamic acid 3-((R)-1-dimethylamino-ethyl)-phenyl ester::Ethyl-methyl-carbamic acid 3-((S)-1-dimethylamino-ethyl)-phenyl ester::Ethyl-methyl-carbamic acid 3-(1-dimethylamino-ethyl)-phenyl ester::Exelon::Rivastigmine::Rivastigmine (1)::SDZ-212-713::SDZ-ENA-713 Cholinesterase 499 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10620 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10620&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46511221 8874 CHEMBL636 DB00989 6602 C11766 ZINC00004413 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324854 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 3310 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324880 CCN(CC)C(=O)Oc1ccc2C(=O)\C(Oc2c1)=C\c1ccc(OCCN2CCCCC2)cc1 InChI=1S/C27H32N2O5/c1-3-29(4-2)27(31)33-22-12-13-23-24(19-22)34-25(26(23)30)18-20-8-10-21(11-9-20)32-17-16-28-14-6-5-7-15-28/h8-13,18-19H,3-7,14-17H2,1-2H3/b25-18- UZWFCWJJWBZPHJ-BWAHOGKJSA-N 50079213 CHEMBL3416662 Cholinesterase 7170 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079213 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079213&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734230 103971526 CHEMBL3416662 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324881 CCN(CC)C(=O)Oc1ccc2C(=O)\C(Oc2c1)=C\c1ccc(cc1)N(C)C InChI=1S/C22H24N2O4/c1-5-24(6-2)22(26)27-17-11-12-18-19(14-17)28-20(21(18)25)13-15-7-9-16(10-8-15)23(3)4/h7-14H,5-6H2,1-4H3/b20-13- SSZUGUOHWXMKKZ-MOSHPQCFSA-N 50079209 CHEMBL3416663 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079209 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079209&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734231 313073909 CHEMBL3416663 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324882 CCN(CC)C(=O)Oc1ccc2C(=O)\C(Oc2c1)=C\c1ccc(cc1)N(CC)CC InChI=1S/C24H28N2O4/c1-5-25(6-2)18-11-9-17(10-12-18)15-22-23(27)20-14-13-19(16-21(20)30-22)29-24(28)26(7-3)8-4/h9-16H,5-8H2,1-4H3/b22-15- KDOSARFDQHLXCU-JCMHNJIXSA-N 50079208 CHEMBL3416664 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079208 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079208&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734232 313073908 CHEMBL3416664 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324883 CCN(CC)C(=O)Oc1ccc2C(=O)\C(Oc2c1)=C\c1ccc(OCCCN(C)C)cc1 InChI=1S/C25H30N2O5/c1-5-27(6-2)25(29)31-20-12-13-21-22(17-20)32-23(24(21)28)16-18-8-10-19(11-9-18)30-15-7-14-26(3)4/h8-13,16-17H,5-7,14-15H2,1-4H3/b23-16- VMSHYDGJFXDHLJ-KQWNVCNZSA-N 50079207 CHEMBL3416665 Cholinesterase 6096 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079207 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079207&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734233 313073907 CHEMBL3416665 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324884 CCN(CC)C(=O)Oc1ccc2C(=O)\C(Oc2c1)=C\c1ccc(OC)cc1 InChI=1S/C21H21NO5/c1-4-22(5-2)21(24)26-16-10-11-17-18(13-16)27-19(20(17)23)12-14-6-8-15(25-3)9-7-14/h6-13H,4-5H2,1-3H3/b19-12- JFUXZGZNINVQMA-UNOMPAQXSA-N 50079206 CHEMBL3416666 Cholinesterase 12700 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079206 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079206&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 6315979 313073906 CHEMBL3416666 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324885 COc1ccc2C(=O)\C(Oc2c1)=C\c1ccc(OCCN(C)C)c(Cl)c1 InChI=1S/C20H20ClNO4/c1-22(2)8-9-25-17-7-4-13(10-16(17)21)11-19-20(23)15-6-5-14(24-3)12-18(15)26-19/h4-7,10-12H,8-9H2,1-3H3/b19-11- ISNHMCKIKZOYAT-ODLFYWEKSA-N 50079205 CHEMBL3416667 Cholinesterase 11100 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079205 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079205&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734234 313073905 CHEMBL3416667 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324886 Oc1ccc2C(=O)\C(Oc2c1)=C\c1ccc(OCCN2CCCC2)c(Cl)c1 InChI=1S/C21H20ClNO4/c22-17-11-14(3-6-18(17)26-10-9-23-7-1-2-8-23)12-20-21(25)16-5-4-15(24)13-19(16)27-20/h3-6,11-13,24H,1-2,7-10H2/b20-12- VMESENLSNGMGDT-NDENLUEZSA-N 50079204 CHEMBL3416668 Cholinesterase 9920 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079204 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079204&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734235 313073904 CHEMBL3416668 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324887 COc1ccc2C(=O)\C(Oc2c1)=C\c1ccc(OCCN2CCCCC2)c(Cl)c1 InChI=1S/C23H24ClNO4/c1-27-17-6-7-18-21(15-17)29-22(23(18)26)14-16-5-8-20(19(24)13-16)28-12-11-25-9-3-2-4-10-25/h5-8,13-15H,2-4,9-12H2,1H3/b22-14- HQJYIGWZKZCCJR-HMAPJEAMSA-N 50079203 CHEMBL3416669 Cholinesterase 7900 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079203 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079203&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734236 313073903 CHEMBL3416669 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324888 COc1ccc2C(=O)\C(Oc2c1)=C\c1ccc(OCCCN(C)C)c(Cl)c1 InChI=1S/C21H22ClNO4/c1-23(2)9-4-10-26-18-8-5-14(11-17(18)22)12-20-21(24)16-7-6-15(25-3)13-19(16)27-20/h5-8,11-13H,4,9-10H2,1-3H3/b20-12- SVUJCXFPKNGSMJ-NDENLUEZSA-N 50079202 CHEMBL3416670 Cholinesterase 21600 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079202 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079202&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734237 103971522 CHEMBL3416670 ZINC01540212 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324889 COc1ccc2C(=O)\C(Oc2c1)=C\c1ccc(OCCN(C)C)cc1Cl InChI=1S/C20H20ClNO4/c1-22(2)8-9-25-15-5-4-13(17(21)11-15)10-19-20(23)16-7-6-14(24-3)12-18(16)26-19/h4-7,10-12H,8-9H2,1-3H3/b19-10- FLNCSPRFWULPAJ-GRSHGNNSSA-N 50079201 CHEMBL3416671 Cholinesterase 23900 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079201 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079201&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734238 103971521 CHEMBL3416671 ZINC35960272 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324890 Oc1ccc2C(=O)\C(Oc2c1)=C\c1ccc(OCCN2CCCC2)cc1Cl InChI=1S/C21H20ClNO4/c22-18-13-16(26-10-9-23-7-1-2-8-23)5-3-14(18)11-20-21(25)17-6-4-15(24)12-19(17)27-20/h3-6,11-13,24H,1-2,7-10H2/b20-11- BMRIEQZUPRITCT-JAIQZWGSSA-N 50079200 CHEMBL3416672 Cholinesterase 8680 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079200 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079200&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734239 103971520 CHEMBL3416672 ZINC13557239 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324891 COc1ccc2C(=O)\C(Oc2c1)=C\c1ccc(OCCN2CCCCC2)cc1Cl InChI=1S/C23H24ClNO4/c1-27-17-7-8-19-21(15-17)29-22(23(19)26)13-16-5-6-18(14-20(16)24)28-12-11-25-9-3-2-4-10-25/h5-8,13-15H,2-4,9-12H2,1H3/b22-13- GQBIZUJHDXOGIF-XKZIYDEJSA-N 50079199 CHEMBL3416673 Cholinesterase 11400 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079199 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079199&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734240 103971519 CHEMBL3416673 ZINC13557247 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50324892 COc1ccc2C(=O)\C(Oc2c1)=C\c1ccc(OCCCN(C)C)cc1Cl InChI=1S/C21H22ClNO4/c1-23(2)9-4-10-26-16-6-5-14(18(22)12-16)11-20-21(24)17-8-7-15(25-3)13-19(17)27-20/h5-8,11-13H,4,9-10H2,1-3H3/b20-11- BCONBDQETGHVDJ-JAIQZWGSSA-N 50079198 CHEMBL3416674 Cholinesterase 34100 ChEMBL 10.1016/j.ejmech.2015.02.055 10.7270/Q2959K85 25768702 Liew, KF; Chan, KL; Lee, CY Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50079198 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50079198&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118734241 103971518 CHEMBL3416674 ZINC13557246 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50314264 Cc1ccc2n(Cc3cn(Cc4ccc(Cl)cc4)nn3)c3ccccc3c(=O)c2c1 InChI=1S/C24H19ClN4O/c1-16-6-11-23-21(12-16)24(30)20-4-2-3-5-22(20)29(23)15-19-14-28(27-26-19)13-17-7-9-18(25)10-8-17/h2-12,14H,13,15H2,1H3 XCFCTDRCHLMUSN-UHFFFAOYSA-N 50072947 CHEMBL3410483 Cholinesterase 87170 ChEMBL 10.1016/j.ejmech.2015.01.044 10.7270/Q2XD13CP 25636055 Mohammadi-Khanaposhtani, M; Saeedi, M; Zafarghandi, NS; Mahdavi, M; Sabourian, R; Razkenari, EK; Alinezhad, H; Khanavi, M; Foroumadi, A; Shafiee, A; Akbarzadeh, T Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50072947 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50072947&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118732418 313072730 CHEMBL3410483 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50332375 C[n+]1ccc2c(c1)[nH]c1ccccc21 InChI=1S/C12H10N2/c1-14-7-6-10-9-4-2-3-5-11(9)13-12(10)8-14/h2-8H,1H3/p+1 UDHBHTHWWOQPBW-UHFFFAOYSA-O 50269614 2-Methyl-beta-carboline-2-ium iodide::2-methyl-2H-pyrido[3,4-b]indole hydroiodide::2-methylnorharmane iodide::CHEMBL455600 Cholinesterase 11200 ChEMBL 10.1021/np050312l 10.7270/Q2K9378M 16378379 Becher, PG; Beuchat, J; Gademann, K; Juttner, F University of Zürich http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50269614 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50269614&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3036890 104115231 CHEMBL455600 ZINC00394500 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50332376 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 16900 ChEMBL 10.1021/np050312l 10.7270/Q2K9378M 16378379 Becher, PG; Beuchat, J; Gademann, K; Juttner, F University of Zürich http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50332377 C[n+]1ccc2c(c1)[nH]c1ccc(Cl)cc21 InChI=1S/C12H9ClN2/c1-15-5-4-9-10-6-8(13)2-3-11(10)14-12(9)7-15/h2-7H,1H3/p+1 RGQUDRQSJYJYAQ-UHFFFAOYSA-O 50263009 CHEMBL499836::Nostacarboline iodide::Nostocarboline::nostocarboline Hydroiodide Cholinesterase 19400 ChEMBL 10.1021/np050312l 10.7270/Q2K9378M 16378379 Becher, PG; Beuchat, J; Gademann, K; Juttner, F University of Zürich http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50263009 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50263009&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5326150 104111511 CHEMBL499836 ZINC33836455 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351108 Cl.COc1cccc(CN(C)Cc2ccc(COc3ccc4ccc(=O)oc4c3)cc2)c1 InChI=1S/C26H25NO4.ClH/c1-27(17-21-4-3-5-23(14-21)29-2)16-19-6-8-20(9-7-19)18-30-24-12-10-22-11-13-26(28)31-25(22)15-24;/h3-15H,16-18H2,1-2H3;1H IXBBUEYRHWKCRC-UHFFFAOYSA-N 50093228 CHEMBL3586597 Cholinesterase 1400 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093228 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093228&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180440 103991228 CHEMBL3586597 ZINC26472343 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351109 Cl.CN(Cc1ccc(COc2ccc3ccc(=O)oc3c2)cc1)Cc1cccc(Cl)c1 InChI=1S/C19H17NO/c1-2-4-16-17-6-3-5-14-9-12-18(20(14)17)19(16)13-7-10-15(21)11-8-13/h3,5-12,21H,2,4H2,1H3 NWVZDYUELJBXMB-UHFFFAOYSA-N 50093229 CHEMBL3586598 Cholinesterase 1200 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093229 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093229&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180442 103991229 CHEMBL3586598 ZINC26472356 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351110 Cl.CN(Cc1ccc(COc2ccc3ccc(=O)oc3c2)cc1)Cc1ccc(cc1)C#N InChI=1S/C18H15NO/c1-2-15-16-8-4-6-13-9-10-17(19(13)16)18(15)12-5-3-7-14(20)11-12/h3-11,20H,2H2,1H3 LWWQDBGGSCYYQL-UHFFFAOYSA-N 50093230 CHEMBL3586602 Cholinesterase 4400 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093230 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093230&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180450 103991230 CHEMBL3586602 ZINC26476325 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351111 Cl.CN(Cc1ccccc1)Cc1ccc(COc2ccc3cc(C#N)c(=O)oc3c2)cc1 InChI=1S/C26H22N2O3.ClH/c1-28(16-19-5-3-2-4-6-19)17-20-7-9-21(10-8-20)18-30-24-12-11-22-13-23(15-27)26(29)31-25(22)14-24;/h2-14H,16-18H2,1H3;1H ATGYEALLAZPYKJ-UHFFFAOYSA-N 50093231 CHEMBL3586606 Cholinesterase 5500 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093231 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093231&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180458 103991231 CHEMBL3586606 ZINC26472313 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351112 Cl.CN(Cc1ccccc1)Cc1ccc(COc2ccc3c(CO)cc(=O)oc3c2)cc1 InChI=1S/C17H13NO/c1-11-15-4-2-3-13-7-10-16(18(13)15)17(11)12-5-8-14(19)9-6-12/h2-10,19H,1H3 USTALMYDYGSTPY-UHFFFAOYSA-N 50093227 CHEMBL3586608 Cholinesterase 1100 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093227 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093227&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180462 103991227 CHEMBL3586608 ZINC26402808 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351113 OCc1cc(=O)oc2cc(OCc3ccc(CNCc4ccccc4)cc3)ccc12 InChI=1S/C25H23NO4/c27-16-21-12-25(28)30-24-13-22(10-11-23(21)24)29-17-20-8-6-19(7-9-20)15-26-14-18-4-2-1-3-5-18/h1-13,26-27H,14-17H2 MRXZYTKUUZVUNY-UHFFFAOYSA-N 50093232 CHEMBL3586609 Cholinesterase 570 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093232 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093232&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180464 103991232 CHEMBL3586609 ZINC26480324 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351114 Cl.CN(Cc1ccc(COc2ccc3c(CO)cc(=O)oc3c2)cc1)Cc1cccc(Cl)c1 InChI=1S/C18H15NO2/c1-2-15-17-10-14(21)9-12-5-8-16(19(12)17)18(15)11-3-6-13(20)7-4-11/h3-10,20-21H,2H2,1H3 RHDBRQBCMWHOTA-UHFFFAOYSA-N 50093233 CHEMBL3586610 Cholinesterase 630 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093233 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093233&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180465 103991233 CHEMBL3586610 ZINC26400245 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351217 Cl.CN(CCc1ccc(COc2ccc3ccc(=O)oc3c2)cc1)Cc1ccccc1 InChI=1S/C19H17NO/c1-12(2)18-16-5-3-4-14-8-11-17(20(14)16)19(18)13-6-9-15(21)10-7-13/h3-12,21H,1-2H3 RRPVQZIMLQQCGW-UHFFFAOYSA-N 50093234 CHEMBL3586612 Cholinesterase 520 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093234 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093234&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180469 103991234 CHEMBL3586612 ZINC26472349 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351218 Cl.O=c1ccc2ccc(OCc3ccc(CCNCc4ccccc4)cc3)cc2o1 InChI=1S/C18H15NO/c1-2-13-14-10-11-17(20)15-8-9-16(19(14)15)18(13)12-6-4-3-5-7-12/h3-11,20H,2H2,1H3 GRNVUOXPXBQXQR-UHFFFAOYSA-N 50093235 CHEMBL3586613 Cholinesterase 640 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093235 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093235&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180471 103991235 CHEMBL3586613 ZINC26400606 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351219 CN(Cc1ccccc1)Cc1ccc(COc2ccc3ccc(=O)[nH]c3c2)cc1 InChI=1S/C25H24N2O2.ClH/c1-27(16-19-5-3-2-4-6-19)17-20-7-9-21(10-8-20)18-29-23-13-11-22-12-14-25(28)26-24(22)15-23;/h2-15H,16-18H2,1H3,(H,26,28);1H NMEDFURLWYWCMS-UHFFFAOYSA-N 50093083 CHEMBL3586614 Cholinesterase 1700 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093083 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093083&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122362987 318473370 CHEMBL3586614 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351308 Cl.CN(CCCOc1ccc2c(C)c(C)c(=O)oc2c1)Cc1ccccc1 InChI=1S/C18H15NO/c1-2-15-17-11-14(20)10-13-8-9-16(19(13)17)18(15)12-6-4-3-5-7-12/h3-11,20H,2H2,1H3 ICBNFMZZQJJWOQ-UHFFFAOYSA-N 50093240 CHEMBL3586574 Cholinesterase 7800 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093240 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093240&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180400 103991240 CHEMBL3586574 ZINC26468961 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351309 Cl.CCN(CCCOc1ccc2c(C)c(C)c(=O)oc2c1)Cc1ccccc1 InChI=1S/C18H15NO2/c1-2-13-14-9-10-17(21)15-7-8-16(19(14)15)18(13)11-3-5-12(20)6-4-11/h3-10,20-21H,2H2,1H3 IOHWQOBDRDHMNK-UHFFFAOYSA-N 50093239 CHEMBL3586575 Cholinesterase 4000 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093239 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093239&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180402 103991239 CHEMBL3586575 ZINC26468964 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351310 CN(CCCCOc1ccc2c(C)c(C)c(=O)oc2c1)Cc1ccccc1 InChI=1S/C16H11NO/c18-14-7-4-11(5-8-14)15-10-13-3-1-2-12-6-9-16(15)17(12)13/h1-10,18H LCEPYIFGJXRMJI-UHFFFAOYSA-N 50093236 CHEMBL3586576 Cholinesterase 3700 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093236 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093236&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180404 103991236 CHEMBL3586576 ZINC26469515 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351311 Cc1c(C)c(=O)oc2cc(OCCCCCNCc3ccccc3)ccc12 InChI=1S/C23H27NO3.ClH/c1-17-18(2)23(25)27-22-15-20(11-12-21(17)22)26-14-8-4-7-13-24-16-19-9-5-3-6-10-19;/h3,5-6,9-12,15,24H,4,7-8,13-14,16H2,1-2H3;1H PYWSNNOUDNPDGL-UHFFFAOYSA-N 50093084 CHEMBL3586577 Cholinesterase 1800 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093084 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093084&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180406 318473371 CHEMBL3586577 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351312 CN(CCCCCOc1ccc2c(C)c(C)c(=O)oc2c1)Cc1ccccc1 InChI=1S/C19H17NO2/c1-2-16-18(12-4-8-15(22)9-5-12)17-10-7-14-6-3-13(11-21)19(16)20(14)17/h3-10,21-22H,2,11H2,1H3 GVXFBHALBAOQGF-UHFFFAOYSA-N 50093241 CHEMBL3586578 Cholinesterase 2800 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093241 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093241&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180407 103991241 CHEMBL3586578 ZINC26400597 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351313 Cl.CN(CCCCCOc1ccc2c(C)c(C)c(=O)oc2c1)Cc1cccc(c1)C#N InChI=1S/C25H28N2O3.ClH/c1-18-19(2)25(28)30-24-15-22(10-11-23(18)24)29-13-6-4-5-12-27(3)17-21-9-7-8-20(14-21)16-26;/h7-11,14-15H,4-6,12-13,17H2,1-3H3;1H ZLHRHDLKUORYQW-UHFFFAOYSA-N 50093242 CHEMBL3586579 Cholinesterase 4100 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093242 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093242&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180408 103991242 CHEMBL3586579 ZINC40688895 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351314 Cl.CN(CCCCCOc1ccc2c(C)c(C)c(=O)oc2c1)Cc1cccc(Cl)c1 InChI=1S/C24H28ClNO3.ClH/c1-17-18(2)24(27)29-23-15-21(10-11-22(17)23)28-13-6-4-5-12-26(3)16-19-8-7-9-20(25)14-19;/h7-11,14-15H,4-6,12-13,16H2,1-3H3;1H YQMKIZJMPGFZQH-UHFFFAOYSA-N 50093243 CHEMBL3585361 Cholinesterase 2600 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093243 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093243&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180410 103991243 CHEMBL3585361 ZINC40454280 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351315 Cl.CN(CCCCCOc1ccc2c(C)c(C)c(=O)oc2c1)Cc1ccc(cc1)C#N InChI=1S/C25H28N2O3.ClH/c1-18-19(2)25(28)30-24-15-22(11-12-23(18)24)29-14-6-4-5-13-27(3)17-21-9-7-20(16-26)8-10-21;/h7-12,15H,4-6,13-14,17H2,1-3H3;1H AZLFSFYDLOQSRV-UHFFFAOYSA-N 50093244 CHEMBL3586580 Cholinesterase 4300 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093244 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093244&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180412 103991244 CHEMBL3586580 ZINC40449331 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351316 Cl.CCN(CCCCCOc1ccc2c(C)c(C)c(=O)oc2c1)Cc1ccccc1 InChI=1S/C25H31NO3.ClH/c1-4-26(18-21-11-7-5-8-12-21)15-9-6-10-16-28-22-13-14-23-19(2)20(3)25(27)29-24(23)17-22;/h5,7-8,11-14,17H,4,6,9-10,15-16,18H2,1-3H3;1H UNFRTDRMFBESNA-UHFFFAOYSA-N 50093245 CHEMBL3586581 Cholinesterase 940 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093245 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093245&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180414 103991245 CHEMBL3586581 ZINC33751434 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351317 CN(CCCCCCOc1ccc2c(C)c(C)c(=O)oc2c1)Cc1ccccc1 InChI=1S/C25H31NO3/c1-19-20(2)25(27)29-24-17-22(13-14-23(19)24)28-16-10-5-4-9-15-26(3)18-21-11-7-6-8-12-21/h6-8,11-14,17H,4-5,9-10,15-16,18H2,1-3H3 QGRBYVLSFDOHSR-UHFFFAOYSA-N 50093085 CHEMBL3586582 Cholinesterase 670 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093085 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093085&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180416 318473372 CHEMBL3586582 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351318 Cl.CCN(CCCCCCOc1ccc2c(C)c(C)c(=O)oc2c1)Cc1ccccc1 InChI=1S/C26H33NO3.ClH/c1-4-27(19-22-12-8-7-9-13-22)16-10-5-6-11-17-29-23-14-15-24-20(2)21(3)26(28)30-25(24)18-23;/h7-9,12-15,18H,4-6,10-11,16-17,19H2,1-3H3;1H OBKRRCVVXDEWRI-UHFFFAOYSA-N 50093237 CHEMBL3586583 Cholinesterase 490 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093237 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093237&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180417 103991237 CHEMBL3586583 ZINC26481758 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351319 CN(C)Cc1cccc(COc2ccc3ccc(=O)oc3c2)c1 InChI=1S/C19H19NO3/c1-20(2)12-14-4-3-5-15(10-14)13-22-17-8-6-16-7-9-19(21)23-18(16)11-17/h3-11H,12-13H2,1-2H3 BJJAQIXSDADLGQ-UHFFFAOYSA-N 50093246 CHEMBL3586584 Cholinesterase 5300 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093246 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093246&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180419 103991246 CHEMBL3586584 ZINC96299766 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351320 CCN(CC)Cc1cccc(COc2ccc3ccc(=O)oc3c2)c1 InChI=1S/C21H23NO3.ClH/c1-3-22(4-2)14-16-6-5-7-17(12-16)15-24-19-10-8-18-9-11-21(23)25-20(18)13-19;/h5-13H,3-4,14-15H2,1-2H3;1H SIOGOPGONAWXNK-UHFFFAOYSA-N 50093338 CHEMBL3586585 Cholinesterase 6800 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093338 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093338&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180421 318473383 CHEMBL3586585 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351321 CN(Cc1ccccc1)Cc1cccc(COc2ccc3ccc(=O)oc3c2)c1 InChI=1S/C25H23NO3/c1-26(16-19-6-3-2-4-7-19)17-20-8-5-9-21(14-20)18-28-23-12-10-22-11-13-25(27)29-24(22)15-23/h2-15H,16-18H2,1H3 ZORXOJUGHAEHCN-UHFFFAOYSA-N 50093247 CHEMBL3586586 Cholinesterase 1000 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093247 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093247&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180422 103991247 CHEMBL3586586 ZINC96299770 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351322 Cl.CN(Cc1cccc(COc2ccc3ccc(=O)oc3c2)c1)Cc1cccc(c1)C#N InChI=1S/C26H22N2O3.ClH/c1-28(16-20-5-2-4-19(12-20)15-27)17-21-6-3-7-22(13-21)18-30-24-10-8-23-9-11-26(29)31-25(23)14-24;/h2-14H,16-18H2,1H3;1H OMTVFRBSDXUJDS-UHFFFAOYSA-N 50093248 CHEMBL3586587 Cholinesterase 2800 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093248 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093248&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180423 103991248 CHEMBL3586587 ZINC40449270 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351323 Cl.COc1cccc(CN(C)Cc2cccc(COc3ccc4ccc(=O)oc4c3)c2)c1 InChI=1S/C30H48N10O24P4S4/c31-23-17-25(35-13-33-23)39(27-21(43)19(41)15(61-27)11-59-67(51,52)63-65(45,46)47)29(37-17)69-5-9-71(55,56)7-3-1-2-4-8-72(57,58)10-6-70-30-38-18-24(32)34-14-36-26(18)40(30)28-22(44)20(42)16(62-28)12-60-68(53,54)64-66(48,49)50/h13-16,19-22,27-28,41-44H,1-12H2,(H,51,52)(H,53,54)(H2,31,33,35)(H2,32,34,36)(H2,45,46,47)(H2,48,49,50)/t15-,16?,19?,20?,21?,22?,27?,28?/m1/s1 IDJSFSDIKIOUHJ-JLEDZTQVSA-N 50093249 CHEMBL3586588 Cholinesterase 880 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093249 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093249&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180425 103991249 CHEMBL3586588 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351324 Cl.CN(Cc1cccc(Cl)c1)Cc1cccc(COc2ccc3ccc(=O)oc3c2)c1 InChI=1S/C30H48N10O24P4S4/c31-23-19-24(34-14-33-23)40(27-22(43)21(42)17(62-27)13-60-68(53,54)64-66(48,49)50)30(35-19)70-6-10-72(57,58)8-4-2-1-3-7-71(55,56)9-5-69-29-36-20-25(37-28(32)38-26(20)44)39(29)18-11-15(41)16(61-18)12-59-67(51,52)63-65(45,46)47/h14-18,21-22,27,41-43H,1-13H2,(H,51,52)(H,53,54)(H2,31,33,34)(H2,45,46,47)(H2,48,49,50)(H3,32,37,38,44)/t15?,16-,17?,18?,21?,22?,27?/m1/s1 GXAOOOMHTMVZGM-LPXRHJKGSA-N 50093250 CHEMBL3586589 Cholinesterase 310 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093250 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093250&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180427 103991250 CHEMBL3586589 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351325 CN(C)Cc1ccc(COc2ccc3ccc(=O)oc3c2)cc1 InChI=1S/C19H19NO3/c1-20(2)12-14-3-5-15(6-4-14)13-22-17-9-7-16-8-10-19(21)23-18(16)11-17/h3-11H,12-13H2,1-2H3 SGYSVNJKADRKNW-UHFFFAOYSA-N 50093294 CHEMBL3586590 Cholinesterase 240 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093294 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093294&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180429 103991294 CHEMBL3586590 ZINC13834435 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351326 CCN(CC)Cc1ccc(COc2ccc3ccc(=O)oc3c2)cc1 InChI=1S/C21H23NO3/c1-3-22(4-2)14-16-5-7-17(8-6-16)15-24-19-11-9-18-10-12-21(23)25-20(18)13-19/h5-13H,3-4,14-15H2,1-2H3 MNGOFMXNXZCRBX-UHFFFAOYSA-N 50093339 CHEMBL3586591 Cholinesterase 3400 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093339 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093339&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180430 318473384 CHEMBL3586591 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351327 CN(Cc1ccccc1)Cc1ccc(COc2ccc3ccc(=O)oc3c2)cc1 InChI=1S/C28H42N4O4/c33-25-13-10-24(22-26(25)34)12-15-28(36)32-21-7-19-30-17-5-4-16-29-18-6-20-31-27(35)14-11-23-8-2-1-3-9-23/h1-3,8-10,13,22,29-30,33-34H,4-7,11-12,14-21H2,(H,31,35)(H,32,36) LIIYKTUWAKPTPG-UHFFFAOYSA-N 50093212 CHEMBL3586592 Cholinesterase 11000 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093212 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093212&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180431 103991212 CHEMBL3586592 ZINC26471200 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351328 Cl.CN(Cc1ccccc1)Cc1ccc(COc2ccc3cc(C)c(=O)oc3c2)cc1 InChI=1S/C26H25NO3.ClH/c1-19-14-23-12-13-24(15-25(23)30-26(19)28)29-18-22-10-8-21(9-11-22)17-27(2)16-20-6-4-3-5-7-20;/h3-15H,16-18H2,1-2H3;1H XLSLYAQVOOFDSE-UHFFFAOYSA-N 50093295 CHEMBL3586593 Cholinesterase 1100 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093295 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093295&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180432 103991295 CHEMBL3586593 ZINC13834441 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351329 CN(Cc1ccccc1)Cc1ccc(COc2ccc3c(C)cc(=O)oc3c2)cc1 InChI=1S/C26H25NO3.ClH/c1-19-14-26(28)30-25-15-23(12-13-24(19)25)29-18-22-10-8-21(9-11-22)17-27(2)16-20-6-4-3-5-7-20;/h3-15H,16-18H2,1-2H3;1H GDOQYXLNAKCFNO-UHFFFAOYSA-N 50093322 CHEMBL3586594 Cholinesterase 1000 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093322 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093322&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180435 318473373 CHEMBL3586594 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351330 Cl.CN(Cc1ccccc1)Cc1ccc(COc2ccc3c(C)c(C)c(=O)oc3c2)cc1 InChI=1S/C27H27NO3.ClH/c1-19-20(2)27(29)31-26-15-24(13-14-25(19)26)30-18-23-11-9-22(10-12-23)17-28(3)16-21-7-5-4-6-8-21;/h4-15H,16-18H2,1-3H3;1H MBKAOIVYJASVAB-UHFFFAOYSA-N 50093238 CHEMBL3586595 Cholinesterase 690 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093238 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093238&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180436 103991238 CHEMBL3586595 ZINC26481793 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50351331 CN(Cc1ccc(COc2ccc3ccc(=O)oc3c2)cc1)Cc1cccc(c1)C#N InChI=1S/C26H22N2O3.ClH/c1-28(17-22-4-2-3-21(13-22)15-27)16-19-5-7-20(8-6-19)18-30-24-11-9-23-10-12-26(29)31-25(23)14-24;/h2-14H,16-18H2,1H3;1H VHJILQRALCXVPC-UHFFFAOYSA-N 50093323 CHEMBL3586596 Cholinesterase 4100 ChEMBL 10.1021/acs.jmedchem.5b00599 10.7270/Q26T0PCZ 26107513 Farina, R; Pisani, L; Catto, M; Nicolotti, O; Gadaleta, D; Denora, N; Soto-Otero, R; Mendez-Alvarez, E; Passos, CS; Muncipinto, G; Altomare, CD; Nurisso, A; Carrupt, PA; Carotti, A Universit£ degli Studi di Bari"Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50093323 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50093323&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122180439 318473374 CHEMBL3586596 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50353661 N[C@@H](CO)C(O)=O InChI=1S/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1 MTCFGRXMJLQNBG-REOHCLBHSA-N 50357212 (L)-SERINE::Serine Cholinesterase 16 ChEMBL 10.1016/j.bmcl.2015.04.086 10.7270/Q2KW5HS8 25980913 Heller, L; Schwarz, S; Obernauer, A; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50357212 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50357212&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search SEG 5951 136961236 17822 DB00133 C00065 ZINC00895034 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50367822 CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12 50099603 CHEMBL3343932 Cholinesterase 6.2 ChEMBL 10.1016/j.bmc.2014.08.035 10.7270/Q2M61N1Z 25282654 Lan, JS; Xie, SS; Li, SY; Pan, LF; Wang, XB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50099603 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50099603&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118717434 318490638 CHEMBL3343932 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50367823 N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12 50099602 CHEMBL3343931 Cholinesterase 11 ChEMBL 10.1016/j.bmc.2014.08.035 10.7270/Q2M61N1Z 25282654 Lan, JS; Xie, SS; Li, SY; Pan, LF; Wang, XB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50099602 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50099602&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118717433 318490637 CHEMBL3343931 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50367824 Cc1nc(cc2c3ccccc3[nH]c12)C(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C32H35N5O/c1-21-30-25(22-12-4-7-15-26(22)37-30)20-29(35-21)32(38)34-19-11-3-2-10-18-33-31-23-13-5-8-16-27(23)36-28-17-9-6-14-24(28)31/h4-5,7-8,12-13,15-16,20,37H,2-3,6,9-11,14,17-19H2,1H3,(H,33,36)(H,34,38) OOCKQJHRJFDPCK-UHFFFAOYSA-N 50099570 CHEMBL3343885 Cholinesterase 94 ChEMBL 10.1016/j.bmc.2014.08.035 10.7270/Q2M61N1Z 25282654 Lan, JS; Xie, SS; Li, SY; Pan, LF; Wang, XB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50099570 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50099570&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118717408 103996439 CHEMBL3343885 ZINC29309163 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50367825 CC1N[C@@H](Cc2c1[nH]c1ccccc21)C(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12 50099600 CHEMBL3343929 Cholinesterase 240 ChEMBL 10.1016/j.bmc.2014.08.035 10.7270/Q2M61N1Z 25282654 Lan, JS; Xie, SS; Li, SY; Pan, LF; Wang, XB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50099600 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50099600&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118717431 318490635 CHEMBL3343929 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50367826 CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12 50099601 CHEMBL3343930 Cholinesterase 4.3 ChEMBL 10.1016/j.bmc.2014.08.035 10.7270/Q2M61N1Z 25282654 Lan, JS; Xie, SS; Li, SY; Pan, LF; Wang, XB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50099601 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50099601&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118717432 318490636 CHEMBL3343930 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50367827 O=C(NCCCCCCNc1c2CCCCc2nc2ccccc12)c1cc2c3ccccc3[nH]c2c(n1)-c1ccccc1 InChI=1S/C37H37N5O/c43-37(33-24-29-26-16-6-9-19-30(26)41-36(29)34(42-33)25-14-4-3-5-15-25)39-23-13-2-1-12-22-38-35-27-17-7-10-20-31(27)40-32-21-11-8-18-28(32)35/h3-7,9-10,14-17,19-20,24,41H,1-2,8,11-13,18,21-23H2,(H,38,40)(H,39,43) XKKFXCKMPXLPKK-UHFFFAOYSA-N 50099592 CHEMBL3343923 Cholinesterase 129 ChEMBL 10.1016/j.bmc.2014.08.035 10.7270/Q2M61N1Z 25282654 Lan, JS; Xie, SS; Li, SY; Pan, LF; Wang, XB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50099592 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50099592&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118717426 318490627 CHEMBL3343923 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50367828 Fc1ccc(cc1)-c1nc(cc2c3ccccc3[nH]c12)C(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C37H36FN5O/c38-25-19-17-24(18-20-25)34-36-29(26-11-3-6-14-30(26)42-36)23-33(43-34)37(44)40-22-10-2-1-9-21-39-35-27-12-4-7-15-31(27)41-32-16-8-5-13-28(32)35/h3-4,6-7,11-12,14-15,17-20,23,42H,1-2,5,8-10,13,16,21-22H2,(H,39,41)(H,40,44) WKAJCZZPMZGMDI-UHFFFAOYSA-N 50099594 CHEMBL3343924 Cholinesterase 205 ChEMBL 10.1016/j.bmc.2014.08.035 10.7270/Q2M61N1Z 25282654 Lan, JS; Xie, SS; Li, SY; Pan, LF; Wang, XB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50099594 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50099594&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118717427 318490629 CHEMBL3343924 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50367829 O=C(NCCCCCCNc1c2CCCCc2nc2ccccc12)c1cc2c(cn1)[nH]c1ccccc21 InChI=1S/C31H33N5O/c37-31(28-19-24-21-11-3-6-14-25(21)36-29(24)20-34-28)33-18-10-2-1-9-17-32-30-22-12-4-7-15-26(22)35-27-16-8-5-13-23(27)30/h3-4,6-7,11-12,14-15,19-20,36H,1-2,5,8-10,13,16-18H2,(H,32,35)(H,33,37) OLKLOVAJULLISR-UHFFFAOYSA-N 50099591 CHEMBL3343922 Cholinesterase 41 ChEMBL 10.1016/j.bmc.2014.08.035 10.7270/Q2M61N1Z 25282654 Lan, JS; Xie, SS; Li, SY; Pan, LF; Wang, XB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50099591 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50099591&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118717425 318490626 CHEMBL3343922 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50367830 Cc1nc(cc2c3ccccc3[nH]c12)C(=O)NCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C28H27N5O/c1-17-26-21(18-8-2-5-11-22(18)33-26)16-25(31-17)28(34)30-15-14-29-27-19-9-3-6-12-23(19)32-24-13-7-4-10-20(24)27/h2-3,5-6,8-9,11-12,16,33H,4,7,10,13-15H2,1H3,(H,29,32)(H,30,34) ONXBROBTQDOBSV-UHFFFAOYSA-N 50099589 CHEMBL3343883 Cholinesterase 539 ChEMBL 10.1016/j.bmc.2014.08.035 10.7270/Q2M61N1Z 25282654 Lan, JS; Xie, SS; Li, SY; Pan, LF; Wang, XB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50099589 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50099589&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118717406 318490624 CHEMBL3343883 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50367831 O=C(NCCCCCCNc1c2CCCCc2nc2ccccc12)[C@@H]1Cc2c(CN1)[nH]c1ccccc21 50099598 CHEMBL3343927 Cholinesterase 40 ChEMBL 10.1016/j.bmc.2014.08.035 10.7270/Q2M61N1Z 25282654 Lan, JS; Xie, SS; Li, SY; Pan, LF; Wang, XB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50099598 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50099598&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 87056148 318490633 CHEMBL3343927 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50367832 Cc1nc(cc2c3ccccc3[nH]c12)C(=O)NCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C30H31N5O/c1-19-28-23(20-10-2-5-13-24(20)35-28)18-27(33-19)30(36)32-17-9-8-16-31-29-21-11-3-6-14-25(21)34-26-15-7-4-12-22(26)29/h2-3,5-6,10-11,13-14,18,35H,4,7-9,12,15-17H2,1H3,(H,31,34)(H,32,36) XEPUHYVPCYWYRB-UHFFFAOYSA-N 50099595 CHEMBL3343884 Cholinesterase 158 ChEMBL 10.1016/j.bmc.2014.08.035 10.7270/Q2M61N1Z 25282654 Lan, JS; Xie, SS; Li, SY; Pan, LF; Wang, XB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50099595 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50099595&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118717407 318490630 CHEMBL3343884 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50367833 CC1N([C@@H](Cc2c1[nH]c1ccccc21)C(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12)C(=O)OC(C)(C)C 50099599 CHEMBL3343928 Cholinesterase 22 ChEMBL 10.1016/j.bmc.2014.08.035 10.7270/Q2M61N1Z 25282654 Lan, JS; Xie, SS; Li, SY; Pan, LF; Wang, XB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50099599 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50099599&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118717430 318490634 CHEMBL3343928 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50367836 COc1ccc(cc1)-c1nc(cc2c3ccccc3[nH]c12)C(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C38H39N5O2/c1-45-26-20-18-25(19-21-26)35-37-30(27-12-4-7-15-31(27)42-37)24-34(43-35)38(44)40-23-11-3-2-10-22-39-36-28-13-5-8-16-32(28)41-33-17-9-6-14-29(33)36/h4-5,7-8,12-13,15-16,18-21,24,42H,2-3,6,9-11,14,17,22-23H2,1H3,(H,39,41)(H,40,44) ZXEXKQSBZMYPAQ-UHFFFAOYSA-N 50099569 CHEMBL3343925 Cholinesterase 329 ChEMBL 10.1016/j.bmc.2014.08.035 10.7270/Q2M61N1Z 25282654 Lan, JS; Xie, SS; Li, SY; Pan, LF; Wang, XB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50099569 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50099569&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118717428 318490619 CHEMBL3343925 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50367837 CCc1nc(cc2c3ccccc3[nH]c12)C(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C33H37N5O/c1-2-26-32-25(22-13-5-8-16-27(22)38-32)21-30(36-26)33(39)35-20-12-4-3-11-19-34-31-23-14-6-9-17-28(23)37-29-18-10-7-15-24(29)31/h5-6,8-9,13-14,16-17,21,38H,2-4,7,10-12,15,18-20H2,1H3,(H,34,37)(H,35,39) WUZJRHKAIFSDMM-UHFFFAOYSA-N 50099596 CHEMBL3343882 Cholinesterase 97 ChEMBL 10.1016/j.bmc.2014.08.035 10.7270/Q2M61N1Z 25282654 Lan, JS; Xie, SS; Li, SY; Pan, LF; Wang, XB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50099596 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50099596&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118717405 318490631 CHEMBL3343882 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50367838 CC(C)(C)OC(=O)N1Cc2[nH]c3ccccc3c2C[C@H]1C(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12 50099597 CHEMBL3343926 Cholinesterase 7.5 ChEMBL 10.1016/j.bmc.2014.08.035 10.7270/Q2M61N1Z 25282654 Lan, JS; Xie, SS; Li, SY; Pan, LF; Wang, XB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50099597 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50099597&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118717429 318490632 CHEMBL3343926 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50367842 Cc1nc(cc2c3ccccc3[nH]c12)C(=O)NCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C34H39N5O/c1-23-32-27(24-14-6-9-17-28(24)39-32)22-31(37-23)34(40)36-21-13-5-3-2-4-12-20-35-33-25-15-7-10-18-29(25)38-30-19-11-8-16-26(30)33/h6-7,9-10,14-15,17-18,22,39H,2-5,8,11-13,16,19-21H2,1H3,(H,35,38)(H,36,40) QWENAWZBDMGXSP-UHFFFAOYSA-N 50099590 CHEMBL3343920 Cholinesterase 245 ChEMBL 10.1016/j.bmc.2014.08.035 10.7270/Q2M61N1Z 25282654 Lan, JS; Xie, SS; Li, SY; Pan, LF; Wang, XB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50099590 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50099590&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118717423 318490625 CHEMBL3343920 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50367844 Cc1nc(cc2c3ccccc3[nH]c12)C(=O)NCCCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C36H43N5O/c1-25-34-29(26-16-8-11-19-30(26)41-34)24-33(39-25)36(42)38-23-15-7-5-3-2-4-6-14-22-37-35-27-17-9-12-20-31(27)40-32-21-13-10-18-28(32)35/h8-9,11-12,16-17,19-20,24,41H,2-7,10,13-15,18,21-23H2,1H3,(H,37,40)(H,38,42) PBXMVNNJJHHBCU-UHFFFAOYSA-N 50099593 CHEMBL3343921 Cholinesterase 364 ChEMBL 10.1016/j.bmc.2014.08.035 10.7270/Q2M61N1Z 25282654 Lan, JS; Xie, SS; Li, SY; Pan, LF; Wang, XB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50099593 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50099593&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118717424 318490628 CHEMBL3343921 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50367846 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 12700 ChEMBL 10.1016/j.bmc.2014.08.035 10.7270/Q2M61N1Z 25282654 Lan, JS; Xie, SS; Li, SY; Pan, LF; Wang, XB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50367960 COC(=O)c1cc2c(cn1)[nH]c1ccccc21 InChI=1S/C13H10N2O2/c1-17-13(16)11-6-9-8-4-2-3-5-10(8)15-12(9)7-14-11/h2-7,15H,1H3 UKHFPVCOXBJPIN-UHFFFAOYSA-N 50243981 Beta CCM::CHEMBL453066::Methyl Beta-carboline-3 carboxylate::methyl 9H-pyrido[3,4-b]indole-3-carboxylate Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2014.08.035 10.7270/Q2M61N1Z 25282654 Lan, JS; Xie, SS; Li, SY; Pan, LF; Wang, XB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50243981 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50243981&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 107704 104100134 CHEMBL453066 ZINC00025301 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50367961 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 51 ChEMBL 10.1016/j.bmc.2014.08.035 10.7270/Q2M61N1Z 25282654 Lan, JS; Xie, SS; Li, SY; Pan, LF; Wang, XB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50363809 C[C@@]12CC[C@@H]3[C@H](CC3(C)C)C(=C)CC[C@H]1O2 InChI=1S/C15H24O/c1-10-5-6-13-15(4,16-13)8-7-12-11(10)9-14(12,2)3/h11-13H,1,5-9H2,2-4H3/t11-,12-,13-,15-/m1/s1 NVEQFIOZRFFVFW-RGCMKSIDSA-N 50241720 (-)-Caryophyllene oxide::(1R,4R,5R,9S)-4,5-epoxycaryophyllan-8(13)-ene::CHEMBL508894::beta-caryophyllene oxide Cholinesterase 208400 ChEMBL 10.1021/np0680174 10.7270/Q2CN73N0 17067156 Choudhary, MI; Siddiqui, ZA; Nawaz, SA; Atta-ur-Rahman, A University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50241720 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50241720&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1742210 104098845 67818 CHEMBL508894 C16908 ZINC02083320 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50363810 CC1(C)C[C@H]2[C@H]1CC[C@@](C)(O)[C@H](O)CCC2=C InChI=1S/C15H26O2/c1-10-5-6-13(16)15(4,17)8-7-12-11(10)9-14(12,2)3/h11-13,16-17H,1,5-9H2,2-4H3/t11-,12-,13-,15-/m1/s1 XZTGVWRBZDBQLP-RGCMKSIDSA-N 50241721 (1R,4R,5R,9S)-4,5-dihydroxycaryophyllan-8(13)-ene::CHEMBL512948 Cholinesterase 44010 ChEMBL 10.1021/np0680174 10.7270/Q2CN73N0 17067156 Choudhary, MI; Siddiqui, ZA; Nawaz, SA; Atta-ur-Rahman, A University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50241721 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50241721&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10444237 104098846 CHEMBL512948 ZINC13383874 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50363811 CC1(C)C[C@H](O)[C@]23CC[C@@H](O)[C@](C)(CC[C@@H]12)C3 InChI=1S/C15H26O2/c1-13(2)8-12(17)15-7-5-11(16)14(3,9-15)6-4-10(13)15/h10-12,16-17H,4-9H2,1-3H3/t10-,11+,12-,14+,15-/m0/s1 BWXJQHJHGMZLBT-OEMOEHNSSA-N 50241722 (1S,4R,5R,8S,9S)-clovane-5,9-diol::CHEMBL465622 Cholinesterase 455800 ChEMBL 10.1021/np0680174 10.7270/Q2CN73N0 17067156 Choudhary, MI; Siddiqui, ZA; Nawaz, SA; Atta-ur-Rahman, A University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50241722 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50241722&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 15599878 104098847 CHEMBL465622 ZINC04476636 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50363812 C[C@@]12CC[C@@H]3[C@H](C[C@@]3(C)CO)C(=C)CC[C@H]1O2 InChI=1S/C15H24O2/c1-10-4-5-13-15(3,17-13)7-6-12-11(10)8-14(12,2)9-16/h11-13,16H,1,4-9H2,2-3H3/t11-,12-,13-,14+,15-/m1/s1 XLKXIWMHACWINL-ARILJUKYSA-N 50241736 (1R,4R,5R,9S,11R)-4,5-epoxycaryophyllan-8(13)-en-15-ol::CHEMBL511532 Cholinesterase 189500 ChEMBL 10.1021/np0680174 10.7270/Q2CN73N0 17067156 Choudhary, MI; Siddiqui, ZA; Nawaz, SA; Atta-ur-Rahman, A University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50241736 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50241736&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14543497 104098853 CHEMBL511532 ZINC34457948 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50363813 C[C@@]12CC[C@@H]3[C@H](C[C@]3(C)CO)C(=C)CC[C@H]1O2 InChI=1S/C15H24O2/c1-10-4-5-13-15(3,17-13)7-6-12-11(10)8-14(12,2)9-16/h11-13,16H,1,4-9H2,2-3H3/t11-,12-,13-,14-,15-/m1/s1 XLKXIWMHACWINL-KJWHEZOQSA-N 50241737 (1R,4R,5R,9S,11S)-4,5-epoxycaryophyllan-8(13)-en-14-ol::CHEMBL463194 Cholinesterase 10900 ChEMBL 10.1021/np0680174 10.7270/Q2CN73N0 17067156 Choudhary, MI; Siddiqui, ZA; Nawaz, SA; Atta-ur-Rahman, A University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50241737 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50241737&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 21672189 104098854 CHEMBL463194 ZINC34457949 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50363814 C[C@@]12C[C@H](O)[C@@H]3[C@H](CC3(C)C)C(=O)CC[C@H]1O2 InChI=1S/C14H22O3/c1-13(2)6-8-9(15)4-5-11-14(3,17-11)7-10(16)12(8)13/h8,10-12,16H,4-7H2,1-3H3/t8-,10+,11-,12+,14-/m1/s1 LPQILJLNNPWGIC-KSXHLQSHSA-N 50241738 (1R,2S,4R,5R,9S)-4,5-epoxy-13-norcaryophyllan-8-one::CHEMBL463195 Cholinesterase 458700 ChEMBL 10.1021/np0680174 10.7270/Q2CN73N0 17067156 Choudhary, MI; Siddiqui, ZA; Nawaz, SA; Atta-ur-Rahman, A University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50241738 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50241738&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 16091566 104098855 CHEMBL463195 ZINC35066282 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50363815 C[C@@]12CC[C@@H]3[C@H](CC3(C)C)[C@@H](CO)CC[C@H]1O2 InChI=1S/C15H26O2/c1-14(2)8-11-10(9-16)4-5-13-15(3,17-13)7-6-12(11)14/h10-13,16H,4-9H2,1-3H3/t10-,11-,12-,13-,15-/m1/s1 CAKPDQJXCRCUCR-FTQJZPFOSA-N 50241739 (1R,4R,5R,8S,9S)-4,5-epoxycaryophyllan-13-ol::CHEMBL511533 Cholinesterase 26370 ChEMBL 10.1021/np0680174 10.7270/Q2CN73N0 17067156 Choudhary, MI; Siddiqui, ZA; Nawaz, SA; Atta-ur-Rahman, A University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50241739 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50241739&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 21672191 104098856 CHEMBL511533 ZINC40873099 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50363816 CC1(C)C[C@H]2[C@H]1CC[C@]1(C)[C@H](O)CC[C@@]2(O)[C@H]1O InChI=1S/C15H26O3/c1-13(2)8-10-9(13)4-6-14(3)11(16)5-7-15(10,18)12(14)17/h9-12,16-18H,4-8H2,1-3H3/t9-,10+,11-,12+,14-,15+/m1/s1 ZNZACRWMACXOCV-NJTCAMEISA-N 50241740 (1R,4R,5R,8S, 9S,13S)-caryolane-5,8,13-triol::CHEMBL463196 Cholinesterase 23600 ChEMBL 10.1021/np0680174 10.7270/Q2CN73N0 17067156 Choudhary, MI; Siddiqui, ZA; Nawaz, SA; Atta-ur-Rahman, A University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50241740 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50241740&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 16091567 104098857 CHEMBL463196 ZINC35066284 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50363817 C[C@]12O[C@@H]1CC[C@H](CO)[C@H]1CC(C)(C)[C@@H]1C[C@H]2O InChI=1S/C15H26O3/c1-14(2)7-10-9(8-16)4-5-13-15(3,18-13)12(17)6-11(10)14/h9-13,16-17H,4-8H2,1-3H3/t9-,10-,11-,12-,13-,15-/m1/s1 PTIVJDNUAGEGNR-QTPLKFIXSA-N 50241741 (1R,3R,4R,5R,8S,9S)-4,5-epoxycaryophyllan-3,13-diol::CHEMBL518527 Cholinesterase 154600 ChEMBL 10.1021/np0680174 10.7270/Q2CN73N0 17067156 Choudhary, MI; Siddiqui, ZA; Nawaz, SA; Atta-ur-Rahman, A University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50241741 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50241741&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 16091568 104098858 CHEMBL518527 ZINC35066287 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50363818 CC1(C)C[C@H](O)[C@]23CC[C@@H](O)[C@](CO)(CC[C@@H]12)C3 InChI=1S/C15H26O3/c1-13(2)7-12(18)15-6-4-11(17)14(8-15,9-16)5-3-10(13)15/h10-12,16-18H,3-9H2,1-2H3/t10-,11+,12-,14+,15-/m0/s1 JPTKHPFZGJJGML-OEMOEHNSSA-N 50241742 (1S,4R,5R,8S,9S)-clovane-5,9,12-triol::CHEMBL517307 Cholinesterase 43630 ChEMBL 10.1021/np0680174 10.7270/Q2CN73N0 17067156 Choudhary, MI; Siddiqui, ZA; Nawaz, SA; Atta-ur-Rahman, A University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50241742 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50241742&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 16091569 104098859 CHEMBL517307 ZINC35066290 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50363819 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 8500 ChEMBL 10.1021/np0680174 10.7270/Q2CN73N0 17067156 Choudhary, MI; Siddiqui, ZA; Nawaz, SA; Atta-ur-Rahman, A University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50393167 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 820 ChEMBL 10.1016/j.bmcl.2015.07.026 10.7270/Q22B90TV 26212777 Chen, Y; Liu, ZL; Fu, TM; Li, W; Xu, XL; Sun, HP Nanjing University of Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50393168 CC(=O)c1c(C)nc2ccccc2c1N InChI=1S/C12H12N2O/c1-7-11(8(2)15)12(13)9-5-3-4-6-10(9)14-7/h3-6H,1-2H3,(H2,13,14) YFGFFNPPTDOYLI-UHFFFAOYSA-N 50110699 CHEMBL1531257 Cholinesterase 460 ChEMBL 10.1016/j.bmcl.2015.07.026 10.7270/Q22B90TV 26212777 Chen, Y; Liu, ZL; Fu, TM; Li, W; Xu, XL; Sun, HP Nanjing University of Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50110699 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50110699&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 672297 104005429 CHEMBL1531257 ZINC40640514 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50393169 Nc1c2CCCc2nc2c3CCCc3nn12 InChI=1S/C12H14N4/c13-11-7-3-1-5-9(7)14-12-8-4-2-6-10(8)15-16(11)12/h1-6,13H2 DKJLZDLLDSQAOK-UHFFFAOYSA-N 50110701 CHEMBL3605837 Cholinesterase 60910 ChEMBL 10.1016/j.bmcl.2015.07.026 10.7270/Q22B90TV 26212777 Chen, Y; Liu, ZL; Fu, TM; Li, W; Xu, XL; Sun, HP Nanjing University of Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50110701 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50110701&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3163254 319493267 CHEMBL3605837 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50393170 Nc1c2CCN(Cc3ccccc3)c2nc2ccccc12 InChI=1S/C18H17N3/c19-17-14-8-4-5-9-16(14)20-18-15(17)10-11-21(18)12-13-6-2-1-3-7-13/h1-9H,10-12H2,(H2,19,20) ZCZQCKJQIGWLFR-UHFFFAOYSA-N 50110702 CHEMBL283841 Cholinesterase 2250 ChEMBL 10.1016/j.bmcl.2015.07.026 10.7270/Q22B90TV 26212777 Chen, Y; Liu, ZL; Fu, TM; Li, W; Xu, XL; Sun, HP Nanjing University of Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50110702 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50110702&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 711989 319493268 CHEMBL283841 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50393171 CC1(C)CC(=O)c2c(C1)nc1ccccc1c2N InChI=1S/C15H16N2O/c1-15(2)7-11-13(12(18)8-15)14(16)9-5-3-4-6-10(9)17-11/h3-6H,7-8H2,1-2H3,(H2,16,17) RFXDMILSJZCTDQ-UHFFFAOYSA-N 50110722 CHEMBL1478435 Cholinesterase 36150 ChEMBL 10.1016/j.bmcl.2015.07.026 10.7270/Q22B90TV 26212777 Chen, Y; Liu, ZL; Fu, TM; Li, W; Xu, XL; Sun, HP Nanjing University of Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50110722 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50110722&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 617614 104005450 CHEMBL1478435 ZINC13472693 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50393172 COc1ccc2nc(c(C#N)c(N)c2c1)C(F)(F)F InChI=1S/C12H8F3N3O/c1-19-6-2-3-9-7(4-6)10(17)8(5-16)11(18-9)12(13,14)15/h2-4H,1H3,(H2,17,18) RCWHVQVJHLZELL-UHFFFAOYSA-N 50210319 4-amino-6-methoxy-2-(trifluoromethyl)quinoline-3-carbonitrile::CHEMBL226970 Cholinesterase 30680 ChEMBL 10.1016/j.bmcl.2015.07.026 10.7270/Q22B90TV 26212777 Chen, Y; Liu, ZL; Fu, TM; Li, W; Xu, XL; Sun, HP Nanjing University of Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210319 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210319&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 824060 104086869 CHEMBL226970 ZINC19593996 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50393174 Nc1c2CCCCc2nc2sccc12 InChI=1S/C11H12N2S/c12-10-7-3-1-2-4-9(7)13-11-8(10)5-6-14-11/h5-6H,1-4H2,(H2,12,13) PMWMMNQYOBSEDT-UHFFFAOYSA-N 50110726 CHEMBL3605836 Cholinesterase 110 ChEMBL 10.1016/j.bmcl.2015.07.026 10.7270/Q22B90TV 26212777 Chen, Y; Liu, ZL; Fu, TM; Li, W; Xu, XL; Sun, HP Nanjing University of Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50110726 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50110726&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1LW 4JMB 826449 104005454 CHEMBL3605836 ZINC28224210 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50393179 Nc1c2CCCc2nc2CCCCc12 InChI=1S/C12H16N2/c13-12-8-4-1-2-6-10(8)14-11-7-3-5-9(11)12/h1-7H2,(H2,13,14) YLUSMKAJIQOXPV-UHFFFAOYSA-N 50279987 2,3,5,6,7,8-Hexahydro-1H-cyclopenta[b]quinolin-9-ylamine::CHEMBL130880::Ipidacrine Cholinesterase 70 ChEMBL 10.1016/j.bmcl.2015.07.026 10.7270/Q22B90TV 26212777 Chen, Y; Liu, ZL; Fu, TM; Li, W; Xu, XL; Sun, HP Nanjing University of Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50279987 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50279987&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search R9W 7AF0 604519 104121691 CHEMBL130880 ZINC04006685 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50393182 Nc1c2C3CCCCC3Sc2nc2CCCCc12 InChI=1S/C15H20N2S/c16-14-9-5-1-3-7-11(9)17-15-13(14)10-6-2-4-8-12(10)18-15/h10,12H,1-8H2,(H2,16,17) GTVDFNBZJUIHHZ-UHFFFAOYSA-N 50110727 CHEMBL3605838 Cholinesterase 330 ChEMBL 10.1016/j.bmcl.2015.07.026 10.7270/Q22B90TV 26212777 Chen, Y; Liu, ZL; Fu, TM; Li, W; Xu, XL; Sun, HP Nanjing University of Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50110727 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50110727&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122186661 104005455 CHEMBL3605838 ZINC27422619 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50393183 CCCCN1CCc2c1nc1ccc(Br)cc1c2N InChI=1S/C15H18BrN3/c1-2-3-7-19-8-6-11-14(17)12-9-10(16)4-5-13(12)18-15(11)19/h4-5,9H,2-3,6-8H2,1H3,(H2,17,18) XHNLICSHYXRRRU-UHFFFAOYSA-N 39664 (6-bromo-1-butyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)amine;hydrochloride::6-bromanyl-1-butyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-amine;hydrochloride::6-bromo-1-butyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinolin-4-amine hydrochloride::6-bromo-1-butyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-amine;hydrochloride::MLS000532161::SMR000137102::cid_2831789 Cholinesterase 8920 ChEMBL 10.1016/j.bmcl.2015.07.026 10.7270/Q22B90TV 26212777 Chen, Y; Liu, ZL; Fu, TM; Li, W; Xu, XL; Sun, HP Nanjing University of Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=39664 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=39664&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1602511 252620550 ZINC01823622 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50393184 CN1CCc2c1nc1c(C)cccc1c2N InChI=1S/C13H15N3/c1-8-4-3-5-9-11(14)10-6-7-16(2)13(10)15-12(8)9/h3-5H,6-7H2,1-2H3,(H2,14,15) FPHSWMLTZQGJIC-UHFFFAOYSA-N 50110728 CHEMBL1617348 Cholinesterase 15940 ChEMBL 10.1016/j.bmcl.2015.07.026 10.7270/Q22B90TV 26212777 Chen, Y; Liu, ZL; Fu, TM; Li, W; Xu, XL; Sun, HP Nanjing University of Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50110728 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50110728&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 712055 104005456 CHEMBL1617348 ZINC28225059 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50393654 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 4 ChEMBL 10.1016/j.ejmech.2007.04.018 10.7270/Q2TH8MG0 17624631 Andreani, A; Burnelli, S; Granaiola, M; Guardigli, M; Leoni, A; Locatelli, A; Morigi, R; Rambaldi, M; Rizzoli, M; Varoli, L; Roda, A Università di Bologna http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50393655 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 2700 ChEMBL 10.1016/j.ejmech.2007.04.018 10.7270/Q2TH8MG0 17624631 Andreani, A; Burnelli, S; Granaiola, M; Guardigli, M; Leoni, A; Locatelli, A; Morigi, R; Rambaldi, M; Rizzoli, M; Varoli, L; Roda, A Università di Bologna http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50394771 [I-].[I-].C[n+]1ccc2n(CCCCCCCCn3c4ccccc4c4c[n+](C)ccc34)c3ccccc3c2c1 InChI=1S/C28H38N4O9/c29-13-20-23(35)24(36)27(40-20)41-21(19-12-18(33)26(39-19)32-11-10-22(34)31-28(32)38)14-30-25(37)17-8-6-16(7-9-17)15-4-2-1-3-5-15/h6-11,15,18-21,23-24,26-27,33,35-36H,1-5,12-14,29H2,(H,30,37)(H,31,34,38)/t18-,19+,20-,21+,23-,24-,26-,27+/m1/s1 DZQMCLGCAJEOIP-NGGDQPKYSA-N 50111775 CHEMBL3605360 Cholinesterase 31 ChEMBL 10.1021/acs.jmedchem.5b00958 10.7270/Q2QZ2CRZ 26278660 Otto, R; Penzis, R; Gaube, F; Adolph, O; Föhr, KJ; Warncke, P; Robaa, D; Appenroth, D; Fleck, C; Enzensperger, C; Lehmann, J; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50111775 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50111775&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122186427 104006300 CHEMBL3605360 ZINC28227028 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50394773 [I-].[I-].C[n+]1ccc2n(CCCCCCCCCn3c4ccccc4c4c[n+](C)ccc34)c3ccccc3c2c1 InChI=1S/C29H34N4O10/c30-13-21-24(36)25(37)28(42-21)43-22(20-12-19(34)27(41-20)33-11-10-23(35)32-29(33)39)14-31-26(38)17-6-8-18(9-7-17)40-15-16-4-2-1-3-5-16/h1-11,19-22,24-25,27-28,34,36-37H,12-15,30H2,(H,31,38)(H,32,35,39)/t19-,20+,21-,22+,24-,25-,27-,28+/m1/s1 XGZSOQVDRJWDRQ-IWUDHEKZSA-N 50111776 CHEMBL3605361 Cholinesterase 16 ChEMBL 10.1021/acs.jmedchem.5b00958 10.7270/Q2QZ2CRZ 26278660 Otto, R; Penzis, R; Gaube, F; Adolph, O; Föhr, KJ; Warncke, P; Robaa, D; Appenroth, D; Fleck, C; Enzensperger, C; Lehmann, J; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50111776 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50111776&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122186429 104006301 CHEMBL3605361 ZINC28226641 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50394775 [I-].[I-].COc1ccc2n(CCCCCCCCCn3c4ccc(OC)cc4c4c[n+](C)ccc34)c3cc[n+](C)cc3c2c1 InChI=1S/C28H39N5O9/c29-13-20-23(36)24(37)26(41-20)42-21(19-12-18(34)25(40-19)33-11-10-22(35)32-28(33)39)14-30-27(38)31-17-8-6-16(7-9-17)15-4-2-1-3-5-15/h6-11,15,18-21,23-26,34,36-37H,1-5,12-14,29H2,(H2,30,31,38)(H,32,35,39)/t18-,19+,20-,21+,23-,24-,25-,26+/m1/s1 VPRUYRHUFOOVRY-CGJGWCQRSA-N 50111777 CHEMBL3605362 Cholinesterase 48 ChEMBL 10.1021/acs.jmedchem.5b00958 10.7270/Q2QZ2CRZ 26278660 Otto, R; Penzis, R; Gaube, F; Adolph, O; Föhr, KJ; Warncke, P; Robaa, D; Appenroth, D; Fleck, C; Enzensperger, C; Lehmann, J; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50111777 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50111777&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122186431 104006302 CHEMBL3605362 ZINC28229443 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50394776 [I-].[I-].CC[n+]1ccc2n(CCCCCCCCCn3c4ccccc4c4c[n+](CC)ccc34)c3ccccc3c2c1 InChI=1S/C24H31F3N4O8/c25-24(26,27)13-3-1-2-12(8-13)4-6-29-11-17(39-22-20(35)19(34)16(10-28)38-22)15-9-14(32)21(37-15)31-7-5-18(33)30-23(31)36/h1-3,5,7-8,14-17,19-22,29,32,34-35H,4,6,9-11,28H2,(H,30,33,36)/t14-,15+,16-,17+,19-,20-,21-,22+/m1/s1 QOFWENVYNYUISB-UDHQNBHYSA-N 50111778 CHEMBL3605363 Cholinesterase 33 ChEMBL 10.1021/acs.jmedchem.5b00958 10.7270/Q2QZ2CRZ 26278660 Otto, R; Penzis, R; Gaube, F; Adolph, O; Föhr, KJ; Warncke, P; Robaa, D; Appenroth, D; Fleck, C; Enzensperger, C; Lehmann, J; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50111778 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50111778&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122186433 104006303 CHEMBL3605363 ZINC28225813 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50394777 [I-].[I-].OCC[n+]1ccc2n(CCCCCCCCCn3c4ccccc4c4c[n+](CCO)ccc34)c3ccccc3c2c1 InChI=1S/C29H52N4O8/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-31-19-23(41-28-26(37)25(36)22(18-30)40-28)21-17-20(34)27(39-21)33-16-14-24(35)32-29(33)38/h14,16,20-23,25-28,31,34,36-37H,2-13,15,17-19,30H2,1H3,(H,32,35,38)/t20-,21+,22-,23+,25-,26-,27-,28+/m1/s1 NZSSUHPFQJXYCA-WBSGOERWSA-N 50111779 CHEMBL3605364 Cholinesterase 85 ChEMBL 10.1021/acs.jmedchem.5b00958 10.7270/Q2QZ2CRZ 26278660 Otto, R; Penzis, R; Gaube, F; Adolph, O; Föhr, KJ; Warncke, P; Robaa, D; Appenroth, D; Fleck, C; Enzensperger, C; Lehmann, J; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50111779 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50111779&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122186435 104006304 CHEMBL3605364 ZINC36352018 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50394780 [I-].[I-].CCC[n+]1ccc2n(CCCCCCCCCn3c4ccccc4c4c[n+](CCC)ccc34)c3ccccc3c2c1 InChI=1S/C22H31N5O8/c23-10-15-18(30)19(31)21(34-15)35-16(11-25-7-3-12-1-5-24-6-2-12)14-9-13(28)20(33-14)27-8-4-17(29)26-22(27)32/h1-2,4-6,8,13-16,18-21,25,28,30-31H,3,7,9-11,23H2,(H,26,29,32)/t13-,14+,15-,16+,18-,19-,20-,21+/m1/s1 PDXOSNLVVWZMSE-XKXSSWDPSA-N 50111780 CHEMBL3605365 Cholinesterase 56 ChEMBL 10.1021/acs.jmedchem.5b00958 10.7270/Q2QZ2CRZ 26278660 Otto, R; Penzis, R; Gaube, F; Adolph, O; Föhr, KJ; Warncke, P; Robaa, D; Appenroth, D; Fleck, C; Enzensperger, C; Lehmann, J; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50111780 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50111780&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122186437 104006305 CHEMBL3605365 ZINC28227082 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50394781 CN1CCc2c(C1)c1ccccc1n2CCCCCCn1c2CCN(C)Cc2c2ccccc12 InChI=1S/C20H34N4O8/c1-2-3-4-6-22-10-14(32-19-17(28)16(27)13(9-21)31-19)12-8-11(25)18(30-12)24-7-5-15(26)23-20(24)29/h5,7,11-14,16-19,22,25,27-28H,2-4,6,8-10,21H2,1H3,(H,23,26,29)/t11-,12+,13-,14+,16-,17-,18-,19+/m1/s1 UXNOWLDFIQZJQY-YBKIVMFTSA-N 50111781 CHEMBL3605366 Cholinesterase 80 ChEMBL 10.1021/acs.jmedchem.5b00958 10.7270/Q2QZ2CRZ 26278660 Otto, R; Penzis, R; Gaube, F; Adolph, O; Föhr, KJ; Warncke, P; Robaa, D; Appenroth, D; Fleck, C; Enzensperger, C; Lehmann, J; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50111781 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50111781&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122186439 104006306 CHEMBL3605366 ZINC13440787 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50394782 CN1CCc2c(C1)c1ccccc1n2CCCCCCCn1c2CCN(C)Cc2c2ccccc12 InChI=1S/C27H32N4O9/c28-13-20-23(34)24(35)26(39-20)40-21(19-12-18(32)25(38-19)31-11-10-22(33)30-27(31)36)14-29-15-6-8-17(9-7-15)37-16-4-2-1-3-5-16/h1-11,18-21,23-26,29,32,34-35H,12-14,28H2,(H,30,33,36)/t18-,19+,20-,21+,23-,24-,25-,26+/m1/s1 BWAFXPQLJMQJAX-CGJGWCQRSA-N 50111782 CHEMBL3605367 Cholinesterase 38 ChEMBL 10.1021/acs.jmedchem.5b00958 10.7270/Q2QZ2CRZ 26278660 Otto, R; Penzis, R; Gaube, F; Adolph, O; Föhr, KJ; Warncke, P; Robaa, D; Appenroth, D; Fleck, C; Enzensperger, C; Lehmann, J; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50111782 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50111782&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122186440 104006307 CHEMBL3605367 ZINC28226367 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50394783 [I-].[I-].C[n+]1ccc2n(CCCCCCCn3c4ccccc4c4c[n+](C)ccc34)c3ccccc3c2c1 InChI=1S/C24H34N4O9/c1-27(11-13-3-5-14(34-2)6-4-13)12-18(37-23-21(32)20(31)17(10-25)36-23)16-9-15(29)22(35-16)28-8-7-19(30)26-24(28)33/h3-8,15-18,20-23,29,31-32H,9-12,25H2,1-2H3,(H,26,30,33)/t15-,16+,17-,18+,20-,21-,22-,23+/m1/s1 LOSWQZCOFNPYFH-XTIJIIPQSA-N 50111774 CHEMBL3605359 Cholinesterase 47 ChEMBL 10.1021/acs.jmedchem.5b00958 10.7270/Q2QZ2CRZ 26278660 Otto, R; Penzis, R; Gaube, F; Adolph, O; Föhr, KJ; Warncke, P; Robaa, D; Appenroth, D; Fleck, C; Enzensperger, C; Lehmann, J; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50111774 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50111774&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122186425 104006299 CHEMBL3605359 ZINC28226400 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50394784 [I-].[I-].C[n+]1ccc2n(CCCCCCn3c4ccccc4c4c[n+](C)ccc34)c3ccccc3c2c1 InChI=1S/C21H35N5O8/c1-25-5-2-3-11(25)9-23-10-15(34-20-18(30)17(29)14(8-22)33-20)13-7-12(27)19(32-13)26-6-4-16(28)24-21(26)31/h4,6,11-15,17-20,23,27,29-30H,2-3,5,7-10,22H2,1H3,(H,24,28,31)/t11?,12-,13+,14-,15+,17-,18-,19-,20+/m1/s1 SZPGUEKZKKMDDE-NOTNPOBESA-N 50111773 CHEMBL3605358 Cholinesterase 94 ChEMBL 10.1021/acs.jmedchem.5b00958 10.7270/Q2QZ2CRZ 26278660 Otto, R; Penzis, R; Gaube, F; Adolph, O; Föhr, KJ; Warncke, P; Robaa, D; Appenroth, D; Fleck, C; Enzensperger, C; Lehmann, J; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50111773 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50111773&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122186423 104006298 CHEMBL3605358 ZINC28225889 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50394785 COc1ccc2n(CCCCCCCCCn3c4ccncc4c4cc(OC)ccc34)c3ccncc3c2c1 InChI=1S/C22H37N5O8/c1-26-7-2-3-12(26)4-6-24-11-16(35-21-19(31)18(30)15(10-23)34-21)14-9-13(28)20(33-14)27-8-5-17(29)25-22(27)32/h5,8,12-16,18-21,24,28,30-31H,2-4,6-7,9-11,23H2,1H3,(H,25,29,32)/t12?,13-,14+,15-,16+,18-,19-,20-,21+/m1/s1 IBPFPXLLJNGLOK-FISCHTRNSA-N 50111772 CHEMBL3605357 Cholinesterase 6.5 ChEMBL 10.1021/acs.jmedchem.5b00958 10.7270/Q2QZ2CRZ 26278660 Otto, R; Penzis, R; Gaube, F; Adolph, O; Föhr, KJ; Warncke, P; Robaa, D; Appenroth, D; Fleck, C; Enzensperger, C; Lehmann, J; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50111772 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50111772&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122186422 104006297 CHEMBL3605357 ZINC28228191 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50394786 C(CCCCn1c2ccccc2c2cnccc12)CCCCn1c2ccccc2c2cnccc12 InChI=1S/C28H32N4O10/c29-13-20-23(35)24(36)27(41-20)42-21(19-12-18(33)26(40-19)32-10-9-22(34)31-28(32)38)14-30-25(37)15-5-4-8-17(11-15)39-16-6-2-1-3-7-16/h1-11,18-21,23-24,26-27,33,35-36H,12-14,29H2,(H,30,37)(H,31,34,38)/t18-,19+,20-,21+,23-,24-,26-,27+/m1/s1 WBZJVQCPQBHRKY-NGGDQPKYSA-N 50111771 CHEMBL3605356 Cholinesterase 13 ChEMBL 10.1021/acs.jmedchem.5b00958 10.7270/Q2QZ2CRZ 26278660 Otto, R; Penzis, R; Gaube, F; Adolph, O; Föhr, KJ; Warncke, P; Robaa, D; Appenroth, D; Fleck, C; Enzensperger, C; Lehmann, J; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50111771 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50111771&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122186421 104006296 CHEMBL3605356 ZINC28228094 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50394787 C(CCCCn1c2ccccc2c2cnccc12)CCCn1c2ccccc2c2cnccc12 InChI=1S/C23H31ClN4O8/c24-13-3-1-12(2-4-13)5-7-26-11-17(36-22-20(32)19(31)16(10-25)35-22)15-9-14(29)21(34-15)28-8-6-18(30)27-23(28)33/h1-4,6,8,14-17,19-22,26,29,31-32H,5,7,9-11,25H2,(H,27,30,33)/t14-,15+,16-,17+,19-,20-,21-,22+/m1/s1 LEWSUOGIDKRESS-UDHQNBHYSA-N 50111770 CHEMBL3605355 Cholinesterase 13 ChEMBL 10.1021/acs.jmedchem.5b00958 10.7270/Q2QZ2CRZ 26278660 Otto, R; Penzis, R; Gaube, F; Adolph, O; Föhr, KJ; Warncke, P; Robaa, D; Appenroth, D; Fleck, C; Enzensperger, C; Lehmann, J; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50111770 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50111770&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122186420 104006295 CHEMBL3605355 ZINC28227168 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50394788 C(CCCn1c2ccccc2c2cnccc12)CCCn1c2ccccc2c2cnccc12 InChI=1S/C25H44N6O8/c1-3-28(4-2)7-8-29-9-11-30(12-10-29)15-19(39-24-22(35)21(34)18(14-26)38-24)17-13-16(32)23(37-17)31-6-5-20(33)27-25(31)36/h5-6,16-19,21-24,32,34-35H,3-4,7-15,26H2,1-2H3,(H,27,33,36)/t16-,17+,18-,19+,21-,22-,23-,24+/m1/s1 ZXHQVBQBXYWKAB-VXAIIWMZSA-N 50111769 CHEMBL3605354 Cholinesterase 16 ChEMBL 10.1021/acs.jmedchem.5b00958 10.7270/Q2QZ2CRZ 26278660 Otto, R; Penzis, R; Gaube, F; Adolph, O; Föhr, KJ; Warncke, P; Robaa, D; Appenroth, D; Fleck, C; Enzensperger, C; Lehmann, J; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50111769 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50111769&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122186419 104006294 CHEMBL3605354 ZINC28225830 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50394789 C(CCCn1c2ccccc2c2cnccc12)CCn1c2ccccc2c2cnccc12 InChI=1S/C25H44N4O8/c1-3-5-7-10-28(11-8-6-4-2)15-19(37-24-22(33)21(32)18(14-26)36-24)17-13-16(30)23(35-17)29-12-9-20(31)27-25(29)34/h9,12,16-19,21-24,30,32-33H,3-8,10-11,13-15,26H2,1-2H3,(H,27,31,34)/t16-,17+,18-,19+,21-,22-,23-,24+/m1/s1 RWQVQCUDCXZINH-VXAIIWMZSA-N 50111768 CHEMBL3605353 Cholinesterase 50 ChEMBL 10.1021/acs.jmedchem.5b00958 10.7270/Q2QZ2CRZ 26278660 Otto, R; Penzis, R; Gaube, F; Adolph, O; Föhr, KJ; Warncke, P; Robaa, D; Appenroth, D; Fleck, C; Enzensperger, C; Lehmann, J; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50111768 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50111768&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122186418 104006293 CHEMBL3605353 ZINC28229422 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50394790 CN1CCc2c(C1)n(CCCCCCCCCn1c3CN(C)CCc3c3ccccc13)c1ccccc21 InChI=1S/C33H44N4/c1-34-22-18-28-26-14-8-10-16-30(26)36(32(28)24-34)20-12-6-4-3-5-7-13-21-37-31-17-11-9-15-27(31)29-19-23-35(2)25-33(29)37/h8-11,14-17H,3-7,12-13,18-25H2,1-2H3 JADBPNYNHZGHDV-UHFFFAOYSA-N 50317193 2-Methyl-9-[9-(2-methyl-1,2,3,4-tetrahydro-beta-carboline-9-yl)nonyl]-1,2,3,4-tetrahydro-beta-carboline::CHEMBL1087459 Cholinesterase 24 ChEMBL 10.1021/acs.jmedchem.5b00958 10.7270/Q2QZ2CRZ 26278660 Otto, R; Penzis, R; Gaube, F; Adolph, O; Föhr, KJ; Warncke, P; Robaa, D; Appenroth, D; Fleck, C; Enzensperger, C; Lehmann, J; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317193 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317193&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46222450 104151554 CHEMBL1087459 ZINC49109807 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50394791 C[n+]1ccc2c(c1)n(CCCCCCCCCn1c3ccccc3c3cc[n+](C)cc13)c1ccccc21 InChI=1S/C33H38N4/c1-34-22-18-28-26-14-8-10-16-30(26)36(32(28)24-34)20-12-6-4-3-5-7-13-21-37-31-17-11-9-15-27(31)29-19-23-35(2)25-33(29)37/h8-11,14-19,22-25H,3-7,12-13,20-21H2,1-2H3/q+2 XBLBEGLFURYCBO-UHFFFAOYSA-N 50317179 2-Methyl-9-[9-(2-methyl-beta-carboline-9-yl)nonyl]-beta-carboline-2-ium diiodide::CHEMBL1087458 Cholinesterase 5.3 ChEMBL 10.1021/acs.jmedchem.5b00958 10.7270/Q2QZ2CRZ 26278660 Otto, R; Penzis, R; Gaube, F; Adolph, O; Föhr, KJ; Warncke, P; Robaa, D; Appenroth, D; Fleck, C; Enzensperger, C; Lehmann, J; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317179 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317179&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46223338 104151540 CHEMBL1087458 ZINC49050890 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50394792 C(CCCCn1c2ccccc2c2ccncc12)CCCCn1c2ccccc2c2ccncc12 InChI=1S/C31H32N4/c1(2-4-10-20-34-28-14-8-6-12-24(28)26-16-18-32-22-30(26)34)3-5-11-21-35-29-15-9-7-13-25(29)27-17-19-33-23-31(27)35/h6-9,12-19,22-23H,1-5,10-11,20-21H2 JJAATQLWMKLMJU-UHFFFAOYSA-N 50317203 9-[9-(beta-Carboline-9-yl)nonyl]-beta-carboline::CHEMBL1098471 Cholinesterase 289 ChEMBL 10.1021/acs.jmedchem.5b00958 10.7270/Q2QZ2CRZ 26278660 Otto, R; Penzis, R; Gaube, F; Adolph, O; Föhr, KJ; Warncke, P; Robaa, D; Appenroth, D; Fleck, C; Enzensperger, C; Lehmann, J; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317203 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317203&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46223113 104151564 CHEMBL1098471 ZINC49088209 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50394883 CN1CCc2c(C1)c1ccccc1n2CCCCCCCCn1c2CCN(C)Cc2c2ccccc12 InChI=1S/C28H32N4O10/c29-13-20-23(35)24(36)27(41-20)42-21(19-12-18(33)26(40-19)32-11-10-22(34)31-28(32)38)14-30-25(37)15-6-8-17(9-7-15)39-16-4-2-1-3-5-16/h1-11,18-21,23-24,26-27,33,35-36H,12-14,29H2,(H,30,37)(H,31,34,38)/t18-,19+,20-,21+,23-,24-,26-,27+/m1/s1 KRAFNDPYRZERBU-NGGDQPKYSA-N 50111783 CHEMBL3605368 Cholinesterase 43 ChEMBL 10.1021/acs.jmedchem.5b00958 10.7270/Q2QZ2CRZ 26278660 Otto, R; Penzis, R; Gaube, F; Adolph, O; Föhr, KJ; Warncke, P; Robaa, D; Appenroth, D; Fleck, C; Enzensperger, C; Lehmann, J; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50111783 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50111783&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122186441 104006308 CHEMBL3605368 ZINC28228778 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50394884 CN1CCc2c(C1)c1ccccc1n2CCCCCCCCCn1c2CCN(C)Cc2c2ccccc12 InChI=1S/C29H36N4O8/c1-32(15-17-7-9-19(10-8-17)18-5-3-2-4-6-18)16-23(41-28-26(37)25(36)22(14-30)40-28)21-13-20(34)27(39-21)33-12-11-24(35)31-29(33)38/h2-12,20-23,25-28,34,36-37H,13-16,30H2,1H3,(H,31,35,38)/t20-,21+,22-,23+,25-,26-,27-,28+/m1/s1 JTPXGOHMZJZWRP-WBSGOERWSA-N 50111784 CHEMBL3605369 Cholinesterase 52 ChEMBL 10.1021/acs.jmedchem.5b00958 10.7270/Q2QZ2CRZ 26278660 Otto, R; Penzis, R; Gaube, F; Adolph, O; Föhr, KJ; Warncke, P; Robaa, D; Appenroth, D; Fleck, C; Enzensperger, C; Lehmann, J; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50111784 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50111784&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122186442 104006309 CHEMBL3605369 ZINC28225563 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50394885 COc1ccc2n(CCCCCCCCCn3c4CCN(C)Cc4c4cc(OC)ccc34)c3CCN(C)Cc3c2c1 InChI=1S/C27H38N4O8/c28-14-20-23(34)24(35)26(38-20)39-21(15-30-9-6-17(7-10-30)12-16-4-2-1-3-5-16)19-13-18(32)25(37-19)31-11-8-22(33)29-27(31)36/h1-5,8,11,17-21,23-26,32,34-35H,6-7,9-10,12-15,28H2,(H,29,33,36)/t18-,19+,20-,21+,23-,24-,25-,26+/m1/s1 AFKWASGTPCMWFX-CGJGWCQRSA-N 50111785 CHEMBL3605370 Cholinesterase 44 ChEMBL 10.1021/acs.jmedchem.5b00958 10.7270/Q2QZ2CRZ 26278660 Otto, R; Penzis, R; Gaube, F; Adolph, O; Föhr, KJ; Warncke, P; Robaa, D; Appenroth, D; Fleck, C; Enzensperger, C; Lehmann, J; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50111785 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50111785&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122186443 104006310 CHEMBL3605370 ZINC28229388 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50394886 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 4.4 ChEMBL 10.1021/acs.jmedchem.5b00958 10.7270/Q2QZ2CRZ 26278660 Otto, R; Penzis, R; Gaube, F; Adolph, O; Föhr, KJ; Warncke, P; Robaa, D; Appenroth, D; Fleck, C; Enzensperger, C; Lehmann, J; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409273 COc1ccccc1NC(=O)Nc1nc(cs1)-c1cc2ccccc2o1 InChI=1S/C19H15N3O3S/c1-24-16-9-5-3-7-13(16)20-18(23)22-19-21-14(11-26-19)17-10-12-6-2-4-8-15(12)25-17/h2-11H,1H3,(H2,20,21,22,23) CQQFQQQTZYDXQJ-UHFFFAOYSA-N 50118925 CHEMBL3617362 Cholinesterase 81280 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118925 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118925&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 30349448 104012178 CHEMBL3617362 ZINC05837577 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409274 COc1cccc(NC(=O)Nc2nc(cs2)-c2cc3ccccc3o2)c1 InChI=1S/C19H15N3O3S/c1-24-14-7-4-6-13(10-14)20-18(23)22-19-21-15(11-26-19)17-9-12-5-2-3-8-16(12)25-17/h2-11H,1H3,(H2,20,21,22,23) OXUNGIJMWUZXNH-UHFFFAOYSA-N 50118911 CHEMBL3617363 Cholinesterase 59560 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118911 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118911&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 2327992 104012164 CHEMBL3617363 ZINC36348564 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409275 COc1ccc(NC(=O)Nc2nc(cs2)-c2cc3ccccc3o2)cc1 InChI=1S/C19H15N3O3S/c1-24-14-8-6-13(7-9-14)20-18(23)22-19-21-15(11-26-19)17-10-12-4-2-3-5-16(12)25-17/h2-11H,1H3,(H2,20,21,22,23) DLOZVCKYVWWFNK-UHFFFAOYSA-N 50118895 CHEMBL3617364 Cholinesterase 74260 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118895 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118895&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 30349470 104012148 CHEMBL3617364 ZINC27523280 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409276 Cc1ccc(NC(=O)Nc2nc(cs2)-c2cc3ccccc3o2)cc1 InChI=1S/C19H15N3O2S/c1-12-6-8-14(9-7-12)20-18(23)22-19-21-15(11-25-19)17-10-13-4-2-3-5-16(13)24-17/h2-11H,1H3,(H2,20,21,22,23) SXEJSYRFICGWJP-UHFFFAOYSA-N 50118890 CHEMBL3617365 Cholinesterase 56320 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118890 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118890&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 30349444 319565797 CHEMBL3617365 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409277 O=C(Nc1nc(cs1)-c1cc2ccccc2o1)Nc1ccccc1 InChI=1S/C18H13N3O2S/c22-17(19-13-7-2-1-3-8-13)21-18-20-14(11-24-18)16-10-12-6-4-5-9-15(12)23-16/h1-11H,(H2,19,20,21,22) SJEYSDXHISONIC-UHFFFAOYSA-N 50118889 CHEMBL3617366 Cholinesterase 21260 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118889 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118889&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 30349438 319565796 CHEMBL3617366 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409278 [O-][N+](=O)c1ccccc1NC(=O)Nc1nc(cs1)-c1cc2ccccc2o1 InChI=1S/C18H12N4O4S/c23-17(19-12-6-2-3-7-14(12)22(24)25)21-18-20-13(10-27-18)16-9-11-5-1-4-8-15(11)26-16/h1-10H,(H2,19,20,21,23) USNUYGVHYQVJBH-UHFFFAOYSA-N 50118861 CHEMBL3617367 Cholinesterase 79930 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118861 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118861&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190209 104012116 CHEMBL3617367 ZINC13491521 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409279 [O-][N+](=O)c1cccc(NC(=O)Nc2nc(cs2)-c2cc3ccccc3o2)c1 InChI=1S/C18H12N4O4S/c23-17(19-12-5-3-6-13(9-12)22(24)25)21-18-20-14(10-27-18)16-8-11-4-1-2-7-15(11)26-16/h1-10H,(H2,19,20,21,23) PJNNFHPSCHLIHQ-UHFFFAOYSA-N 50118821 CHEMBL3617368 Cholinesterase 26810 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118821 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118821&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190210 319565795 CHEMBL3617368 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409280 [O-][N+](=O)c1ccc(NC(=O)Nc2nc(cs2)-c2cc3ccccc3o2)cc1 InChI=1S/C18H12N4O4S/c23-17(19-12-5-7-13(8-6-12)22(24)25)21-18-20-14(10-27-18)16-9-11-3-1-2-4-15(11)26-16/h1-10H,(H2,19,20,21,23) SGMDECZGZUSFRD-UHFFFAOYSA-N 50118820 CHEMBL3617369 Cholinesterase 3440 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118820 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118820&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190211 319565794 CHEMBL3617369 C02125 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409281 Fc1ccccc1NC(=O)Nc1nc(cs1)-c1cc2ccccc2o1 InChI=1S/C18H12FN3O2S/c19-12-6-2-3-7-13(12)20-17(23)22-18-21-14(10-25-18)16-9-11-5-1-4-8-15(11)24-16/h1-10H,(H2,20,21,22,23) MRLWHCZAIPEILV-UHFFFAOYSA-N 50118819 CHEMBL3617370 Cholinesterase 41660 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118819 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118819&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 45551490 319565793 CHEMBL3617370 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409282 Fc1cccc(NC(=O)Nc2nc(cs2)-c2cc3ccccc3o2)c1 InChI=1S/C18H12FN3O2S/c19-12-5-3-6-13(9-12)20-17(23)22-18-21-14(10-25-18)16-8-11-4-1-2-7-15(11)24-16/h1-10H,(H2,20,21,22,23) FGPNQGJVVXUPSZ-UHFFFAOYSA-N 50118818 CHEMBL3617371 Cholinesterase 17980 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118818 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118818&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190212 319565792 CHEMBL3617371 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409283 Fc1ccc(NC(=O)Nc2nc(cs2)-c2cc3ccccc3o2)cc1 InChI=1S/C18H12FN3O2S/c19-12-5-7-13(8-6-12)20-17(23)22-18-21-14(10-25-18)16-9-11-3-1-2-4-15(11)24-16/h1-10H,(H2,20,21,22,23) OUOCPZYVSOBKET-UHFFFAOYSA-N 50118817 CHEMBL3617372 Cholinesterase 7450 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118817 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118817&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 30349446 319565791 CHEMBL3617372 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409284 Clc1cccc(NC(=O)Nc2nc(cs2)-c2cc3ccccc3o2)c1 InChI=1S/C18H12ClN3O2S/c19-12-5-3-6-13(9-12)20-17(23)22-18-21-14(10-25-18)16-8-11-4-1-2-7-15(11)24-16/h1-10H,(H2,20,21,22,23) MUBWDZSFXNCBTK-UHFFFAOYSA-N 50118816 CHEMBL3617373 Cholinesterase 21520 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118816 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118816&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 30349436 319565790 CHEMBL3617373 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409285 Clc1ccc(NC(=O)Nc2nc(cs2)-c2cc3ccccc3o2)cc1 InChI=1S/C18H12ClN3O2S/c19-12-5-7-13(8-6-12)20-17(23)22-18-21-14(10-25-18)16-9-11-3-1-2-4-15(11)24-16/h1-10H,(H2,20,21,22,23) WKZDIGYHFBXIAA-UHFFFAOYSA-N 50118815 CHEMBL3617374 Cholinesterase 38580 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118815 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118815&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 30349434 319565789 CHEMBL3617374 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409286 Clc1ccc(NC(=O)Nc2nc(cs2)-c2cc3ccccc3o2)cc1Cl InChI=1S/C18H11Cl2N3O2S/c19-12-6-5-11(8-13(12)20)21-17(24)23-18-22-14(9-26-18)16-7-10-3-1-2-4-15(10)25-16/h1-9H,(H2,21,22,23,24) AZDGSOZTBKGALA-UHFFFAOYSA-N 50118814 CHEMBL3617375 Cholinesterase 75600 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118814 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118814&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 121081355 319565788 CHEMBL3617375 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409287 Brc1ccc(NC(=O)Nc2nc(cs2)-c2cc3ccccc3o2)cc1 InChI=1S/C18H12BrN3O2S/c19-12-5-7-13(8-6-12)20-17(23)22-18-21-14(10-25-18)16-9-11-3-1-2-4-15(11)24-16/h1-10H,(H2,20,21,22,23) RAIFXGROINUDHY-UHFFFAOYSA-N 50118797 CHEMBL3617376 Cholinesterase 55180 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118797 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118797&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190213 319565787 CHEMBL3617376 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409288 Ic1ccc(NC(=O)Nc2nc(cs2)-c2cc3ccccc3o2)cc1 InChI=1S/C18H12IN3O2S/c19-12-5-7-13(8-6-12)20-17(23)22-18-21-14(10-25-18)16-9-11-3-1-2-4-15(11)24-16/h1-10H,(H2,20,21,22,23) PNMWJNAYCKJEDE-UHFFFAOYSA-N 50118956 CHEMBL3617377 Cholinesterase 41270 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118956 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118956&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190214 319565798 CHEMBL3617377 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409289 COc1ccccc1NC(=O)Nc1nc(cs1)-c1cc2cc(Br)ccc2o1 InChI=1S/C19H14BrN3O3S/c1-25-16-5-3-2-4-13(16)21-18(24)23-19-22-14(10-27-19)17-9-11-8-12(20)6-7-15(11)26-17/h2-10H,1H3,(H2,21,22,23,24) NVSTWDBLUPFDDA-UHFFFAOYSA-N 50118957 CHEMBL3617378 Cholinesterase 154080 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118957 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118957&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190215 319565799 CHEMBL3617378 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409290 COc1cccc(NC(=O)Nc2nc(cs2)-c2cc3cc(Br)ccc3o2)c1 InChI=1S/C19H14BrN3O3S/c1-25-14-4-2-3-13(9-14)21-18(24)23-19-22-15(10-27-19)17-8-11-7-12(20)5-6-16(11)26-17/h2-10H,1H3,(H2,21,22,23,24) YHPSBZUUQSAKBW-UHFFFAOYSA-N 50118958 CHEMBL3617379 Cholinesterase 13950 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118958 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118958&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190216 319565800 CHEMBL3617379 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409291 COc1ccc(NC(=O)Nc2nc(cs2)-c2cc3cc(Br)ccc3o2)cc1 InChI=1S/C19H14BrN3O3S/c1-25-14-5-3-13(4-6-14)21-18(24)23-19-22-15(10-27-19)17-9-11-8-12(20)2-7-16(11)26-17/h2-10H,1H3,(H2,21,22,23,24) DCNMOYLMFVFNBI-UHFFFAOYSA-N 50118959 CHEMBL3617380 Cholinesterase 30970 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118959 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118959&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190217 319565801 CHEMBL3617380 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409292 Cc1ccc(NC(=O)Nc2nc(cs2)-c2cc3cc(Br)ccc3o2)cc1 InChI=1S/C19H14BrN3O2S/c1-11-2-5-14(6-3-11)21-18(24)23-19-22-15(10-26-19)17-9-12-8-13(20)4-7-16(12)25-17/h2-10H,1H3,(H2,21,22,23,24) BAPZDYUKLHATDD-UHFFFAOYSA-N 50118960 CHEMBL3617381 Cholinesterase 5650 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190218 319565802 CHEMBL3617381 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409293 Brc1ccc2oc(cc2c1)-c1csc(NC(=O)Nc2ccccc2)n1 InChI=1S/C18H12BrN3O2S/c19-12-6-7-15-11(8-12)9-16(24-15)14-10-25-18(21-14)22-17(23)20-13-4-2-1-3-5-13/h1-10H,(H2,20,21,22,23) PBZSWVCFHVRQPM-UHFFFAOYSA-N 50118963 CHEMBL3617382 Cholinesterase 35030 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50118963 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50118963&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190219 104012211 CHEMBL3617382 ZINC95545751 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409294 [O-][N+](=O)c1ccccc1NC(=O)Nc1nc(cs1)-c1cc2cc(Br)ccc2o1 InChI=1S/C18H11BrN4O4S/c19-11-5-6-15-10(7-11)8-16(27-15)13-9-28-18(21-13)22-17(24)20-12-3-1-2-4-14(12)23(25)26/h1-9H,(H2,20,21,22,24) QWXOTBKEKBVYLH-UHFFFAOYSA-N 50119072 CHEMBL3617383 Cholinesterase 5120 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50119072 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50119072&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190220 104012320 CHEMBL3617383 ZINC26723605 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409295 [O-][N+](=O)c1cccc(NC(=O)Nc2nc(cs2)-c2cc3cc(Br)ccc3o2)c1 InChI=1S/C18H11BrN4O4S/c19-11-4-5-15-10(6-11)7-16(27-15)14-9-28-18(21-14)22-17(24)20-12-2-1-3-13(8-12)23(25)26/h1-9H,(H2,20,21,22,24) HBTATKCIHZPCES-UHFFFAOYSA-N 50119075 CHEMBL3617384 Cholinesterase 78970 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50119075 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50119075&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190221 104012323 CHEMBL3617384 ZINC26732529 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409296 [O-][N+](=O)c1ccc(NC(=O)Nc2nc(cs2)-c2cc3cc(Br)ccc3o2)cc1 InChI=1S/C18H11BrN4O4S/c19-11-1-6-15-10(7-11)8-16(27-15)14-9-28-18(21-14)22-17(24)20-12-2-4-13(5-3-12)23(25)26/h1-9H,(H2,20,21,22,24) VZKCDWBLPVFWQC-UHFFFAOYSA-N 50119081 CHEMBL3617385 Cholinesterase 3120 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50119081 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50119081&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190222 104012329 CHEMBL3617385 C02125 ZINC26735054 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409297 Fc1ccccc1NC(=O)Nc1nc(cs1)-c1cc2cc(Br)ccc2o1 InChI=1S/C18H11BrFN3O2S/c19-11-5-6-15-10(7-11)8-16(25-15)14-9-26-18(22-14)23-17(24)21-13-4-2-1-3-12(13)20/h1-9H,(H2,21,22,23,24) AYDKLQXOMXIGDY-UHFFFAOYSA-N 50119098 CHEMBL3617386 Cholinesterase 9250 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50119098 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50119098&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190223 104012346 CHEMBL3617386 ZINC26733030 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409298 Fc1cccc(NC(=O)Nc2nc(cs2)-c2cc3cc(Br)ccc3o2)c1 InChI=1S/C18H11BrFN3O2S/c19-11-4-5-15-10(6-11)7-16(25-15)14-9-26-18(22-14)23-17(24)21-13-3-1-2-12(20)8-13/h1-9H,(H2,21,22,23,24) MXUCZMRTPQECLE-UHFFFAOYSA-N 50119099 CHEMBL3617387 Cholinesterase 40160 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50119099 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50119099&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190224 104012347 CHEMBL3617387 ZINC26731782 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409299 Fc1ccc(NC(=O)Nc2nc(cs2)-c2cc3cc(Br)ccc3o2)cc1 InChI=1S/C18H11BrFN3O2S/c19-11-1-6-15-10(7-11)8-16(25-15)14-9-26-18(22-14)23-17(24)21-13-4-2-12(20)3-5-13/h1-9H,(H2,21,22,23,24) BUTDBCAIKRJGRQ-UHFFFAOYSA-N 50119100 CHEMBL3617388 Cholinesterase 64320 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50119100 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50119100&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190225 104012348 CHEMBL3617388 ZINC13818782 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409300 Clc1cccc(NC(=O)Nc2nc(cs2)-c2cc3cc(Br)ccc3o2)c1 InChI=1S/C18H11BrClN3O2S/c19-11-4-5-15-10(6-11)7-16(25-15)14-9-26-18(22-14)23-17(24)21-13-3-1-2-12(20)8-13/h1-9H,(H2,21,22,23,24) KGQJAPWTALCLSA-UHFFFAOYSA-N 50119101 CHEMBL3617389 Cholinesterase 26320 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50119101 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50119101&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190226 104012349 CHEMBL3617389 ZINC13818777 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409301 Clc1ccc(NC(=O)Nc2nc(cs2)-c2cc3cc(Br)ccc3o2)cc1 InChI=1S/C18H11BrClN3O2S/c19-11-1-6-15-10(7-11)8-16(25-15)14-9-26-18(22-14)23-17(24)21-13-4-2-12(20)3-5-13/h1-9H,(H2,21,22,23,24) AYRUHAIPJAVRLE-UHFFFAOYSA-N 50119102 CHEMBL3617390 Cholinesterase 36930 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50119102 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50119102&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190227 104012350 CHEMBL3617390 ZINC13818779 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409302 Brc1ccc(NC(=O)Nc2nc(cs2)-c2cc3cc(Br)ccc3o2)cc1 InChI=1S/C18H11Br2N3O2S/c19-11-1-4-13(5-2-11)21-17(24)23-18-22-14(9-26-18)16-8-10-7-12(20)3-6-15(10)25-16/h1-9H,(H2,21,22,23,24) UPSCIDYJULRNEQ-UHFFFAOYSA-N 50119103 CHEMBL3617391 Cholinesterase 35810 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50119103 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50119103&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190228 104012351 CHEMBL3617391 ZINC03817905 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409303 Brc1ccc2oc(cc2c1)-c1csc(NC(=O)Nc2ccc(I)cc2)n1 InChI=1S/C18H11BrIN3O2S/c19-11-1-6-15-10(7-11)8-16(25-15)14-9-26-18(22-14)23-17(24)21-13-4-2-12(20)3-5-13/h1-9H,(H2,21,22,23,24) MDANXUNCVRWCRU-UHFFFAOYSA-N 50119104 CHEMBL3617392 Cholinesterase 43630 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50119104 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50119104&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190229 104012352 CHEMBL3617392 ZINC03817907 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409304 COc1ccc(NC(=O)Nc2nc(cs2)-c2cc3cc(ccc3o2)[N+]([O-])=O)cc1 InChI=1S/C19H14N4O5S/c1-27-14-5-2-12(3-6-14)20-18(24)22-19-21-15(10-29-19)17-9-11-8-13(23(25)26)4-7-16(11)28-17/h2-10H,1H3,(H2,20,21,22,24) ZSRRFBDLPWBOCR-UHFFFAOYSA-N 50119105 CHEMBL3617393 Cholinesterase 49240 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50119105 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50119105&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190230 104012353 CHEMBL3617393 ZINC13818775 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409305 [O-][N+](=O)c1ccc2oc(cc2c1)-c1csc(NC(=O)Nc2ccccc2)n1 InChI=1S/C18H12N4O4S/c23-17(19-12-4-2-1-3-5-12)21-18-20-14(10-27-18)16-9-11-8-13(22(24)25)6-7-15(11)26-16/h1-10H,(H2,19,20,21,23) SPHFMYWMEYSLDD-UHFFFAOYSA-N 50119106 CHEMBL3617394 Cholinesterase 2260 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50119106 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50119106&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190231 104012354 CHEMBL3617394 ZINC26732540 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409306 [O-][N+](=O)c1ccc(NC(=O)Nc2nc(cs2)-c2cc3cc(ccc3o2)[N+]([O-])=O)cc1 InChI=1S/C18H11N5O6S/c24-17(19-11-1-3-12(4-2-11)22(25)26)21-18-20-14(9-30-18)16-8-10-7-13(23(27)28)5-6-15(10)29-16/h1-9H,(H2,19,20,21,24) KEQNUGVULOPCBJ-UHFFFAOYSA-N 50119107 CHEMBL3617395 Cholinesterase 25600 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50119107 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50119107&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190232 104012355 CHEMBL3617395 C02125 ZINC13818784 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409307 [O-][N+](=O)c1ccc2oc(cc2c1)-c1csc(NC(=O)Nc2ccc(F)cc2)n1 InChI=1S/C18H11FN4O4S/c19-11-1-3-12(4-2-11)20-17(24)22-18-21-14(9-28-18)16-8-10-7-13(23(25)26)5-6-15(10)27-16/h1-9H,(H2,20,21,22,24) QRPSNKDWOXAPML-UHFFFAOYSA-N 50119108 CHEMBL3617396 Cholinesterase 47560 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50119108 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50119108&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190233 104012356 CHEMBL3617396 ZINC26732974 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409308 [O-][N+](=O)c1ccc2oc(cc2c1)-c1csc(NC(=O)Nc2ccc(Cl)cc2)n1 InChI=1S/C18H11ClN4O4S/c19-11-1-3-12(4-2-11)20-17(24)22-18-21-14(9-28-18)16-8-10-7-13(23(25)26)5-6-15(10)27-16/h1-9H,(H2,20,21,22,24) VBCXDEQSQSZOBI-UHFFFAOYSA-N 50119109 CHEMBL3617397 Cholinesterase 26610 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50119109 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50119109&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190234 104012357 CHEMBL3617397 ZINC13818786 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409309 [O-][N+](=O)c1ccc2oc(cc2c1)-c1csc(NC(=O)Nc2ccc(Br)cc2)n1 InChI=1S/C18H11BrN4O4S/c19-11-1-3-12(4-2-11)20-17(24)22-18-21-14(9-28-18)16-8-10-7-13(23(25)26)5-6-15(10)27-16/h1-9H,(H2,20,21,22,24) CTKNCRMYRUSOHV-UHFFFAOYSA-N 50119170 CHEMBL3617398 Cholinesterase 34500 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50119170 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50119170&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190235 319565803 CHEMBL3617398 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409310 [O-][N+](=O)c1ccc2oc(cc2c1)-c1csc(NC(=O)Nc2ccc(I)cc2)n1 InChI=1S/C18H11IN4O4S/c19-11-1-3-12(4-2-11)20-17(24)22-18-21-14(9-28-18)16-8-10-7-13(23(25)26)5-6-15(10)27-16/h1-9H,(H2,20,21,22,24) GYPCSABGLCTXBJ-UHFFFAOYSA-N 50119275 CHEMBL3617399 Cholinesterase 2030 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50119275 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50119275&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122190236 319565804 CHEMBL3617399 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50409311 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 17380 ChEMBL 10.1016/j.ejmech.2015.07.005 10.7270/Q2JM2CFX 26244990 Kurt, BZ; Gazioglu, I; Basile, L; Sonmez, F; Ginex, T; Kucukislamoglu, M; Guccione, S Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50400919 Cl.CN(C)c1ccc(cc1)C(=O)NCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C24H28N4O.ClH/c1-28(2)18-13-11-17(12-14-18)24(29)26-16-15-25-23-19-7-3-5-9-21(19)27-22-10-6-4-8-20(22)23;/h3,5,7,9,11-14H,4,6,8,10,15-16H2,1-2H3,(H,25,27)(H,26,29);1H PFASXTGIKQFHMF-UHFFFAOYSA-N 50114361 CHEMBL3604192 Cholinesterase 0.500000 ChEMBL 10.1016/j.bmc.2015.07.029 10.7270/Q25T3N9G 26242241 Bajda, M; Jonczyk, J; Malawska, B; Czarnecka, K; Girek, M; Olszewska, P; Sikora, J; Mikiciuk-Olasik, E; Skibinski, R; Gumieniczek, A; Szymanski, P Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50114361 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50114361&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122185531 319493870 CHEMBL3604192 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50400920 Cl.CN(C)c1ccc(cc1)C(=O)NCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C25H30N4O.ClH/c1-29(2)19-14-12-18(13-15-19)25(30)27-17-7-16-26-24-20-8-3-5-10-22(20)28-23-11-6-4-9-21(23)24;/h3,5,8,10,12-15H,4,6-7,9,11,16-17H2,1-2H3,(H,26,28)(H,27,30);1H YKUSXCRXKNMUMG-UHFFFAOYSA-N 50114362 CHEMBL3604193 Cholinesterase 73 ChEMBL 10.1016/j.bmc.2015.07.029 10.7270/Q25T3N9G 26242241 Bajda, M; Jonczyk, J; Malawska, B; Czarnecka, K; Girek, M; Olszewska, P; Sikora, J; Mikiciuk-Olasik, E; Skibinski, R; Gumieniczek, A; Szymanski, P Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50114362 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50114362&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122185533 319493871 CHEMBL3604193 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50400921 Cl.CN(C)c1ccc(cc1)C(=O)NCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C26H32N4O.ClH/c1-30(2)20-15-13-19(14-16-20)26(31)28-18-8-7-17-27-25-21-9-3-5-11-23(21)29-24-12-6-4-10-22(24)25;/h3,5,9,11,13-16H,4,6-8,10,12,17-18H2,1-2H3,(H,27,29)(H,28,31);1H SAXGCXXSOSTHKB-UHFFFAOYSA-N 50114363 CHEMBL3604194 Cholinesterase 7.0 ChEMBL 10.1016/j.bmc.2015.07.029 10.7270/Q25T3N9G 26242241 Bajda, M; Jonczyk, J; Malawska, B; Czarnecka, K; Girek, M; Olszewska, P; Sikora, J; Mikiciuk-Olasik, E; Skibinski, R; Gumieniczek, A; Szymanski, P Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50114363 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50114363&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122185535 319493872 CHEMBL3604194 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50400922 Cl.CN(C)c1ccc(cc1)C(=O)NCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C27H34N4O.ClH/c1-31(2)21-16-14-20(15-17-21)27(32)29-19-9-3-8-18-28-26-22-10-4-6-12-24(22)30-25-13-7-5-11-23(25)26;/h4,6,10,12,14-17H,3,5,7-9,11,13,18-19H2,1-2H3,(H,28,30)(H,29,32);1H LTFRKEIBRWQYPM-UHFFFAOYSA-N 50114364 CHEMBL3604195 Cholinesterase 3.7 ChEMBL 10.1016/j.bmc.2015.07.029 10.7270/Q25T3N9G 26242241 Bajda, M; Jonczyk, J; Malawska, B; Czarnecka, K; Girek, M; Olszewska, P; Sikora, J; Mikiciuk-Olasik, E; Skibinski, R; Gumieniczek, A; Szymanski, P Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50114364 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50114364&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122185537 319493873 CHEMBL3604195 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50400923 Cl.CN(C)c1ccc(cc1)C(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C28H36N4O.ClH/c1-32(2)22-17-15-21(16-18-22)28(33)30-20-10-4-3-9-19-29-27-23-11-5-7-13-25(23)31-26-14-8-6-12-24(26)27;/h5,7,11,13,15-18H,3-4,6,8-10,12,14,19-20H2,1-2H3,(H,29,31)(H,30,33);1H FSIJFGRZTJROBL-UHFFFAOYSA-N 50114365 CHEMBL3604196 Cholinesterase 1.1 ChEMBL 10.1016/j.bmc.2015.07.029 10.7270/Q25T3N9G 26242241 Bajda, M; Jonczyk, J; Malawska, B; Czarnecka, K; Girek, M; Olszewska, P; Sikora, J; Mikiciuk-Olasik, E; Skibinski, R; Gumieniczek, A; Szymanski, P Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50114365 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50114365&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122185539 319493874 CHEMBL3604196 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50400924 Cl.CN(C)c1ccc(cc1)C(=O)NCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C29H38N4O.ClH/c1-33(2)23-18-16-22(17-19-23)29(34)31-21-11-5-3-4-10-20-30-28-24-12-6-8-14-26(24)32-27-15-9-7-13-25(27)28;/h6,8,12,14,16-19H,3-5,7,9-11,13,15,20-21H2,1-2H3,(H,30,32)(H,31,34);1H KLLAKZDRPWAZFJ-UHFFFAOYSA-N 50114366 CHEMBL3604197 Cholinesterase 210 ChEMBL 10.1016/j.bmc.2015.07.029 10.7270/Q25T3N9G 26242241 Bajda, M; Jonczyk, J; Malawska, B; Czarnecka, K; Girek, M; Olszewska, P; Sikora, J; Mikiciuk-Olasik, E; Skibinski, R; Gumieniczek, A; Szymanski, P Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50114366 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50114366&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122185541 319493875 CHEMBL3604197 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50400925 Cl.CN(C)c1ccc(cc1)C(=O)NCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C30H40N4O.ClH/c1-34(2)24-19-17-23(18-20-24)30(35)32-22-12-6-4-3-5-11-21-31-29-25-13-7-9-15-27(25)33-28-16-10-8-14-26(28)29;/h7,9,13,15,17-20H,3-6,8,10-12,14,16,21-22H2,1-2H3,(H,31,33)(H,32,35);1H JQMMSKMSQKBRKA-UHFFFAOYSA-N 50114367 CHEMBL3604198 Cholinesterase 0.700000 ChEMBL 10.1016/j.bmc.2015.07.029 10.7270/Q25T3N9G 26242241 Bajda, M; Jonczyk, J; Malawska, B; Czarnecka, K; Girek, M; Olszewska, P; Sikora, J; Mikiciuk-Olasik, E; Skibinski, R; Gumieniczek, A; Szymanski, P Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50114367 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50114367&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122185543 319493876 CHEMBL3604198 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50400926 Cl.CN(C)c1ccc(cc1)C(=O)NCCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C31H42N4O.ClH/c1-35(2)25-20-18-24(19-21-25)31(36)33-23-13-7-5-3-4-6-12-22-32-30-26-14-8-10-16-28(26)34-29-17-11-9-15-27(29)30;/h8,10,14,16,18-21H,3-7,9,11-13,15,17,22-23H2,1-2H3,(H,32,34)(H,33,36);1H KGNOCGDSAXDLPI-UHFFFAOYSA-N 50114368 CHEMBL3604199 Cholinesterase 0.700000 ChEMBL 10.1016/j.bmc.2015.07.029 10.7270/Q25T3N9G 26242241 Bajda, M; Jonczyk, J; Malawska, B; Czarnecka, K; Girek, M; Olszewska, P; Sikora, J; Mikiciuk-Olasik, E; Skibinski, R; Gumieniczek, A; Szymanski, P Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50114368 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50114368&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122185545 319493877 CHEMBL3604199 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50400927 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 4.7 ChEMBL 10.1016/j.bmc.2015.07.029 10.7270/Q25T3N9G 26242241 Bajda, M; Jonczyk, J; Malawska, B; Czarnecka, K; Girek, M; Olszewska, P; Sikora, J; Mikiciuk-Olasik, E; Skibinski, R; Gumieniczek, A; Szymanski, P Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50407466 COc1cc(\C=C\C(=O)SSC(=O)\C=C\c2ccc(O)c(OC)c2)ccc1O InChI=1S/C18H14N4S/c1-12-21-17(10-23-12)13-5-4-6-14(9-13)22-18-15-7-2-3-8-16(15)19-11-20-18/h2-11H,1H3,(H,19,20,22) ZCEZJALGTMNIID-UHFFFAOYSA-N 50117941 CHEMBL3612823 Cholinesterase 12870 ChEMBL 10.1016/j.bmc.2015.08.024 10.7270/Q2W097QD 26337018 Manral, A; Saini, V; Meena, P; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50117941 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50117941&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11109949 104011345 CHEMBL3612823 C00693 ZINC13490839 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50407468 COc1ccc(\C=C\C(=O)SSC(=O)\C=C\c2ccc(OC)cc2OC)c(OC)c1 InChI=1S/C24H27N5O2S/c1-4-30-21-12-18-19(13-22(21)31-5-2)28-23(9-10-25)29-24(18)27-17-8-6-7-16(11-17)20-14-32-15(3)26-20/h6-8,11-14H,4-5,9-10,25H2,1-3H3,(H,27,28,29) RYEPNRLVIGUAKF-UHFFFAOYSA-N 50117942 CHEMBL3612824 Cholinesterase 14890 ChEMBL 10.1016/j.bmc.2015.08.024 10.7270/Q2W097QD 26337018 Manral, A; Saini, V; Meena, P; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50117942 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50117942&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10182347 104011346 CHEMBL3612824 C00693 ZINC13490835 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50407471 Clc1cccc(\C=C\CSSC\C=C\c2cccc(Cl)c2)c1 InChI=1S/C22H21BrN4O2S/c1-4-28-20-9-15-17(10-21(20)29-5-2)24-12-25-22(15)27-18-8-14(6-7-16(18)23)19-11-30-13(3)26-19/h6-12H,4-5H2,1-3H3,(H,24,25,27) SIBFBOZEZCEYIA-UHFFFAOYSA-N 50117943 CHEMBL3612614 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2015.08.024 10.7270/Q2W097QD 26337018 Manral, A; Saini, V; Meena, P; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50117943 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50117943&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10874564 104011347 CHEMBL3612614 C15496 ZINC13490813 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50407473 Fc1cccc(\C=C\CSSC\C=C\c2cccc(F)c2)c1 InChI=1S/C22H22N4O2S/c1-4-8-28-21-11-18-17(10-20(21)27-3)22(24-13-23-18)26-16-7-5-6-15(9-16)19-12-29-14(2)25-19/h5-7,9-13H,4,8H2,1-3H3,(H,23,24,26) HJJQEMWWLBZXAO-UHFFFAOYSA-N 50117944 CHEMBL3612613 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2015.08.024 10.7270/Q2W097QD 26337018 Manral, A; Saini, V; Meena, P; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50117944 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50117944&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10173069 104011348 CHEMBL3612613 C15496 ZINC13490842 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50407475 Fc1ccccc1\C=C\CSSC\C=C\c1ccccc1F InChI=1S/C23H25N5O2S/c1-4-29-20-10-17-18(11-21(20)30-5-2)27-22(12-24)28-23(17)26-16-8-6-7-15(9-16)19-13-31-14(3)25-19/h6-11,13H,4-5,12,24H2,1-3H3,(H,26,27,28) KZIIYQLZCQFDPE-UHFFFAOYSA-N 50117945 CHEMBL3612612 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2015.08.024 10.7270/Q2W097QD 26337018 Manral, A; Saini, V; Meena, P; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50117945 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50117945&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10310248 104011349 CHEMBL3612612 C15496 ZINC13490828 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50407476 Oc1ccc(\C=C\CSSC\C=C\c2ccc(O)cc2)cc1 InChI=1S/C24H26N4O3S/c1-5-29-21-9-8-16(20-13-32-15(4)27-20)10-19(21)28-24-17-11-22(30-6-2)23(31-7-3)12-18(17)25-14-26-24/h8-14H,5-7H2,1-4H3,(H,25,26,28) VAUIVXCZTMIWGL-UHFFFAOYSA-N 50117946 CHEMBL3612620 Cholinesterase 63010 ChEMBL 10.1016/j.bmc.2015.08.024 10.7270/Q2W097QD 26337018 Manral, A; Saini, V; Meena, P; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50117946 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50117946&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10895650 104011350 CHEMBL3612620 C15496 ZINC13490812 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50407478 COc1ccc(\C=C\CSSC\C=C\c2ccc(OC)cc2)cc1 InChI=1S/C25H25N3O2/c1-4-29-23-14-21-22(15-24(23)30-5-2)26-16-27-25(21)28-20-11-7-10-19(13-20)18-9-6-8-17(3)12-18/h6-16H,4-5H2,1-3H3,(H,26,27,28) FEANNKPAELZFMT-UHFFFAOYSA-N 50117948 CHEMBL365207 Cholinesterase 59540 ChEMBL 10.1016/j.bmc.2015.08.024 10.7270/Q2W097QD 26337018 Manral, A; Saini, V; Meena, P; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50117948 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50117948&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11014847 104011352 CHEMBL365207 C15496 ZINC13490799 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50407480 COc1ccc(\C=C\CSSC\C=C\c2ccc(OC)c(OC)c2)cc1OC InChI=1S/C23H24N4O2S/c1-4-5-9-29-22-11-18-19(12-21(22)28-3)24-14-25-23(18)27-17-8-6-7-16(10-17)20-13-30-15(2)26-20/h6-8,10-14H,4-5,9H2,1-3H3,(H,24,25,27) GMHDMHFXAUFHHL-UHFFFAOYSA-N 50117949 CHEMBL3612621 Cholinesterase 55210 ChEMBL 10.1016/j.bmc.2015.08.024 10.7270/Q2W097QD 26337018 Manral, A; Saini, V; Meena, P; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50117949 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50117949&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11048070 104011353 CHEMBL3612621 C15496 ZINC13490852 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50407482 COc1cc(\C=C\CSSC\C=C\c2ccc(O)c(OC)c2)ccc1O InChI=1S/C24H26N4O3S/c1-5-29-20-12-18-21(23(31-7-3)22(20)30-6-2)25-14-26-24(18)28-17-10-8-9-16(11-17)19-13-32-15(4)27-19/h8-14H,5-7H2,1-4H3,(H,25,26,28) TVEGBIXFMLXVRK-UHFFFAOYSA-N 50117950 CHEMBL3612815 Cholinesterase 57890 ChEMBL 10.1016/j.bmc.2015.08.024 10.7270/Q2W097QD 26337018 Manral, A; Saini, V; Meena, P; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50117950 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50117950&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11004874 104011354 CHEMBL3612815 C15496 ZINC13490856 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50407484 Fc1ccc(\C=C\C(=O)SSC(=O)\C=C\c2ccc(F)cc2)cc1 InChI=1S/C25H29N5O2S/c1-5-26-14-24-29-20-13-23(32-7-3)22(31-6-2)12-19(20)25(30-24)28-18-10-8-9-17(11-18)21-15-33-16(4)27-21/h8-13,15,26H,5-7,14H2,1-4H3,(H,28,29,30) BVMOKLDKPAMGSW-UHFFFAOYSA-N 50117951 CHEMBL3612816 Cholinesterase 32410 ChEMBL 10.1016/j.bmc.2015.08.024 10.7270/Q2W097QD 26337018 Manral, A; Saini, V; Meena, P; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50117951 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50117951&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10288574 104011355 CHEMBL3612816 C00693 ZINC13490830 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50407486 Clc1ccc(\C=C\C(=O)SSC(=O)\C=C\c2ccc(Cl)cc2)cc1 InChI=1S/C26H30N4O2S/c1-6-31-23-13-20-21(14-24(23)32-7-2)29-25(11-16(3)4)30-26(20)28-19-10-8-9-18(12-19)22-15-33-17(5)27-22/h8-10,12-16H,6-7,11H2,1-5H3,(H,28,29,30) GFPOCNYTLFNRFU-UHFFFAOYSA-N 50117953 CHEMBL3612817 Cholinesterase 35620 ChEMBL 10.1016/j.bmc.2015.08.024 10.7270/Q2W097QD 26337018 Manral, A; Saini, V; Meena, P; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50117953 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50117953&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10173929 104011357 CHEMBL3612817 C00693 ZINC13490832 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50407488 Brc1cccc(\C=C\C(=O)SSC(=O)\C=C\c2cccc(Br)c2)c1 InChI=1S/C25H25N3O2/c1-4-29-23-14-21-22(15-24(23)30-5-2)26-16-27-25(21)28-20-8-6-7-19(13-20)18-11-9-17(3)10-12-18/h6-16H,4-5H2,1-3H3,(H,26,27,28) GBHDWFYFZREIHX-UHFFFAOYSA-N 50117954 CHEMBL3612818 Cholinesterase 38740 ChEMBL 10.1016/j.bmc.2015.08.024 10.7270/Q2W097QD 26337018 Manral, A; Saini, V; Meena, P; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50117954 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50117954&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10862259 104011358 CHEMBL3612818 C00693 ZINC13490800 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50407490 Brc1ccc(\C=C\C(=O)SSC(=O)\C=C\c2ccc(Br)cc2)cc1 InChI=1S/C22H21ClN4O2S/c1-4-28-20-9-15-17(10-21(20)29-5-2)24-12-25-22(15)27-18-8-14(6-7-16(18)23)19-11-30-13(3)26-19/h6-12H,4-5H2,1-3H3,(H,24,25,27) OFPHEYBWHAZQED-UHFFFAOYSA-N 50117956 CHEMBL3612819 Cholinesterase 37180 ChEMBL 10.1016/j.bmc.2015.08.024 10.7270/Q2W097QD 26337018 Manral, A; Saini, V; Meena, P; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50117956 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50117956&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11091471 104011360 CHEMBL3612819 C00693 ZINC13490808 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50407492 Oc1ccc(\C=C\C(=O)SSC(=O)\C=C\c2ccc(O)cc2)cc1 InChI=1S/C20H21N3O3/c1-4-25-18-10-16-17(11-19(18)26-5-2)21-12-22-20(16)23-15-8-6-7-14(9-15)13(3)24/h6-12H,4-5H2,1-3H3,(H,21,22,23) QZRGWLSWQIRIHZ-UHFFFAOYSA-N 50117958 CHEMBL3612820 Cholinesterase 24540 ChEMBL 10.1016/j.bmc.2015.08.024 10.7270/Q2W097QD 26337018 Manral, A; Saini, V; Meena, P; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50117958 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50117958&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11727859 104011362 CHEMBL3612820 C00693 ZINC13490785 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50407494 COc1ccc(\C=C\C(=O)SSC(=O)\C=C\c2ccc(OC)cc2)cc1 InChI=1S/C23H22N4O2/c1-3-28-21-12-19-20(13-22(21)29-4-2)25-15-26-23(19)27-18-9-5-7-16(11-18)17-8-6-10-24-14-17/h5-15H,3-4H2,1-2H3,(H,25,26,27) DQFIXDJSYWQSRS-UHFFFAOYSA-N 50117959 CHEMBL3612821 Cholinesterase 15980 ChEMBL 10.1016/j.bmc.2015.08.024 10.7270/Q2W097QD 26337018 Manral, A; Saini, V; Meena, P; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50117959 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50117959&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10126505 104011363 CHEMBL3612821 C00693 ZINC13490796 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50407496 COc1ccc(\C=C\C(=O)SSC(=O)\C=C\c2ccc(OC)c(OC)c2)cc1OC InChI=1S/C23H24N4O3S/c1-4-29-20-10-17-18(11-21(20)30-5-2)24-14-25-23(17)26-16-8-6-7-15(9-16)19-13-31-22(27-19)12-28-3/h6-11,13-14H,4-5,12H2,1-3H3,(H,24,25,26) COXZBNXECHGGGN-UHFFFAOYSA-N 50117962 CHEMBL3612822 Cholinesterase 13640 ChEMBL 10.1016/j.bmc.2015.08.024 10.7270/Q2W097QD 26337018 Manral, A; Saini, V; Meena, P; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50117962 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50117962&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10173537 104011366 CHEMBL3612822 C00693 ZINC13490776 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50407514 Brc1ccc(\C=C\CSSC\C=C\c2ccc(Br)cc2)cc1 InChI=1S/C22H20N4O4S/c1-3-29-18-9-15-16(10-19(18)30-4-2)23-12-24-20(15)25-14-7-5-6-13(8-14)17-11-31-21(26-17)22(27)28/h5-12H,3-4H2,1-2H3,(H,27,28)(H,23,24,25) RHSLAWKWZRBHIL-UHFFFAOYSA-N 50117963 CHEMBL3612619 Cholinesterase 72490 ChEMBL 10.1016/j.bmc.2015.08.024 10.7270/Q2W097QD 26337018 Manral, A; Saini, V; Meena, P; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50117963 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50117963&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11761903 104011367 CHEMBL3612619 C15496 ZINC13490783 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50407551 Brc1cccc(\C=C\CSSC\C=C\c2cccc(Br)c2)c1 InChI=1S/C25H27ClN4O2S/c1-4-31-22-13-19-20(14-23(22)32-5-2)29-24(10-7-11-26)30-25(19)28-18-9-6-8-17(12-18)21-15-33-16(3)27-21/h6,8-9,12-15H,4-5,7,10-11H2,1-3H3,(H,28,29,30) AYOJFONFAZWCIP-UHFFFAOYSA-N 50117964 CHEMBL3612618 Cholinesterase 75410 ChEMBL 10.1016/j.bmc.2015.08.024 10.7270/Q2W097QD 26337018 Manral, A; Saini, V; Meena, P; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50117964 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50117964&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10152087 104011368 CHEMBL3612618 C15496 ZINC13490824 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50407632 Clc1ccc(\C=C\CSSC\C=C\c2ccc(Cl)cc2)cc1 InChI=1S/C23H24N4O2S/c1-5-14(2)29-22-11-19-18(10-21(22)28-4)23(25-13-24-19)27-17-8-6-7-16(9-17)20-12-30-15(3)26-20/h6-14H,5H2,1-4H3,(H,24,25,27) KQEHXCRMWRBQOF-UHFFFAOYSA-N 50117965 CHEMBL3612617 Cholinesterase 94160 ChEMBL 10.1016/j.bmc.2015.08.024 10.7270/Q2W097QD 26337018 Manral, A; Saini, V; Meena, P; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50117965 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50117965&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10151053 104011369 CHEMBL3612617 C15496 ZINC13490846 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50407648 Fc1cccc(F)c1\C=C\CSSC\C=C\c1c(F)cccc1F InChI=1S/C27H24N4O2S/c1-3-32-24-14-21-22(15-25(24)33-4-2)28-17-29-26(21)30-20-12-8-11-19(13-20)23-16-34-27(31-23)18-9-6-5-7-10-18/h5-17H,3-4H2,1-2H3,(H,28,29,30) QTWCHVULPWQWNI-UHFFFAOYSA-N 50117966 CHEMBL3612616 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2015.08.024 10.7270/Q2W097QD 26337018 Manral, A; Saini, V; Meena, P; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50117966 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50117966&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11733351 104011370 CHEMBL3612616 C15496 ZINC13490774 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50407770 Clc1cc(Cl)cc(\C=C\CSSC\C=C\c2cc(Cl)cc(Cl)c2)c1 InChI=1S/C22H23N5O2S/c1-4-28-19-10-16-17(11-20(19)29-5-2)24-13-25-21(16)26-15-8-6-7-14(9-15)18-12-30-22(23-3)27-18/h6-13H,4-5H2,1-3H3,(H,23,27)(H,24,25,26) HLIUJAVSRUBDBP-UHFFFAOYSA-N 50117967 CHEMBL3612615 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2015.08.024 10.7270/Q2W097QD 26337018 Manral, A; Saini, V; Meena, P; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50117967 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50117967&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10216516 104011371 CHEMBL3612615 C15496 ZINC13490778 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50407772 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 8710 ChEMBL 10.1016/j.bmc.2015.08.024 10.7270/Q2W097QD 26337018 Manral, A; Saini, V; Meena, P; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50420939 C[N+](C)(C)c1cc(O)cc(OCCCOc2cc(O)cc(c2)[N+](C)(C)C)c1 InChI=1S/C21H30N2O4/c1-22(2,3)16-10-18(24)14-20(12-16)26-8-7-9-27-21-13-17(23(4,5)6)11-19(25)15-21/h10-15H,7-9H2,1-6H3/p+2 KYKAASBPZQEFMK-UHFFFAOYSA-P 50262878 3-hydroxy-5-(3-(3-hydroxy-5-(trimethylammonio)phenoxy)propoxy)-N,N,N-trimethylbenzenaminium iodide::CHEMBL477140 Cholinesterase 718 ChEMBL 10.1016/j.bmc.2008.06.022 10.7270/Q2NC611F 18585045 Leonetti, F; Catto, M; Nicolotti, O; Pisani, L; Cappa, A; Stefanachi, A; Carotti, A Università di Bari http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262878 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262878&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44578477 104111422 CHEMBL477140 ZINC40918477 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50420940 C[N+](C)(C)c1cccc(OCCCCOc2cccc(c2)[N+](C)(C)C)c1 InChI=1S/C22H34N2O2/c1-23(2,3)19-11-9-13-21(17-19)25-15-7-8-16-26-22-14-10-12-20(18-22)24(4,5)6/h9-14,17-18H,7-8,15-16H2,1-6H3/q+2 JJKOOCPIEAVPCW-UHFFFAOYSA-N 50262928 3,3'-(butane-1,4-diylbis(oxy)bis(N,N,N-trimethyl-benzenaminium iodide)::CHEMBL478194 Cholinesterase 2344 ChEMBL 10.1016/j.bmc.2008.06.022 10.7270/Q2NC611F 18585045 Leonetti, F; Catto, M; Nicolotti, O; Pisani, L; Cappa, A; Stefanachi, A; Carotti, A Università di Bari http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262928 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262928&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44578515 104111451 CHEMBL478194 ZINC40918216 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50420941 Cc1c(C)c(=O)oc2cc(OCCCCOc3cc(O)cc(c3)[N+](C)(C)C)ccc12 InChI=1S/C24H29NO5/c1-16-17(2)24(27)30-23-15-20(8-9-22(16)23)28-10-6-7-11-29-21-13-18(25(3,4)5)12-19(26)14-21/h8-9,12-15H,6-7,10-11H2,1-5H3/p+1 BHQTWYSLIIBIGC-UHFFFAOYSA-O 50262926 3-(4-(3,4-dimethyl-2-oxo-2H-chromen-7-yloxy)butoxy)-5-hydroxy-N,N,N-trimethylbenzenaminium iodide::CHEMBL478193 Cholinesterase 708 ChEMBL 10.1016/j.bmc.2008.06.022 10.7270/Q2NC611F 18585045 Leonetti, F; Catto, M; Nicolotti, O; Pisani, L; Cappa, A; Stefanachi, A; Carotti, A Università di Bari http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262926 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262926&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44578511 104111449 CHEMBL478193 ZINC40918214 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50420942 Cc1c(C)c(=O)oc2cc(OCCCOc3cc(O)cc(c3)[N+](C)(C)C)ccc12 InChI=1S/C23H27NO5/c1-15-16(2)23(26)29-22-14-19(7-8-21(15)22)27-9-6-10-28-20-12-17(24(3,4)5)11-18(25)13-20/h7-8,11-14H,6,9-10H2,1-5H3/p+1 VSMMAJBKBSEGTH-UHFFFAOYSA-O 50262880 3-(3-(3,4-dimethyl-2-oxo-2H-chromen-7-yloxy)propoxy)-5-hydroxy-N,N,N-trimethylbenzenaminium iodide::CHEMBL514534 Cholinesterase 1060 ChEMBL 10.1016/j.bmc.2008.06.022 10.7270/Q2NC611F 18585045 Leonetti, F; Catto, M; Nicolotti, O; Pisani, L; Cappa, A; Stefanachi, A; Carotti, A Università di Bari http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262880 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262880&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44578480 104111424 CHEMBL514534 ZINC40407273 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50420943 C[N+](C)(C)c1cc(O)cc(OCCCCOc2cc(O)cc(c2)[N+](C)(C)C)c1 InChI=1S/C22H32N2O4/c1-23(2,3)17-11-19(25)15-21(13-17)27-9-7-8-10-28-22-14-18(24(4,5)6)12-20(26)16-22/h11-16H,7-10H2,1-6H3/p+2 IFCAHYWTXKINIF-UHFFFAOYSA-P 50262879 3-hydroxy-5-(4-(3-hydroxy-5-(trimethylammonio)phenoxy)butoxy)-N,N,N-trimethylbenzenaminium iodide::CHEMBL477141 Cholinesterase 715 ChEMBL 10.1016/j.bmc.2008.06.022 10.7270/Q2NC611F 18585045 Leonetti, F; Catto, M; Nicolotti, O; Pisani, L; Cappa, A; Stefanachi, A; Carotti, A Università di Bari http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262879 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262879&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 25147718 104111423 CHEMBL477141 ZINC40918478 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50430804 [Br-].COc1ccc2C(=O)\C(OCc2c1OC)=C\c1cc[n+](Cc2ccc(cc2)[N+]([O-])=O)cc1 InChI=1S/C24H21N2O6.BrH/c1-30-21-8-7-19-20(24(21)31-2)15-32-22(23(19)27)13-16-9-11-25(12-10-16)14-17-3-5-18(6-4-17)26(28)29;/h3-13H,14-15H2,1-2H3;1H/q+1;/p-1/b22-13-; DXLAIDIHGAHXBQ-BWLGBDCWSA-M 50128524 CHEMBL3628626 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2015.09.063 10.7270/Q2B56MKS 26454504 Wang, C; Wu, Z; Cai, H; Xu, S; Liu, J; Jiang, J; Yao, H; Wu, X; Xu, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50128524 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50128524&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122193633 104020288 CHEMBL3628626 ZINC26386176 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50430805 [Br-].COc1ccccc1C[n+]1ccc(\C=C2/OCc3c(OC)c(OC)ccc3C2=O)cc1 InChI=1S/C25H24NO5.BrH/c1-28-21-7-5-4-6-18(21)15-26-12-10-17(11-13-26)14-23-24(27)19-8-9-22(29-2)25(30-3)20(19)16-31-23;/h4-14H,15-16H2,1-3H3;1H/q+1;/p-1/b23-14-; MVNYSGFWRIUMIO-BJMORVNCSA-M 50128525 CHEMBL3628618 Cholinesterase 8790 ChEMBL 10.1016/j.bmcl.2015.09.063 10.7270/Q2B56MKS 26454504 Wang, C; Wu, Z; Cai, H; Xu, S; Liu, J; Jiang, J; Yao, H; Wu, X; Xu, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50128525 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50128525&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122193617 104020289 CHEMBL3628618 ZINC26376922 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50430806 [Br-].COc1cccc(C[n+]2ccc(\C=C3/OCc4c(OC)c(OC)ccc4C3=O)cc2)c1 InChI=1S/C25H24NO5.BrH/c1-28-19-6-4-5-18(13-19)15-26-11-9-17(10-12-26)14-23-24(27)20-7-8-22(29-2)25(30-3)21(20)16-31-23;/h4-14H,15-16H2,1-3H3;1H/q+1;/p-1/b23-14-; ZKIUJYPVSCGWLM-BJMORVNCSA-M 50128526 CHEMBL3628619 Cholinesterase 3060 ChEMBL 10.1016/j.bmcl.2015.09.063 10.7270/Q2B56MKS 26454504 Wang, C; Wu, Z; Cai, H; Xu, S; Liu, J; Jiang, J; Yao, H; Wu, X; Xu, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50128526 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50128526&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122193619 104020290 CHEMBL3628619 ZINC13520459 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50430807 [Br-].COc1ccc(C[n+]2ccc(\C=C3/OCc4c(OC)c(OC)ccc4C3=O)cc2)cc1 InChI=1S/C25H24NO5.BrH/c1-28-19-6-4-18(5-7-19)15-26-12-10-17(11-13-26)14-23-24(27)20-8-9-22(29-2)25(30-3)21(20)16-31-23;/h4-14H,15-16H2,1-3H3;1H/q+1;/p-1/b23-14-; SDVUZRBLKOJFKD-BJMORVNCSA-M 50128527 CHEMBL3628620 Cholinesterase 4330 ChEMBL 10.1016/j.bmcl.2015.09.063 10.7270/Q2B56MKS 26454504 Wang, C; Wu, Z; Cai, H; Xu, S; Liu, J; Jiang, J; Yao, H; Wu, X; Xu, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50128527 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50128527&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122193621 104020291 CHEMBL3628620 ZINC26382202 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50431017 [Br-].COc1ccc2C(=O)\C(OCc2c1OC)=C\c1cc[n+](Cc2ccc(F)cc2)cc1 InChI=1S/C24H21FNO4.BrH/c1-28-21-8-7-19-20(24(21)29-2)15-30-22(23(19)27)13-16-9-11-26(12-10-16)14-17-3-5-18(25)6-4-17;/h3-13H,14-15H2,1-2H3;1H/q+1;/p-1/b22-13-; HGHARBHXQNXYRK-BWLGBDCWSA-M 50128528 CHEMBL3628617 Cholinesterase 2070 ChEMBL 10.1016/j.bmcl.2015.09.063 10.7270/Q2B56MKS 26454504 Wang, C; Wu, Z; Cai, H; Xu, S; Liu, J; Jiang, J; Yao, H; Wu, X; Xu, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50128528 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50128528&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122193615 104020292 CHEMBL3628617 ZINC13520483 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50431018 [Br-].COc1ccc2C(=O)\C(OCc2c1OC)=C\c1cc[n+](Cc2cccc(c2)[N+]([O-])=O)cc1 InChI=1S/C24H21N2O6.BrH/c1-30-21-7-6-19-20(24(21)31-2)15-32-22(23(19)27)13-16-8-10-25(11-9-16)14-17-4-3-5-18(12-17)26(28)29;/h3-13H,14-15H2,1-2H3;1H/q+1;/p-1/b22-13-; BLHPKPOXRHQXBK-BWLGBDCWSA-M 50128541 CHEMBL3628625 Cholinesterase 29160 ChEMBL 10.1016/j.bmcl.2015.09.063 10.7270/Q2B56MKS 26454504 Wang, C; Wu, Z; Cai, H; Xu, S; Liu, J; Jiang, J; Yao, H; Wu, X; Xu, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50128541 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50128541&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122193631 321902704 CHEMBL3628625 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50431019 [Br-].COc1ccc2C(=O)\C(OCc2c1OC)=C\c1cc[n+](Cc2ccccc2Cl)cc1 InChI=1S/C24H21ClNO4.BrH/c1-28-21-8-7-18-19(24(21)29-2)15-30-22(23(18)27)13-16-9-11-26(12-10-16)14-17-5-3-4-6-20(17)25;/h3-13H,14-15H2,1-2H3;1H/q+1;/p-1/b22-13-; JTNDQEHNJUIOMS-BWLGBDCWSA-M 50128545 CHEMBL3628621 Cholinesterase 3640 ChEMBL 10.1016/j.bmcl.2015.09.063 10.7270/Q2B56MKS 26454504 Wang, C; Wu, Z; Cai, H; Xu, S; Liu, J; Jiang, J; Yao, H; Wu, X; Xu, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50128545 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50128545&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122193623 104020308 CHEMBL3628621 ZINC13520653 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50431020 [Br-].COc1ccc2C(=O)\C(OCc2c1OC)=C\c1cc[n+](Cc2cccc(Cl)c2)cc1 InChI=1S/C24H21ClNO4.BrH/c1-28-21-7-6-19-20(24(21)29-2)15-30-22(23(19)27)13-16-8-10-26(11-9-16)14-17-4-3-5-18(25)12-17;/h3-13H,14-15H2,1-2H3;1H/q+1;/p-1/b22-13-; OFGUGWDMEPSKAG-BWLGBDCWSA-M 50128549 CHEMBL3628622 Cholinesterase 9920 ChEMBL 10.1016/j.bmcl.2015.09.063 10.7270/Q2B56MKS 26454504 Wang, C; Wu, Z; Cai, H; Xu, S; Liu, J; Jiang, J; Yao, H; Wu, X; Xu, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50128549 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50128549&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122193625 104020312 CHEMBL3628622 ZINC13520634 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50431024 [Br-].COc1ccc2C(=O)\C(OCc2c1OC)=C\c1cc[n+](Cc2ccccc2)cc1 InChI=1S/C24H22NO4.BrH/c1-27-21-9-8-19-20(24(21)28-2)16-29-22(23(19)26)14-17-10-12-25(13-11-17)15-18-6-4-3-5-7-18;/h3-14H,15-16H2,1-2H3;1H/q+1;/p-1/b22-14-; KGIRVUJWIWXLJX-YDHFHHHVSA-M 50128553 CHEMBL3628614 Cholinesterase 6870 ChEMBL 10.1016/j.bmcl.2015.09.063 10.7270/Q2B56MKS 26454504 Wang, C; Wu, Z; Cai, H; Xu, S; Liu, J; Jiang, J; Yao, H; Wu, X; Xu, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50128553 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50128553&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122193609 104020316 CHEMBL3628614 ZINC03979066 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50431026 [Br-].COc1ccc2C(=O)\C(OCc2c1OC)=C\c1cc[n+](Cc2ccccc2[N+]([O-])=O)cc1 InChI=1S/C24H21N2O6.BrH/c1-30-21-8-7-18-19(24(21)31-2)15-32-22(23(18)27)13-16-9-11-25(12-10-16)14-17-5-3-4-6-20(17)26(28)29;/h3-13H,14-15H2,1-2H3;1H/q+1;/p-1/b22-13-; GZTYEXJFNCPVJZ-BWLGBDCWSA-M 50128559 CHEMBL3628624 Cholinesterase 20920 ChEMBL 10.1016/j.bmcl.2015.09.063 10.7270/Q2B56MKS 26454504 Wang, C; Wu, Z; Cai, H; Xu, S; Liu, J; Jiang, J; Yao, H; Wu, X; Xu, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50128559 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50128559&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122193629 104020322 CHEMBL3628624 ZINC26401736 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50431027 [Br-].COc1ccc2C(=O)\C(OCc2c1OC)=C\c1cc[n+](Cc2ccc(Cl)cc2)cc1 InChI=1S/C24H21ClNO4.BrH/c1-28-21-8-7-19-20(24(21)29-2)15-30-22(23(19)27)13-16-9-11-26(12-10-16)14-17-3-5-18(25)6-4-17;/h3-13H,14-15H2,1-2H3;1H/q+1;/p-1/b22-13-; IBWAYAGKZUVIJW-BWLGBDCWSA-M 50128562 CHEMBL3628623 Cholinesterase 3560 ChEMBL 10.1016/j.bmcl.2015.09.063 10.7270/Q2B56MKS 26454504 Wang, C; Wu, Z; Cai, H; Xu, S; Liu, J; Jiang, J; Yao, H; Wu, X; Xu, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50128562 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50128562&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122193627 104020325 CHEMBL3628623 ZINC13520660 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50431031 [Br-].COc1ccc2C(=O)\C(OCc2c1OC)=C\c1cc[n+](Cc2ccccc2F)cc1 InChI=1S/C24H21FNO4.BrH/c1-28-21-8-7-18-19(24(21)29-2)15-30-22(23(18)27)13-16-9-11-26(12-10-16)14-17-5-3-4-6-20(17)25;/h3-13H,14-15H2,1-2H3;1H/q+1;/p-1/b22-13-; XKAFYQUOCBMVIU-BWLGBDCWSA-M 50128566 CHEMBL3628615 Cholinesterase 4410 ChEMBL 10.1016/j.bmcl.2015.09.063 10.7270/Q2B56MKS 26454504 Wang, C; Wu, Z; Cai, H; Xu, S; Liu, J; Jiang, J; Yao, H; Wu, X; Xu, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50128566 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50128566&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122193611 104020329 CHEMBL3628615 ZINC36323087 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50431032 [Br-].COc1ccc2C(=O)\C(OCc2c1OC)=C\c1cc[n+](Cc2cccc(F)c2)cc1 InChI=1S/C24H21FNO4.BrH/c1-28-21-7-6-19-20(24(21)29-2)15-30-22(23(19)27)13-16-8-10-26(11-9-16)14-17-4-3-5-18(25)12-17;/h3-13H,14-15H2,1-2H3;1H/q+1;/p-1/b22-13-; LYZRUFQBQATURQ-BWLGBDCWSA-M 50128558 CHEMBL3628616 Cholinesterase 9440 ChEMBL 10.1016/j.bmcl.2015.09.063 10.7270/Q2B56MKS 26454504 Wang, C; Wu, Z; Cai, H; Xu, S; Liu, J; Jiang, J; Yao, H; Wu, X; Xu, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50128558 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50128558&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122193613 104020321 CHEMBL3628616 ZINC40449543 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50431035 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 3620 ChEMBL 10.1016/j.bmcl.2015.09.063 10.7270/Q2B56MKS 26454504 Wang, C; Wu, Z; Cai, H; Xu, S; Liu, J; Jiang, J; Yao, H; Wu, X; Xu, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50416584 CCN(CC)CCOc1ccc(\C=C2/CCn3c2nc2ccccc2c3=O)cc1 InChI=1S/C24H27N3O2/c1-3-26(4-2)15-16-29-20-11-9-18(10-12-20)17-19-13-14-27-23(19)25-22-8-6-5-7-21(22)24(27)28/h5-12,17H,3-4,13-16H2,1-2H3/b19-17+ JYXQZWJZHPOXSH-HTXNQAPBSA-N 50244217 3-(4-(2-(diethylamino)ethoxy)benzylidene)-2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-one::CHEMBL515199 Cholinesterase 12670 ChEMBL 10.1016/j.bmcl.2008.05.039 10.7270/Q2154GTQ 18524585 Pan, L; Tan, JH; Hou, JQ; Huang, SL; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50244217 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50244217&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 24863693 104100286 CHEMBL515199 ZINC40379771 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50416593 O=c1n2CCC(Cc3ccc(OCCN4CCCCC4)cc3)c2nc2ccccc12 InChI=1S/C25H29N3O2/c29-25-22-6-2-3-7-23(22)26-24-20(12-15-28(24)25)18-19-8-10-21(11-9-19)30-17-16-27-13-4-1-5-14-27/h2-3,6-11,20H,1,4-5,12-18H2 VSHZTCRSNWRICE-UHFFFAOYSA-N 50244279 3-(4-(2-(piperidin-1-yl)ethoxy)benzyl)-2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-one::CHEMBL470954 Cholinesterase 8290 ChEMBL 10.1016/j.bmcl.2008.05.039 10.7270/Q2154GTQ 18524585 Pan, L; Tan, JH; Hou, JQ; Huang, SL; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50244279 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50244279&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44561503 104100339 CHEMBL470954 ZINC40892609 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50416594 CCN(CC)CCCOc1ccc(CC2CCn3c2nc2ccccc2c3=O)cc1 InChI=1S/C25H31N3O2/c1-3-27(4-2)15-7-17-30-21-12-10-19(11-13-21)18-20-14-16-28-24(20)26-23-9-6-5-8-22(23)25(28)29/h5-6,8-13,20H,3-4,7,14-18H2,1-2H3 JFLLGMOAKXBLQP-UHFFFAOYSA-N 50244278 3-(4-(3-(diethylamino)propoxy)benzyl)-2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-one::CHEMBL470953 Cholinesterase >20000 ChEMBL 10.1016/j.bmcl.2008.05.039 10.7270/Q2154GTQ 18524585 Pan, L; Tan, JH; Hou, JQ; Huang, SL; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50244278 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50244278&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44561502 104100338 CHEMBL470953 ZINC40892359 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50416595 CCN(CC)CCOc1ccc(CC2CCn3c2nc2ccccc2c3=O)cc1 InChI=1S/C24H29N3O2/c1-3-26(4-2)15-16-29-20-11-9-18(10-12-20)17-19-13-14-27-23(19)25-22-8-6-5-7-21(22)24(27)28/h5-12,19H,3-4,13-17H2,1-2H3 BOPZUSPNSRLAPK-UHFFFAOYSA-N 50244251 3-(4-(2-(diethylamino)ethoxy)benzyl)-2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-one::CHEMBL448673 Cholinesterase >20000 ChEMBL 10.1016/j.bmcl.2008.05.039 10.7270/Q2154GTQ 18524585 Pan, L; Tan, JH; Hou, JQ; Huang, SL; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50244251 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50244251&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44561464 104100313 CHEMBL448673 ZINC40378995 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50416596 O=c1n2CC\C(=C/c3ccc(OCCCN4CCCCC4)cc3)c2nc2ccccc12 InChI=1S/C26H29N3O2/c30-26-23-7-2-3-8-24(23)27-25-21(13-17-29(25)26)19-20-9-11-22(12-10-20)31-18-6-16-28-14-4-1-5-15-28/h2-3,7-12,19H,1,4-6,13-18H2/b21-19+ BNFGDCACLFCEOP-XUTLUUPISA-N 50244250 3-(4-(3-(piperidin-1-yl)propoxy)benzylidene)-2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-one::CHEMBL470966 Cholinesterase 1660 ChEMBL 10.1016/j.bmcl.2008.05.039 10.7270/Q2154GTQ 18524585 Pan, L; Tan, JH; Hou, JQ; Huang, SL; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50244250 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50244250&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44561463 104100312 CHEMBL470966 ZINC40893722 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50416597 O=c1n2CC\C(=C/c3ccc(OCCN4CCCCC4)cc3)c2nc2ccccc12 InChI=1S/C25H27N3O2/c29-25-22-6-2-3-7-23(22)26-24-20(12-15-28(24)25)18-19-8-10-21(11-9-19)30-17-16-27-13-4-1-5-14-27/h2-3,6-11,18H,1,4-5,12-17H2/b20-18+ NWZBAOLXTYKHBF-CZIZESTLSA-N 50244249 3-(4-(2-(piperidin-1-yl)ethoxy)benzylidene)-2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-one::CHEMBL469914 Cholinesterase 2990 ChEMBL 10.1016/j.bmcl.2008.05.039 10.7270/Q2154GTQ 18524585 Pan, L; Tan, JH; Hou, JQ; Huang, SL; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50244249 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50244249&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44561462 104100311 CHEMBL469914 ZINC40894911 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50416598 CCN(CC)CCCOc1ccc(\C=C2/CCn3c2nc2ccccc2c3=O)cc1 InChI=1S/C25H29N3O2/c1-3-27(4-2)15-7-17-30-21-12-10-19(11-13-21)18-20-14-16-28-24(20)26-23-9-6-5-8-22(23)25(28)29/h5-6,8-13,18H,3-4,7,14-17H2,1-2H3/b20-18+ PBXZYLMZCIWSJI-CZIZESTLSA-N 50244248 3-(4-(3-(diethylamino)propoxy)benzylidene)-2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-one::CHEMBL513587 Cholinesterase 7120 ChEMBL 10.1016/j.bmcl.2008.05.039 10.7270/Q2154GTQ 18524585 Pan, L; Tan, JH; Hou, JQ; Huang, SL; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50244248 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50244248&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44561461 104100310 CHEMBL513587 ZINC40913425 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50416599 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 10 ChEMBL 10.1016/j.bmcl.2008.05.039 10.7270/Q2154GTQ 18524585 Pan, L; Tan, JH; Hou, JQ; Huang, SL; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50416602 O=c1n2CCC(Cc3ccc(OCCCN4CCCCC4)cc3)c2nc2ccccc12 InChI=1S/C26H31N3O2/c30-26-23-7-2-3-8-24(23)27-25-21(13-17-29(25)26)19-20-9-11-22(12-10-20)31-18-6-16-28-14-4-1-5-15-28/h2-3,7-12,21H,1,4-6,13-19H2 CMEVQXVSXFVNFH-UHFFFAOYSA-N 50244280 3-(4-(3-(piperidin-1-yl)propoxy)benzyl)-2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-one::CHEMBL512904 Cholinesterase 5720 ChEMBL 10.1016/j.bmcl.2008.05.039 10.7270/Q2154GTQ 18524585 Pan, L; Tan, JH; Hou, JQ; Huang, SL; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50244280 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50244280&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44561504 104100340 CHEMBL512904 ZINC40394600 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50439336 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 540 ChEMBL 10.1016/j.bmcl.2015.10.051 10.7270/Q2J67JQB 26514744 Yerdelen, KO; Koca, M; Anil, B; Sevindik, H; Kasap, Z; Halici, Z; Turkaydin, K; Gunesacar, G Ataturk University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50439337 COc1cc2CC(C(=O)Nc3ccccc3Br)C(=O)c2cc1OC InChI=1S/C18H16BrNO4/c1-23-15-8-10-7-12(17(21)11(10)9-16(15)24-2)18(22)20-14-6-4-3-5-13(14)19/h3-6,8-9,12H,7H2,1-2H3,(H,20,22) GAPNLEWLECCIDA-UHFFFAOYSA-N 50133673 CHEMBL3633495 Cholinesterase 3400 ChEMBL 10.1016/j.bmcl.2015.10.051 10.7270/Q2J67JQB 26514744 Yerdelen, KO; Koca, M; Anil, B; Sevindik, H; Kasap, Z; Halici, Z; Turkaydin, K; Gunesacar, G Ataturk University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50133673 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50133673&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122195312 321903700 CHEMBL3633495 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50439338 COc1cc2CC(C(=O)Nc3ccccc3Cl)C(=O)c2cc1OC InChI=1S/C18H16ClNO4/c1-23-15-8-10-7-12(17(21)11(10)9-16(15)24-2)18(22)20-14-6-4-3-5-13(14)19/h3-6,8-9,12H,7H2,1-2H3,(H,20,22) VJHZDNPGDKWBSH-UHFFFAOYSA-N 50133674 CHEMBL3633494 Cholinesterase 7100 ChEMBL 10.1016/j.bmcl.2015.10.051 10.7270/Q2J67JQB 26514744 Yerdelen, KO; Koca, M; Anil, B; Sevindik, H; Kasap, Z; Halici, Z; Turkaydin, K; Gunesacar, G Ataturk University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50133674 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50133674&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122195311 321903701 CHEMBL3633494 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50439339 COc1cc2CC(C(=O)Nc3ccccc3F)C(=O)c2cc1OC InChI=1S/C18H16FNO4/c1-23-15-8-10-7-12(17(21)11(10)9-16(15)24-2)18(22)20-14-6-4-3-5-13(14)19/h3-6,8-9,12H,7H2,1-2H3,(H,20,22) BTWFYALHGJFPSY-UHFFFAOYSA-N 50133675 CHEMBL3633493 Cholinesterase 3210 ChEMBL 10.1016/j.bmcl.2015.10.051 10.7270/Q2J67JQB 26514744 Yerdelen, KO; Koca, M; Anil, B; Sevindik, H; Kasap, Z; Halici, Z; Turkaydin, K; Gunesacar, G Ataturk University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50133675 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50133675&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122195310 321903702 CHEMBL3633493 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50439340 CCOc1ccccc1NC(=O)C1Cc2cc(OC)c(OC)cc2C1=O InChI=1S/C20H21NO5/c1-4-26-16-8-6-5-7-15(16)21-20(23)14-9-12-10-17(24-2)18(25-3)11-13(12)19(14)22/h5-8,10-11,14H,4,9H2,1-3H3,(H,21,23) PGMMLDYEAFGAOG-UHFFFAOYSA-N 50133613 CHEMBL3633492 Cholinesterase 6620 ChEMBL 10.1016/j.bmcl.2015.10.051 10.7270/Q2J67JQB 26514744 Yerdelen, KO; Koca, M; Anil, B; Sevindik, H; Kasap, Z; Halici, Z; Turkaydin, K; Gunesacar, G Ataturk University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50133613 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50133613&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122195309 104024398 CHEMBL3633492 ZINC13553650 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50439341 COc1ccccc1NC(=O)C1Cc2cc(OC)c(OC)cc2C1=O InChI=1S/C19H19NO5/c1-23-15-7-5-4-6-14(15)20-19(22)13-8-11-9-16(24-2)17(25-3)10-12(11)18(13)21/h4-7,9-10,13H,8H2,1-3H3,(H,20,22) OZMDVZJVXCRYEE-UHFFFAOYSA-N 50133614 CHEMBL3633491 Cholinesterase 4810 ChEMBL 10.1016/j.bmcl.2015.10.051 10.7270/Q2J67JQB 26514744 Yerdelen, KO; Koca, M; Anil, B; Sevindik, H; Kasap, Z; Halici, Z; Turkaydin, K; Gunesacar, G Ataturk University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50133614 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50133614&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122195308 104024399 CHEMBL3633491 ZINC27093464 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50439342 CCc1ccccc1NC(=O)C1Cc2cc(OC)c(OC)cc2C1=O InChI=1S/C20H21NO4/c1-4-12-7-5-6-8-16(12)21-20(23)15-9-13-10-17(24-2)18(25-3)11-14(13)19(15)22/h5-8,10-11,15H,4,9H2,1-3H3,(H,21,23) IWTAUJSTUKWUKV-UHFFFAOYSA-N 50133635 CHEMBL3633490 Cholinesterase 6290 ChEMBL 10.1016/j.bmcl.2015.10.051 10.7270/Q2J67JQB 26514744 Yerdelen, KO; Koca, M; Anil, B; Sevindik, H; Kasap, Z; Halici, Z; Turkaydin, K; Gunesacar, G Ataturk University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50133635 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50133635&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122195307 321903683 CHEMBL3633490 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50439343 COc1cc2CC(C(=O)Nc3ccccc3C)C(=O)c2cc1OC InChI=1S/C19H19NO4/c1-11-6-4-5-7-15(11)20-19(22)14-8-12-9-16(23-2)17(24-3)10-13(12)18(14)21/h4-7,9-10,14H,8H2,1-3H3,(H,20,22) MICVCQXADHILDH-UHFFFAOYSA-N 50133636 CHEMBL3633489 Cholinesterase 3060 ChEMBL 10.1016/j.bmcl.2015.10.051 10.7270/Q2J67JQB 26514744 Yerdelen, KO; Koca, M; Anil, B; Sevindik, H; Kasap, Z; Halici, Z; Turkaydin, K; Gunesacar, G Ataturk University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50133636 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50133636&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122195306 321903684 CHEMBL3633489 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50439344 COc1cc2CC(C(=O)Nc3cccc(Br)c3)C(=O)c2cc1OC InChI=1S/C18H16BrNO4/c1-23-15-7-10-6-14(17(21)13(10)9-16(15)24-2)18(22)20-12-5-3-4-11(19)8-12/h3-5,7-9,14H,6H2,1-2H3,(H,20,22) KOSUCKLBBCJIND-UHFFFAOYSA-N 50133637 CHEMBL3633488 Cholinesterase 2430 ChEMBL 10.1016/j.bmcl.2015.10.051 10.7270/Q2J67JQB 26514744 Yerdelen, KO; Koca, M; Anil, B; Sevindik, H; Kasap, Z; Halici, Z; Turkaydin, K; Gunesacar, G Ataturk University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50133637 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50133637&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122195305 321903685 CHEMBL3633488 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50439345 COc1cc2CC(C(=O)Nc3cccc(Cl)c3)C(=O)c2cc1OC InChI=1S/C18H16ClNO4/c1-23-15-7-10-6-14(17(21)13(10)9-16(15)24-2)18(22)20-12-5-3-4-11(19)8-12/h3-5,7-9,14H,6H2,1-2H3,(H,20,22) CTOFXPTYLFIWMK-UHFFFAOYSA-N 50133638 CHEMBL3633487 Cholinesterase 2240 ChEMBL 10.1016/j.bmcl.2015.10.051 10.7270/Q2J67JQB 26514744 Yerdelen, KO; Koca, M; Anil, B; Sevindik, H; Kasap, Z; Halici, Z; Turkaydin, K; Gunesacar, G Ataturk University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50133638 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50133638&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122195304 321903686 CHEMBL3633487 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50439346 COc1cc2CC(C(=O)Nc3cccc(F)c3)C(=O)c2cc1OC InChI=1S/C18H16FNO4/c1-23-15-7-10-6-14(17(21)13(10)9-16(15)24-2)18(22)20-12-5-3-4-11(19)8-12/h3-5,7-9,14H,6H2,1-2H3,(H,20,22) OKAVUOMJAGALCY-UHFFFAOYSA-N 50133639 CHEMBL3633486 Cholinesterase 2250 ChEMBL 10.1016/j.bmcl.2015.10.051 10.7270/Q2J67JQB 26514744 Yerdelen, KO; Koca, M; Anil, B; Sevindik, H; Kasap, Z; Halici, Z; Turkaydin, K; Gunesacar, G Ataturk University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50133639 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50133639&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122195303 321903687 CHEMBL3633486 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50439347 CCOc1cccc(NC(=O)C2Cc3cc(OC)c(OC)cc3C2=O)c1 InChI=1S/C20H21NO5/c1-4-26-14-7-5-6-13(10-14)21-20(23)16-8-12-9-17(24-2)18(25-3)11-15(12)19(16)22/h5-7,9-11,16H,4,8H2,1-3H3,(H,21,23) CNZIDPVXUFSJEM-UHFFFAOYSA-N 50133640 CHEMBL3633485 Cholinesterase 3870 ChEMBL 10.1016/j.bmcl.2015.10.051 10.7270/Q2J67JQB 26514744 Yerdelen, KO; Koca, M; Anil, B; Sevindik, H; Kasap, Z; Halici, Z; Turkaydin, K; Gunesacar, G Ataturk University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50133640 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50133640&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122195302 321903688 CHEMBL3633485 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50439348 COc1cccc(NC(=O)C2Cc3cc(OC)c(OC)cc3C2=O)c1 InChI=1S/C19H19NO5/c1-23-13-6-4-5-12(9-13)20-19(22)15-7-11-8-16(24-2)17(25-3)10-14(11)18(15)21/h4-6,8-10,15H,7H2,1-3H3,(H,20,22) WNRFVVHTPYZICF-UHFFFAOYSA-N 50133642 CHEMBL3633484 Cholinesterase 2100 ChEMBL 10.1016/j.bmcl.2015.10.051 10.7270/Q2J67JQB 26514744 Yerdelen, KO; Koca, M; Anil, B; Sevindik, H; Kasap, Z; Halici, Z; Turkaydin, K; Gunesacar, G Ataturk University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50133642 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50133642&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122195301 321903689 CHEMBL3633484 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50439349 CCc1cccc(NC(=O)C2Cc3cc(OC)c(OC)cc3C2=O)c1 InChI=1S/C20H21NO4/c1-4-12-6-5-7-14(8-12)21-20(23)16-9-13-10-17(24-2)18(25-3)11-15(13)19(16)22/h5-8,10-11,16H,4,9H2,1-3H3,(H,21,23) YEFRMKWPLGBQRC-UHFFFAOYSA-N 50133643 CHEMBL3633483 Cholinesterase 2980 ChEMBL 10.1016/j.bmcl.2015.10.051 10.7270/Q2J67JQB 26514744 Yerdelen, KO; Koca, M; Anil, B; Sevindik, H; Kasap, Z; Halici, Z; Turkaydin, K; Gunesacar, G Ataturk University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50133643 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50133643&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122195300 321903690 CHEMBL3633483 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50439350 COc1cc2CC(C(=O)Nc3cccc(C)c3)C(=O)c2cc1OC InChI=1S/C19H19NO4/c1-11-5-4-6-13(7-11)20-19(22)15-8-12-9-16(23-2)17(24-3)10-14(12)18(15)21/h4-7,9-10,15H,8H2,1-3H3,(H,20,22) ZBRDIUBQXIYEBF-UHFFFAOYSA-N 50133644 CHEMBL3633482 Cholinesterase 2240 ChEMBL 10.1016/j.bmcl.2015.10.051 10.7270/Q2J67JQB 26514744 Yerdelen, KO; Koca, M; Anil, B; Sevindik, H; Kasap, Z; Halici, Z; Turkaydin, K; Gunesacar, G Ataturk University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50133644 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50133644&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122195299 321903691 CHEMBL3633482 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50439351 COc1cc2CC(C(=O)Nc3ccc(Br)cc3)C(=O)c2cc1OC InChI=1S/C18H16BrNO4/c1-23-15-8-10-7-14(17(21)13(10)9-16(15)24-2)18(22)20-12-5-3-11(19)4-6-12/h3-6,8-9,14H,7H2,1-2H3,(H,20,22) DIICHNLMTRCTQI-UHFFFAOYSA-N 50133646 CHEMBL3633481 Cholinesterase 3660 ChEMBL 10.1016/j.bmcl.2015.10.051 10.7270/Q2J67JQB 26514744 Yerdelen, KO; Koca, M; Anil, B; Sevindik, H; Kasap, Z; Halici, Z; Turkaydin, K; Gunesacar, G Ataturk University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50133646 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50133646&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122195298 321903692 CHEMBL3633481 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50439352 COc1cc2CC(C(=O)Nc3ccc(Cl)cc3)C(=O)c2cc1OC InChI=1S/C18H16ClNO4/c1-23-15-8-10-7-14(17(21)13(10)9-16(15)24-2)18(22)20-12-5-3-11(19)4-6-12/h3-6,8-9,14H,7H2,1-2H3,(H,20,22) XHXCMDALVCAUSK-UHFFFAOYSA-N 50133647 CHEMBL3633480 Cholinesterase 4400 ChEMBL 10.1016/j.bmcl.2015.10.051 10.7270/Q2J67JQB 26514744 Yerdelen, KO; Koca, M; Anil, B; Sevindik, H; Kasap, Z; Halici, Z; Turkaydin, K; Gunesacar, G Ataturk University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50133647 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50133647&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122195297 321903693 CHEMBL3633480 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50439353 COc1cc2CC(C(=O)Nc3ccc(F)cc3)C(=O)c2cc1OC InChI=1S/C18H16FNO4/c1-23-15-8-10-7-14(17(21)13(10)9-16(15)24-2)18(22)20-12-5-3-11(19)4-6-12/h3-6,8-9,14H,7H2,1-2H3,(H,20,22) JTMZFFLMXWEAFD-UHFFFAOYSA-N 50133648 CHEMBL3633479 Cholinesterase 2650 ChEMBL 10.1016/j.bmcl.2015.10.051 10.7270/Q2J67JQB 26514744 Yerdelen, KO; Koca, M; Anil, B; Sevindik, H; Kasap, Z; Halici, Z; Turkaydin, K; Gunesacar, G Ataturk University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50133648 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50133648&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122195296 321903694 CHEMBL3633479 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50439354 CCOc1ccc(NC(=O)C2Cc3cc(OC)c(OC)cc3C2=O)cc1 InChI=1S/C20H21NO5/c1-4-26-14-7-5-13(6-8-14)21-20(23)16-9-12-10-17(24-2)18(25-3)11-15(12)19(16)22/h5-8,10-11,16H,4,9H2,1-3H3,(H,21,23) WTOFYFCWHZDYLP-UHFFFAOYSA-N 50133649 CHEMBL3633478 Cholinesterase 2610 ChEMBL 10.1016/j.bmcl.2015.10.051 10.7270/Q2J67JQB 26514744 Yerdelen, KO; Koca, M; Anil, B; Sevindik, H; Kasap, Z; Halici, Z; Turkaydin, K; Gunesacar, G Ataturk University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50133649 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50133649&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122195295 321903695 CHEMBL3633478 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50439355 COc1ccc(NC(=O)C2Cc3cc(OC)c(OC)cc3C2=O)cc1 InChI=1S/C19H19NO5/c1-23-13-6-4-12(5-7-13)20-19(22)15-8-11-9-16(24-2)17(25-3)10-14(11)18(15)21/h4-7,9-10,15H,8H2,1-3H3,(H,20,22) IBQTUDJWFXBDTM-UHFFFAOYSA-N 50133650 CHEMBL3633477 Cholinesterase 2900 ChEMBL 10.1016/j.bmcl.2015.10.051 10.7270/Q2J67JQB 26514744 Yerdelen, KO; Koca, M; Anil, B; Sevindik, H; Kasap, Z; Halici, Z; Turkaydin, K; Gunesacar, G Ataturk University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50133650 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50133650&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122195294 321903696 CHEMBL3633477 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50439356 CCc1ccc(NC(=O)C2Cc3cc(OC)c(OC)cc3C2=O)cc1 InChI=1S/C20H21NO4/c1-4-12-5-7-14(8-6-12)21-20(23)16-9-13-10-17(24-2)18(25-3)11-15(13)19(16)22/h5-8,10-11,16H,4,9H2,1-3H3,(H,21,23) HSMMJOUCZZLYOA-UHFFFAOYSA-N 50133670 CHEMBL3633476 Cholinesterase 2960 ChEMBL 10.1016/j.bmcl.2015.10.051 10.7270/Q2J67JQB 26514744 Yerdelen, KO; Koca, M; Anil, B; Sevindik, H; Kasap, Z; Halici, Z; Turkaydin, K; Gunesacar, G Ataturk University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50133670 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50133670&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122195293 321903697 CHEMBL3633476 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50439357 COc1cc2CC(C(=O)Nc3ccc(C)cc3)C(=O)c2cc1OC InChI=1S/C19H19NO4/c1-11-4-6-13(7-5-11)20-19(22)15-8-12-9-16(23-2)17(24-3)10-14(12)18(15)21/h4-7,9-10,15H,8H2,1-3H3,(H,20,22) QOMHBCBROBLKOL-UHFFFAOYSA-N 50133671 CHEMBL3633475 Cholinesterase 2500 ChEMBL 10.1016/j.bmcl.2015.10.051 10.7270/Q2J67JQB 26514744 Yerdelen, KO; Koca, M; Anil, B; Sevindik, H; Kasap, Z; Halici, Z; Turkaydin, K; Gunesacar, G Ataturk University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50133671 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50133671&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122195292 321903698 CHEMBL3633475 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50439360 COc1cc2CC(C(=O)Nc3ccccc3)C(=O)c2cc1OC InChI=1S/C18H17NO4/c1-22-15-9-11-8-14(17(20)13(11)10-16(15)23-2)18(21)19-12-6-4-3-5-7-12/h3-7,9-10,14H,8H2,1-2H3,(H,19,21) XIZNPCOANDHZGE-UHFFFAOYSA-N 50133672 CHEMBL3633474 Cholinesterase 3150 ChEMBL 10.1016/j.bmcl.2015.10.051 10.7270/Q2J67JQB 26514744 Yerdelen, KO; Koca, M; Anil, B; Sevindik, H; Kasap, Z; Halici, Z; Turkaydin, K; Gunesacar, G Ataturk University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50133672 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50133672&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122195291 321903699 CHEMBL3633474 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50457550 Cc1ccc(cc1)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 InChI=1S/C28H35NO3/c1-22-10-12-23(13-11-22)27-21-26(30)25-15-14-24(20-28(25)32-27)31-19-9-5-3-2-4-6-16-29-17-7-8-18-29/h10-15,20-21H,2-9,16-19H2,1H3 XOUXDVMADKXSHW-UHFFFAOYSA-N 50140449 CHEMBL3754343 Cholinesterase 1920 ChEMBL 10.1016/j.bmc.2015.12.031 10.7270/Q2ZP4801 26752094 Luo, W; Chen, Y; Wang, T; Hong, C; Chang, LP; Chang, CC; Yang, YC; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50140449 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50140449&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127036824 336952569 CHEMBL3754343 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50457551 Oc1ccc(cc1)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 InChI=1S/C27H33NO4/c29-22-11-9-21(10-12-22)26-20-25(30)24-14-13-23(19-27(24)32-26)31-18-8-4-2-1-3-5-15-28-16-6-7-17-28/h9-14,19-20,29H,1-8,15-18H2 NEFQOBFDXBZRGD-UHFFFAOYSA-N 50140450 CHEMBL3754159 Cholinesterase 4580 ChEMBL 10.1016/j.bmc.2015.12.031 10.7270/Q2ZP4801 26752094 Luo, W; Chen, Y; Wang, T; Hong, C; Chang, LP; Chang, CC; Yang, YC; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50140450 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50140450&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127035987 336952570 CHEMBL3754159 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50457552 O=c1cc(oc2cc(OCCCCCCCCN3CCCC3)ccc12)-c1ccc(OCc2ccccc2)cc1 InChI=1S/C34H39NO4/c36-32-25-33(28-14-16-29(17-15-28)38-26-27-12-6-5-7-13-27)39-34-24-30(18-19-31(32)34)37-23-11-4-2-1-3-8-20-35-21-9-10-22-35/h5-7,12-19,24-25H,1-4,8-11,20-23,26H2 MPSYEWGBSMKCBJ-UHFFFAOYSA-N 50140451 CHEMBL3754264 Cholinesterase >25000 ChEMBL 10.1016/j.bmc.2015.12.031 10.7270/Q2ZP4801 26752094 Luo, W; Chen, Y; Wang, T; Hong, C; Chang, LP; Chang, CC; Yang, YC; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50140451 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50140451&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127035986 336952571 CHEMBL3754264 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50457553 Oc1cccc(c1)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 InChI=1S/C27H33NO4/c29-22-11-9-10-21(18-22)26-20-25(30)24-13-12-23(19-27(24)32-26)31-17-8-4-2-1-3-5-14-28-15-6-7-16-28/h9-13,18-20,29H,1-8,14-17H2 LYRYNUCMJJEDTC-UHFFFAOYSA-N 50140452 CHEMBL3752831 Cholinesterase 4920 ChEMBL 10.1016/j.bmc.2015.12.031 10.7270/Q2ZP4801 26752094 Luo, W; Chen, Y; Wang, T; Hong, C; Chang, LP; Chang, CC; Yang, YC; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50140452 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50140452&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127037607 336952572 CHEMBL3752831 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50457554 O=c1cc(oc2cc(OCCCCCCCCN3CCCC3)ccc12)-c1cccc(OCc2ccccc2)c1 InChI=1S/C34H39NO4/c36-32-25-33(28-15-12-16-29(23-28)38-26-27-13-6-5-7-14-27)39-34-24-30(17-18-31(32)34)37-22-11-4-2-1-3-8-19-35-20-9-10-21-35/h5-7,12-18,23-25H,1-4,8-11,19-22,26H2 JGXYQVSBFBZTEI-UHFFFAOYSA-N 50140453 CHEMBL3752142 Cholinesterase >25000 ChEMBL 10.1016/j.bmc.2015.12.031 10.7270/Q2ZP4801 26752094 Luo, W; Chen, Y; Wang, T; Hong, C; Chang, LP; Chang, CC; Yang, YC; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50140453 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50140453&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127037606 336952573 CHEMBL3752142 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50457555 Oc1ccccc1-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 InChI=1S/C27H33NO4/c29-24-12-6-5-11-22(24)27-20-25(30)23-14-13-21(19-26(23)32-27)31-18-10-4-2-1-3-7-15-28-16-8-9-17-28/h5-6,11-14,19-20,29H,1-4,7-10,15-18H2 QLSNSLXSGCCHBC-UHFFFAOYSA-N 50140454 CHEMBL3754412 Cholinesterase 1260 ChEMBL 10.1016/j.bmc.2015.12.031 10.7270/Q2ZP4801 26752094 Luo, W; Chen, Y; Wang, T; Hong, C; Chang, LP; Chang, CC; Yang, YC; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50140454 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50140454&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127037605 336952574 CHEMBL3754412 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50457556 O=c1cc(oc2cc(OCCCCCCCCN3CCCC3)ccc12)-c1ccccc1OCc1ccccc1 InChI=1S/C34H39NO4/c36-31-25-34(30-16-8-9-17-32(30)38-26-27-14-6-5-7-15-27)39-33-24-28(18-19-29(31)33)37-23-13-4-2-1-3-10-20-35-21-11-12-22-35/h5-9,14-19,24-25H,1-4,10-13,20-23,26H2 IGARDKYDERSJQZ-UHFFFAOYSA-N 50140455 CHEMBL3754649 Cholinesterase 5260 ChEMBL 10.1016/j.bmc.2015.12.031 10.7270/Q2ZP4801 26752094 Luo, W; Chen, Y; Wang, T; Hong, C; Chang, LP; Chang, CC; Yang, YC; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50140455 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50140455&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127037604 336952575 CHEMBL3754649 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50457557 COc1cc(cc(OC)c1OC)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 InChI=1S/C30H39NO6/c1-33-28-18-22(19-29(34-2)30(28)35-3)26-21-25(32)24-13-12-23(20-27(24)37-26)36-17-11-7-5-4-6-8-14-31-15-9-10-16-31/h12-13,18-21H,4-11,14-17H2,1-3H3 NSXSGNRPYBSNQV-UHFFFAOYSA-N 50140456 CHEMBL3754793 Cholinesterase 2200 ChEMBL 10.1016/j.bmc.2015.12.031 10.7270/Q2ZP4801 26752094 Luo, W; Chen, Y; Wang, T; Hong, C; Chang, LP; Chang, CC; Yang, YC; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50140456 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50140456&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127037603 336952576 CHEMBL3754793 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50457558 COc1ccc(cc1OC)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 InChI=1S/C29H37NO5/c1-32-26-14-11-22(19-29(26)33-2)27-21-25(31)24-13-12-23(20-28(24)35-27)34-18-10-6-4-3-5-7-15-30-16-8-9-17-30/h11-14,19-21H,3-10,15-18H2,1-2H3 KVFWGUPLAOZNQY-UHFFFAOYSA-N 50140511 CHEMBL3753742 Cholinesterase 3430 ChEMBL 10.1016/j.bmc.2015.12.031 10.7270/Q2ZP4801 26752094 Luo, W; Chen, Y; Wang, T; Hong, C; Chang, LP; Chang, CC; Yang, YC; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50140511 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50140511&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127036654 336952577 CHEMBL3753742 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50457559 COc1ccc(cc1)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 InChI=1S/C28H35NO4/c1-31-23-12-10-22(11-13-23)27-21-26(30)25-15-14-24(20-28(25)33-27)32-19-9-5-3-2-4-6-16-29-17-7-8-18-29/h10-15,20-21H,2-9,16-19H2,1H3 BEACGUARNWJKCH-UHFFFAOYSA-N 50140545 CHEMBL3752790 Cholinesterase 5420 ChEMBL 10.1016/j.bmc.2015.12.031 10.7270/Q2ZP4801 26752094 Luo, W; Chen, Y; Wang, T; Hong, C; Chang, LP; Chang, CC; Yang, YC; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50140545 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50140545&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127035635 104030124 CHEMBL3752790 ZINC28261135 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50457560 COc1cccc(c1)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 InChI=1S/C28H35NO4/c1-31-23-12-10-11-22(19-23)27-21-26(30)25-14-13-24(20-28(25)33-27)32-18-9-5-3-2-4-6-15-29-16-7-8-17-29/h10-14,19-21H,2-9,15-18H2,1H3 XDGZXILVEBGAJO-UHFFFAOYSA-N 50140547 CHEMBL3753214 Cholinesterase 2290 ChEMBL 10.1016/j.bmc.2015.12.031 10.7270/Q2ZP4801 26752094 Luo, W; Chen, Y; Wang, T; Hong, C; Chang, LP; Chang, CC; Yang, YC; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50140547 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50140547&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127035634 104030126 CHEMBL3753214 ZINC28263208 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50457561 COc1ccccc1-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 InChI=1S/C28H35NO4/c1-31-26-13-7-6-12-24(26)28-21-25(30)23-15-14-22(20-27(23)33-28)32-19-11-5-3-2-4-8-16-29-17-9-10-18-29/h6-7,12-15,20-21H,2-5,8-11,16-19H2,1H3 LFQCFZKUJYREDX-UHFFFAOYSA-N 50140559 CHEMBL3753823 Cholinesterase 760 ChEMBL 10.1016/j.bmc.2015.12.031 10.7270/Q2ZP4801 26752094 Luo, W; Chen, Y; Wang, T; Hong, C; Chang, LP; Chang, CC; Yang, YC; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50140559 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50140559&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127037564 336952578 CHEMBL3753823 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50457562 O=c1cc(oc2cc(OCCCCCCCCN3CCCC3)ccc12)-c1ccccc1 InChI=1S/C27H33NO3/c29-25-21-26(22-12-6-5-7-13-22)31-27-20-23(14-15-24(25)27)30-19-11-4-2-1-3-8-16-28-17-9-10-18-28/h5-7,12-15,20-21H,1-4,8-11,16-19H2 RHHOCRDIDRFKJT-UHFFFAOYSA-N 50140560 CHEMBL3753043 Cholinesterase 2240 ChEMBL 10.1016/j.bmc.2015.12.031 10.7270/Q2ZP4801 26752094 Luo, W; Chen, Y; Wang, T; Hong, C; Chang, LP; Chang, CC; Yang, YC; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50140560 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50140560&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127037563 336952579 CHEMBL3753043 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50457586 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 10620 (S)-3-(1-(dimethylamino)ethyl)phenyl ethyl(methyl)carbamate::3-((1S)-1-(Dimethylamino)ethyl)phenyl N-ethyl N-methyl carbamate::3-(1-(dimethylamino)ethyl)phenyl ethyl(methyl)carbamate::3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::CHEMBL636::ENA-713::Ethyl-methyl-carbamic acid 3-((R)-1-dimethylamino-ethyl)-phenyl ester::Ethyl-methyl-carbamic acid 3-((S)-1-dimethylamino-ethyl)-phenyl ester::Ethyl-methyl-carbamic acid 3-(1-dimethylamino-ethyl)-phenyl ester::Exelon::Rivastigmine::Rivastigmine (1)::SDZ-212-713::SDZ-ENA-713 Cholinesterase 1710 ChEMBL 10.1016/j.bmc.2015.12.031 10.7270/Q2ZP4801 26752094 Luo, W; Chen, Y; Wang, T; Hong, C; Chang, LP; Chang, CC; Yang, YC; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10620 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10620&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46511221 8874 CHEMBL636 DB00989 6602 C11766 ZINC00004413 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50457587 O=c1cc(oc2cc(OCCCCCCCCN3CCCC3)ccc12)-c1ccc(cc1)-c1ccccc1 InChI=1S/C33H37NO3/c35-31-25-32(28-16-14-27(15-17-28)26-12-6-5-7-13-26)37-33-24-29(18-19-30(31)33)36-23-11-4-2-1-3-8-20-34-21-9-10-22-34/h5-7,12-19,24-25H,1-4,8-11,20-23H2 ZSEITYMGYZUHEL-UHFFFAOYSA-N 50140561 CHEMBL3753650 Cholinesterase >25000 ChEMBL 10.1016/j.bmc.2015.12.031 10.7270/Q2ZP4801 26752094 Luo, W; Chen, Y; Wang, T; Hong, C; Chang, LP; Chang, CC; Yang, YC; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50140561 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50140561&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127036856 336952580 CHEMBL3753650 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50457588 O=c1cc(oc2cc(OCCCCCCCCN3CCCC3)ccc12)-c1cccc2ccccc12 InChI=1S/C31H35NO3/c33-29-23-31(27-15-11-13-24-12-5-6-14-26(24)27)35-30-22-25(16-17-28(29)30)34-21-10-4-2-1-3-7-18-32-19-8-9-20-32/h5-6,11-17,22-23H,1-4,7-10,18-21H2 QCGVEJFICBTEIY-UHFFFAOYSA-N 50140562 CHEMBL3753044 Cholinesterase 420 ChEMBL 10.1016/j.bmc.2015.12.031 10.7270/Q2ZP4801 26752094 Luo, W; Chen, Y; Wang, T; Hong, C; Chang, LP; Chang, CC; Yang, YC; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50140562 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50140562&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127036855 336952581 CHEMBL3753044 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50457589 O=c1cc(oc2cc(OCCCCCCCCN3CCCC3)ccc12)-c1ccc(cc1)N1CCCC1 InChI=1S/C31H40N2O3/c34-29-24-30(25-11-13-26(14-12-25)33-20-8-9-21-33)36-31-23-27(15-16-28(29)31)35-22-10-4-2-1-3-5-17-32-18-6-7-19-32/h11-16,23-24H,1-10,17-22H2 XIUHRGPYESTKRD-UHFFFAOYSA-N 50140563 CHEMBL3751879 Cholinesterase 4100 ChEMBL 10.1016/j.bmc.2015.12.031 10.7270/Q2ZP4801 26752094 Luo, W; Chen, Y; Wang, T; Hong, C; Chang, LP; Chang, CC; Yang, YC; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50140563 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50140563&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127036827 336952582 CHEMBL3751879 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50457590 Brc1ccc(cc1)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 InChI=1S/C27H32BrNO3/c28-22-11-9-21(10-12-22)26-20-25(30)24-14-13-23(19-27(24)32-26)31-18-8-4-2-1-3-5-15-29-16-6-7-17-29/h9-14,19-20H,1-8,15-18H2 ZFSUCWLJMCHIOR-UHFFFAOYSA-N 50140564 CHEMBL3752109 Cholinesterase 10250 ChEMBL 10.1016/j.bmc.2015.12.031 10.7270/Q2ZP4801 26752094 Luo, W; Chen, Y; Wang, T; Hong, C; Chang, LP; Chang, CC; Yang, YC; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50140564 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50140564&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127036826 336952583 CHEMBL3752109 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50457591 Clc1ccc(cc1)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 InChI=1S/C27H32ClNO3/c28-22-11-9-21(10-12-22)26-20-25(30)24-14-13-23(19-27(24)32-26)31-18-8-4-2-1-3-5-15-29-16-6-7-17-29/h9-14,19-20H,1-8,15-18H2 HKHNVCHEFILQPA-UHFFFAOYSA-N 50140565 CHEMBL3753905 Cholinesterase 3460 ChEMBL 10.1016/j.bmc.2015.12.031 10.7270/Q2ZP4801 26752094 Luo, W; Chen, Y; Wang, T; Hong, C; Chang, LP; Chang, CC; Yang, YC; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50140565 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50140565&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127036825 336952584 CHEMBL3753905 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50453294 COc1cccc(CCCCCCCCN2CCCC2)c1 InChI=1S/C19H31NO/c1-21-19-13-10-12-18(17-19)11-6-4-2-3-5-7-14-20-15-8-9-16-20/h10,12-13,17H,2-9,11,14-16H2,1H3 ICIIOKBNLCNHRA-UHFFFAOYSA-N 50139007 CHEMBL3754287 Cholinesterase 16400 ChEMBL 10.1016/j.ejmech.2015.12.024 10.7270/Q20R9R7V 26735910 Lemes, LF; de Andrade Ramos, G; de Oliveira, AS; da Silva, FM; de Castro Couto, G; da Silva Boni, M; Guimarães, MJ; Souza, IN; Bartolini, M; Andrisano, V; do Nascimento Nogueira, PC; Silveira, ER; Brand, GD; Soukup, O; Korábecný, J; Romeiro, NC; Castro, NG; Bolognesi, ML; Romeiro, LA University of Bras£lia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50139007 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50139007&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127027281 336952169 CHEMBL3754287 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50453295 COc1cccc(CCCCCCCCN2CCCC(C2)OC(C)=O)c1 InChI=1S/C22H35NO3/c1-19(24)26-22-14-10-16-23(18-22)15-8-6-4-3-5-7-11-20-12-9-13-21(17-20)25-2/h9,12-13,17,22H,3-8,10-11,14-16,18H2,1-2H3 LNCDQARJXWKHNB-UHFFFAOYSA-N 50139049 CHEMBL3753732 Cholinesterase 19000 ChEMBL 10.1016/j.ejmech.2015.12.024 10.7270/Q20R9R7V 26735910 Lemes, LF; de Andrade Ramos, G; de Oliveira, AS; da Silva, FM; de Castro Couto, G; da Silva Boni, M; Guimarães, MJ; Souza, IN; Bartolini, M; Andrisano, V; do Nascimento Nogueira, PC; Silveira, ER; Brand, GD; Soukup, O; Korábecný, J; Romeiro, NC; Castro, NG; Bolognesi, ML; Romeiro, LA University of Bras£lia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50139049 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50139049&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127027282 336952170 CHEMBL3753732 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50453296 COc1cccc(CCCCCCCCN2CCC(C2)OC(=O)N(C)C)c1 InChI=1S/C22H36N2O3/c1-23(2)22(25)27-21-14-16-24(18-21)15-9-7-5-4-6-8-11-19-12-10-13-20(17-19)26-3/h10,12-13,17,21H,4-9,11,14-16,18H2,1-3H3 FGPAGOKEVAXSBG-UHFFFAOYSA-N 50139050 CHEMBL3753906 Cholinesterase 22800 ChEMBL 10.1016/j.ejmech.2015.12.024 10.7270/Q20R9R7V 26735910 Lemes, LF; de Andrade Ramos, G; de Oliveira, AS; da Silva, FM; de Castro Couto, G; da Silva Boni, M; Guimarães, MJ; Souza, IN; Bartolini, M; Andrisano, V; do Nascimento Nogueira, PC; Silveira, ER; Brand, GD; Soukup, O; Korábecný, J; Romeiro, NC; Castro, NG; Bolognesi, ML; Romeiro, LA University of Bras£lia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50139050 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50139050&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127027283 336952171 CHEMBL3753906 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50453297 COc1cccc(CCCCCCCCN2CCCC(C2)OC(=O)N(C)C)c1 InChI=1S/C23H38N2O3/c1-24(2)23(26)28-22-15-11-17-25(19-22)16-9-7-5-4-6-8-12-20-13-10-14-21(18-20)27-3/h10,13-14,18,22H,4-9,11-12,15-17,19H2,1-3H3 OMBRFQWDDTUJKU-UHFFFAOYSA-N 50139051 CHEMBL3753070 Cholinesterase 23500 ChEMBL 10.1016/j.ejmech.2015.12.024 10.7270/Q20R9R7V 26735910 Lemes, LF; de Andrade Ramos, G; de Oliveira, AS; da Silva, FM; de Castro Couto, G; da Silva Boni, M; Guimarães, MJ; Souza, IN; Bartolini, M; Andrisano, V; do Nascimento Nogueira, PC; Silveira, ER; Brand, GD; Soukup, O; Korábecný, J; Romeiro, NC; Castro, NG; Bolognesi, ML; Romeiro, LA University of Bras£lia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50139051 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50139051&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127027284 336952172 CHEMBL3753070 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50453298 COc1cccc(CCCCCCCCNCc2ccccc2OC)c1 InChI=1S/C23H33NO2/c1-25-22-15-11-13-20(18-22)12-7-5-3-4-6-10-17-24-19-21-14-8-9-16-23(21)26-2/h8-9,11,13-16,18,24H,3-7,10,12,17,19H2,1-2H3 KRXOCFVRVLIPMS-UHFFFAOYSA-N 50139052 CHEMBL3754700 Cholinesterase 3100 ChEMBL 10.1016/j.ejmech.2015.12.024 10.7270/Q20R9R7V 26735910 Lemes, LF; de Andrade Ramos, G; de Oliveira, AS; da Silva, FM; de Castro Couto, G; da Silva Boni, M; Guimarães, MJ; Souza, IN; Bartolini, M; Andrisano, V; do Nascimento Nogueira, PC; Silveira, ER; Brand, GD; Soukup, O; Korábecný, J; Romeiro, NC; Castro, NG; Bolognesi, ML; Romeiro, LA University of Bras£lia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50139052 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50139052&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127034691 336952173 CHEMBL3754700 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50453314 CCN(CCCCCCCCc1cccc(OC)c1)Cc1ccccc1OC InChI=1S/C25H37NO2/c1-4-26(21-23-16-10-11-18-25(23)28-3)19-12-8-6-5-7-9-14-22-15-13-17-24(20-22)27-2/h10-11,13,15-18,20H,4-9,12,14,19,21H2,1-3H3 CPIHZFXHCABWRY-UHFFFAOYSA-N 50139053 CHEMBL3752227 Cholinesterase 5000 ChEMBL 10.1016/j.ejmech.2015.12.024 10.7270/Q20R9R7V 26735910 Lemes, LF; de Andrade Ramos, G; de Oliveira, AS; da Silva, FM; de Castro Couto, G; da Silva Boni, M; Guimarães, MJ; Souza, IN; Bartolini, M; Andrisano, V; do Nascimento Nogueira, PC; Silveira, ER; Brand, GD; Soukup, O; Korábecný, J; Romeiro, NC; Castro, NG; Bolognesi, ML; Romeiro, LA University of Bras£lia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50139053 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50139053&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127028913 336952174 CHEMBL3752227 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50453315 CCN(CCCCCCCCc1cccc(OC)c1)Cc1ccccc1 InChI=1S/C24H35NO/c1-3-25(21-23-15-10-8-11-16-23)19-12-7-5-4-6-9-14-22-17-13-18-24(20-22)26-2/h8,10-11,13,15-18,20H,3-7,9,12,14,19,21H2,1-2H3 TVAUKYVCQKTZTD-UHFFFAOYSA-N 50139006 CHEMBL3753607 Cholinesterase 8000 ChEMBL 10.1016/j.ejmech.2015.12.024 10.7270/Q20R9R7V 26735910 Lemes, LF; de Andrade Ramos, G; de Oliveira, AS; da Silva, FM; de Castro Couto, G; da Silva Boni, M; Guimarães, MJ; Souza, IN; Bartolini, M; Andrisano, V; do Nascimento Nogueira, PC; Silveira, ER; Brand, GD; Soukup, O; Korábecný, J; Romeiro, NC; Castro, NG; Bolognesi, ML; Romeiro, LA University of Bras£lia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50139006 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50139006&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127028914 336952168 CHEMBL3753607 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50458984 Clc1ccccc1CC(=O)Nc1nc(cs1)-c1ccccc1 InChI=1S/C17H13ClN2OS/c18-14-9-5-4-8-13(14)10-16(21)20-17-19-15(11-22-17)12-6-2-1-3-7-12/h1-9,11H,10H2,(H,19,20,21) FXOWNBBUJMTEQY-UHFFFAOYSA-N 50141094 CHEMBL3752765 Cholinesterase 26420 ChEMBL 10.1016/j.bmcl.2016.01.001 10.7270/Q2GT5Q18 26783181 Sun, ZQ; Tu, LX; Zhuo, FJ; Liu, SX Linyi People's Hospital http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50141094 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50141094&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 2598469 336952647 CHEMBL3752765 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50458985 Cc1ccc(CC(=O)Nc2nc(cs2)-c2ccccc2)cc1 InChI=1S/C18H16N2OS/c1-13-7-9-14(10-8-13)11-17(21)20-18-19-16(12-22-18)15-5-3-2-4-6-15/h2-10,12H,11H2,1H3,(H,19,20,21) CYNMKTXRLZFULL-UHFFFAOYSA-N 50139067 CHEMBL3751888 Cholinesterase 9430 ChEMBL 10.1016/j.bmcl.2016.01.001 10.7270/Q2GT5Q18 26783181 Sun, ZQ; Tu, LX; Zhuo, FJ; Liu, SX Linyi People's Hospital http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50139067 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50139067&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 2186448 336952186 CHEMBL3751888 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50458986 Cc1ccccc1CC(=O)Nc1nc(cs1)-c1ccccc1 InChI=1S/C18H16N2OS/c1-13-7-5-6-10-15(13)11-17(21)20-18-19-16(12-22-18)14-8-3-2-4-9-14/h2-10,12H,11H2,1H3,(H,19,20,21) KNTYBUPIWZCWRI-UHFFFAOYSA-N 50139068 CHEMBL3753797 Cholinesterase 8110 ChEMBL 10.1016/j.bmcl.2016.01.001 10.7270/Q2GT5Q18 26783181 Sun, ZQ; Tu, LX; Zhuo, FJ; Liu, SX Linyi People's Hospital http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50139068 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50139068&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 8179999 336952187 CHEMBL3753797 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50458987 COc1ccc(CC(=O)Nc2nc(cs2)-c2ccccc2)cc1 InChI=1S/C18H16N2O2S/c1-22-15-9-7-13(8-10-15)11-17(21)20-18-19-16(12-23-18)14-5-3-2-4-6-14/h2-10,12H,11H2,1H3,(H,19,20,21) BMLIGCJBOMKOQC-UHFFFAOYSA-N 50139069 CHEMBL3751854 Cholinesterase 9240 ChEMBL 10.1016/j.bmcl.2016.01.001 10.7270/Q2GT5Q18 26783181 Sun, ZQ; Tu, LX; Zhuo, FJ; Liu, SX Linyi People's Hospital http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50139069 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50139069&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 2645568 336952188 CHEMBL3751854 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50458989 COc1ccccc1CC(=O)Nc1nc(cs1)-c1ccccc1 InChI=1S/C18H16N2O2S/c1-22-16-10-6-5-9-14(16)11-17(21)20-18-19-15(12-23-18)13-7-3-2-4-8-13/h2-10,12H,11H2,1H3,(H,19,20,21) PBUBWARIYDQRIJ-UHFFFAOYSA-N 50139070 CHEMBL3754142 Cholinesterase 10830 ChEMBL 10.1016/j.bmcl.2016.01.001 10.7270/Q2GT5Q18 26783181 Sun, ZQ; Tu, LX; Zhuo, FJ; Liu, SX Linyi People's Hospital http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50139070 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50139070&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 807781 336952189 CHEMBL3754142 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50458991 [O-][N+](=O)c1ccc(CC(=O)Nc2nc(cs2)-c2ccccc2)cc1 InChI=1S/C17H13N3O3S/c21-16(10-12-6-8-14(9-7-12)20(22)23)19-17-18-15(11-24-17)13-4-2-1-3-5-13/h1-9,11H,10H2,(H,18,19,21) AQVMBEZOKNNFOC-UHFFFAOYSA-N 50139071 CHEMBL3754705 Cholinesterase 6320 ChEMBL 10.1016/j.bmcl.2016.01.001 10.7270/Q2GT5Q18 26783181 Sun, ZQ; Tu, LX; Zhuo, FJ; Liu, SX Linyi People's Hospital http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50139071 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50139071&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 4128709 336952190 CHEMBL3754705 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50457449 [O-][N+](=O)c1ccccc1CC(=O)Nc1nc(cs1)-c1ccccc1 InChI=1S/C17H13N3O3S/c21-16(10-13-8-4-5-9-15(13)20(22)23)19-17-18-14(11-24-17)12-6-2-1-3-7-12/h1-9,11H,10H2,(H,18,19,21) WJSNREMUFAPQTD-UHFFFAOYSA-N 50139072 CHEMBL3753707 Cholinesterase 11280 ChEMBL 10.1016/j.bmcl.2016.01.001 10.7270/Q2GT5Q18 26783181 Sun, ZQ; Tu, LX; Zhuo, FJ; Liu, SX Linyi People's Hospital http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50139072 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50139072&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1122518 336952191 CHEMBL3753707 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50457450 Clc1ccc(CC(=O)Nc2nc(cs2)-c2ccccc2)cc1 InChI=1S/C17H13ClN2OS/c18-14-8-6-12(7-9-14)10-16(21)20-17-19-15(11-22-17)13-4-2-1-3-5-13/h1-9,11H,10H2,(H,19,20,21) NUCLDLOABHOOOA-UHFFFAOYSA-N 50140171 CHEMBL2403496 Cholinesterase 25270 ChEMBL 10.1016/j.bmcl.2016.01.001 10.7270/Q2GT5Q18 26783181 Sun, ZQ; Tu, LX; Zhuo, FJ; Liu, SX Linyi People's Hospital http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50140171 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50140171&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 886582 336952475 CHEMBL2403496 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50457451 O=C(Cc1ccccc1)Nc1nc(cs1)-c1ccccc1 InChI=1S/C17H14N2OS/c20-16(11-13-7-3-1-4-8-13)19-17-18-15(12-21-17)14-9-5-2-6-10-14/h1-10,12H,11H2,(H,18,19,20) RHYDNPBESMLDTF-UHFFFAOYSA-N 50139066 CHEMBL2403494 Cholinesterase 30670 ChEMBL 10.1016/j.bmcl.2016.01.001 10.7270/Q2GT5Q18 26783181 Sun, ZQ; Tu, LX; Zhuo, FJ; Liu, SX Linyi People's Hospital http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50139066 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50139066&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 813276 336952185 CHEMBL2403494 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50457452 Fc1ccc(CC(=O)Nc2nc(cs2)-c2ccccc2)cc1 InChI=1S/C17H13FN2OS/c18-14-8-6-12(7-9-14)10-16(21)20-17-19-15(11-22-17)13-4-2-1-3-5-13/h1-9,11H,10H2,(H,19,20,21) MKUBNVMTENZGRX-UHFFFAOYSA-N 50140174 CHEMBL2403495 Cholinesterase 26330 ChEMBL 10.1016/j.bmcl.2016.01.001 10.7270/Q2GT5Q18 26783181 Sun, ZQ; Tu, LX; Zhuo, FJ; Liu, SX Linyi People's Hospital http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50140174 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50140174&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 841217 336952478 CHEMBL2403495 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50457454 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 10620 (S)-3-(1-(dimethylamino)ethyl)phenyl ethyl(methyl)carbamate::3-((1S)-1-(Dimethylamino)ethyl)phenyl N-ethyl N-methyl carbamate::3-(1-(dimethylamino)ethyl)phenyl ethyl(methyl)carbamate::3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::CHEMBL636::ENA-713::Ethyl-methyl-carbamic acid 3-((R)-1-dimethylamino-ethyl)-phenyl ester::Ethyl-methyl-carbamic acid 3-((S)-1-dimethylamino-ethyl)-phenyl ester::Ethyl-methyl-carbamic acid 3-(1-dimethylamino-ethyl)-phenyl ester::Exelon::Rivastigmine::Rivastigmine (1)::SDZ-212-713::SDZ-ENA-713 Cholinesterase 1120 ChEMBL 10.1016/j.bmcl.2016.01.001 10.7270/Q2GT5Q18 26783181 Sun, ZQ; Tu, LX; Zhuo, FJ; Liu, SX Linyi People's Hospital http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10620 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10620&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46511221 8874 CHEMBL636 DB00989 6602 C11766 ZINC00004413 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481724 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O InChI=1S/C30H48O4/c1-25(2)12-14-30(24(33)34)15-13-28(6)18(19(30)16-25)8-9-22-27(5)17-20(31)23(32)26(3,4)21(27)10-11-29(22,28)7/h8,19-23,31-32H,9-17H2,1-7H3,(H,33,34)/t19-,20-,21-,22+,23-,27-,28+,29+,30-/m0/s1 MDZKJHQSJHYOHJ-KRGADYIYSA-N 50299747 2beta,3beta-Dihydroxyolean-12-en-28-oic Acid::CHEMBL482673::augustic acid Cholinesterase 35640 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50299747 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50299747&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 15560128 104141276 CHEMBL482673 ZINC14980269 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481725 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O InChI=1S/C30H48O4/c1-25(2)12-14-30(24(33)34)15-13-28(6)18(19(30)16-25)8-9-22-27(5)17-20(31)23(32)26(3,4)21(27)10-11-29(22,28)7/h8,19-23,31-32H,9-17H2,1-7H3,(H,33,34)/t19-,20-,21-,22+,23-,27-,28+,29+,30-/m0/s1 MDZKJHQSJHYOHJ-KRGADYIYSA-N 50299747 2beta,3beta-Dihydroxyolean-12-en-28-oic Acid::CHEMBL482673::augustic acid Cholinesterase 16560 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50299747 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50299747&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 15560128 104141276 CHEMBL482673 ZINC14980269 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481730 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OCCO InChI=1S/C32H52O5/c1-27(2)12-14-32(26(36)37-17-16-33)15-13-30(6)20(21(32)18-27)8-9-24-29(5)19-22(34)25(35)28(3,4)23(29)10-11-31(24,30)7/h8,21-25,33-35H,9-19H2,1-7H3/t21-,22+,23-,24+,25-,29-,30+,31+,32-/m0/s1 VWOCPYLNQOWOQM-PROZZQCMSA-N 50175877 2-hydroxyethyl (4aS,6aS,6bR,8aR,10R,11R,12aR,12bR,14bS)-10,11-dihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylate::CHEMBL204906 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50175877 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50175877&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44407715 104061551 CHEMBL204906 ZINC28570865 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481733 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OCC=C InChI=1S/C33H52O4/c1-9-18-37-27(36)33-16-14-28(2,3)19-22(33)21-10-11-25-30(6)20-23(34)26(35)29(4,5)24(30)12-13-32(25,8)31(21,7)15-17-33/h9-10,22-26,34-35H,1,11-20H2,2-8H3/t22-,23+,24-,25+,26-,30-,31+,32+,33-/m0/s1 ZBCLYFLDQQDBLE-RBNDYAJOSA-N 50155906 CHEMBL3086600 Cholinesterase >30000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155906 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155906&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76335250 340133705 CHEMBL3086600 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481736 CCCOC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2 InChI=1S/C33H54O4/c1-9-18-37-27(36)33-16-14-28(2,3)19-22(33)21-10-11-25-30(6)20-23(34)26(35)29(4,5)24(30)12-13-32(25,8)31(21,7)15-17-33/h10,22-26,34-35H,9,11-20H2,1-8H3/t22-,23+,24-,25+,26-,30-,31+,32+,33-/m0/s1 OHOIXHWNPWXWAQ-RBNDYAJOSA-N 50155907 CHEMBL3086599 Cholinesterase >6000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155907 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155907&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76309815 340133706 CHEMBL3086599 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481737 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)NCC#C InChI=1S/C33H51NO3/c1-9-18-34-27(37)33-16-14-28(2,3)19-22(33)21-10-11-25-30(6)20-23(35)26(36)29(4,5)24(30)12-13-32(25,8)31(21,7)15-17-33/h1,10,22-26,35-36H,11-20H2,2-8H3,(H,34,37)/t22-,23+,24-,25+,26-,30-,31+,32+,33-/m0/s1 NROKTTFNYHWXMQ-RBNDYAJOSA-N 50155901 CHEMBL3086596 Cholinesterase >20000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155901 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155901&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76331621 340133700 CHEMBL3086596 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481738 CCOC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2 InChI=1S/C32H52O4/c1-9-36-26(35)32-16-14-27(2,3)18-21(32)20-10-11-24-29(6)19-22(33)25(34)28(4,5)23(29)12-13-31(24,8)30(20,7)15-17-32/h10,21-25,33-34H,9,11-19H2,1-8H3/t21-,22+,23-,24+,25-,29-,30+,31+,32-/m0/s1 ANCMAMDWGUIQTE-PROZZQCMSA-N 50155895 CHEMBL3086597 Cholinesterase >14000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155895 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155895&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76327970 340133694 CHEMBL3086597 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481739 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)NCC=C InChI=1S/C33H53NO3/c1-9-18-34-27(37)33-16-14-28(2,3)19-22(33)21-10-11-25-30(6)20-23(35)26(36)29(4,5)24(30)12-13-32(25,8)31(21,7)15-17-33/h9-10,22-26,35-36H,1,11-20H2,2-8H3,(H,34,37)/t22-,23+,24-,25+,26-,30-,31+,32+,33-/m0/s1 AXRXTPNSCUKDTJ-RBNDYAJOSA-N 50155903 CHEMBL3086595 Cholinesterase >20000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155903 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155903&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76309814 340133702 CHEMBL3086595 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481741 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OCc1ccc(Cl)cc1Cl InChI=1S/C37H52Cl2O4/c1-32(2)14-16-37(31(42)43-21-22-8-9-23(38)18-26(22)39)17-15-35(6)24(25(37)19-32)10-11-29-34(5)20-27(40)30(41)33(3,4)28(34)12-13-36(29,35)7/h8-10,18,25,27-30,40-41H,11-17,19-21H2,1-7H3/t25-,27+,28-,29+,30-,34-,35+,36+,37-/m0/s1 UHACKXYFRVCZBN-PJVGDJALSA-N 50155916 CHEMBL3781995 Cholinesterase >6000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155916 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155916&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73056193 340133715 CHEMBL3781995 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481751 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O InChI=1S/C30H48O4/c1-25(2)12-14-30(24(33)34)15-13-28(6)18(19(30)16-25)8-9-22-27(5)17-20(31)23(32)26(3,4)21(27)10-11-29(22,28)7/h8,19-23,31-32H,9-17H2,1-7H3,(H,33,34)/t19-,20+,21-,22+,23-,27-,28+,29+,30-/m0/s1 MDZKJHQSJHYOHJ-LLICELPBSA-N 50175892 2alpha,3beta-dihydroxy-12-oleanen-28-oic acid::2alpha,3beta-dihydroxy-olean-12-en-28-oic acid::CHEMBL201515::Maslinic acid::Maslinicacid Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50175892 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50175892&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73659 104061566 66682 CHEMBL201515 C16939 ZINC38349969 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481752 CC(=O)O[C@@H]1C[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC=C2[C@@H]4CC(C)(C)CC[C@@]4(CC[C@@]32C)C(N)=O)C(C)(C)[C@H]1OC(C)=O InChI=1S/C34H53NO5/c1-20(36)39-24-19-31(7)25(30(5,6)27(24)40-21(2)37)12-13-33(9)26(31)11-10-22-23-18-29(3,4)14-16-34(23,28(35)38)17-15-32(22,33)8/h10,23-27H,11-19H2,1-9H3,(H2,35,38)/t23-,24+,25-,26+,27-,31-,32+,33+,34-/m0/s1 ABKKNMCMHOEQAN-LULZRBEKSA-N 50155918 CHEMBL1914929 Cholinesterase >20000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155918 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155918&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56934606 340133717 CHEMBL1914929 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481762 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OCc1cccc(Cl)c1 InChI=1S/C37H53ClO4/c1-32(2)15-17-37(31(41)42-22-23-9-8-10-24(38)19-23)18-16-35(6)25(26(37)20-32)11-12-29-34(5)21-27(39)30(40)33(3,4)28(34)13-14-36(29,35)7/h8-11,19,26-30,39-40H,12-18,20-22H2,1-7H3/t26-,27+,28-,29+,30-,34-,35+,36+,37-/m0/s1 LVXSPKCXNLUEII-IOSPBWAASA-N 50155910 CHEMBL3781667 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155910 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155910&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73056192 340133709 CHEMBL3781667 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481767 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OCCCCCl InChI=1S/C34H55ClO4/c1-29(2)14-16-34(28(38)39-19-9-8-18-35)17-15-32(6)22(23(34)20-29)10-11-26-31(5)21-24(36)27(37)30(3,4)25(31)12-13-33(26,32)7/h10,23-27,36-37H,8-9,11-21H2,1-7H3/t23-,24+,25-,26+,27-,31-,32+,33+,34-/m0/s1 PWHWBHISQZPCOY-LULZRBEKSA-N 50151916 CHEMBL3086609 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50151916 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50151916&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76313535 340132891 CHEMBL3086609 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481768 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OCc1ccc(Cl)cc1 InChI=1S/C37H53ClO4/c1-32(2)16-18-37(31(41)42-22-23-8-10-24(38)11-9-23)19-17-35(6)25(26(37)20-32)12-13-29-34(5)21-27(39)30(40)33(3,4)28(34)14-15-36(29,35)7/h8-12,26-30,39-40H,13-22H2,1-7H3/t26-,27+,28-,29+,30-,34-,35+,36+,37-/m0/s1 HWYAJWGCCGYCLK-IOSPBWAASA-N 50155908 CHEMBL3781182 Cholinesterase >30000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155908 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155908&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73055619 340133707 CHEMBL3781182 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481770 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OC\C=C/CCl InChI=1S/C34H53ClO4/c1-29(2)14-16-34(28(38)39-19-9-8-18-35)17-15-32(6)22(23(34)20-29)10-11-26-31(5)21-24(36)27(37)30(3,4)25(31)12-13-33(26,32)7/h8-10,23-27,36-37H,11-21H2,1-7H3/b9-8-/t23-,24+,25-,26+,27-,31-,32+,33+,34-/m0/s1 LCJPRTHZHMHCBE-MZOORMOUSA-N 50151915 CHEMBL3086610 Cholinesterase >80000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50151915 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50151915&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76327972 340132890 CHEMBL3086610 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481771 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OCc1ccc(Br)cc1 InChI=1S/C37H53BrO4/c1-32(2)16-18-37(31(41)42-22-23-8-10-24(38)11-9-23)19-17-35(6)25(26(37)20-32)12-13-29-34(5)21-27(39)30(40)33(3,4)28(34)14-15-36(29,35)7/h8-12,26-30,39-40H,13-22H2,1-7H3/t26-,27+,28-,29+,30-,34-,35+,36+,37-/m0/s1 WUNQOHRFNWYXSP-IOSPBWAASA-N 50155909 CHEMBL3780804 Cholinesterase >20000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155909 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155909&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73055915 340133708 CHEMBL3780804 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481772 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OCCC=C InChI=1S/C34H54O4/c1-9-10-19-38-28(37)34-17-15-29(2,3)20-23(34)22-11-12-26-31(6)21-24(35)27(36)30(4,5)25(31)13-14-33(26,8)32(22,7)16-18-34/h9,11,23-27,35-36H,1,10,12-21H2,2-8H3/t23-,24+,25-,26+,27-,31-,32+,33+,34-/m0/s1 JRENORWFQHGEGQ-LULZRBEKSA-N 50151920 CHEMBL3086607 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50151920 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50151920&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76331623 340132895 CHEMBL3086607 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481773 CC(=O)O[C@H]1C[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC=C2[C@@H]4CC(C)(C)CC[C@@]4(CC[C@@]32C)C(=O)NCc2ccccc2)C(C)(C)[C@H]1OC(C)=O InChI=1S/C41H59NO5/c1-26(43)46-31-24-38(7)32(37(5,6)34(31)47-27(2)44)17-18-40(9)33(38)16-15-29-30-23-36(3,4)19-21-41(30,22-20-39(29,40)8)35(45)42-25-28-13-11-10-12-14-28/h10-15,30-34H,16-25H2,1-9H3,(H,42,45)/t30-,31-,32-,33+,34-,38-,39+,40+,41-/m0/s1 BFRXPUWFFUXTML-HJPICNELSA-N 50155894 CHEMBL3781066 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155894 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155894&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127032003 340133693 CHEMBL3781066 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481775 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OCCC#C InChI=1S/C34H52O4/c1-9-10-19-38-28(37)34-17-15-29(2,3)20-23(34)22-11-12-26-31(6)21-24(35)27(36)30(4,5)25(31)13-14-33(26,8)32(22,7)16-18-34/h1,11,23-27,35-36H,10,12-21H2,2-8H3/t23-,24+,25-,26+,27-,31-,32+,33+,34-/m0/s1 ODBCWOLAUHFTGZ-LULZRBEKSA-N 50151918 CHEMBL3086608 Cholinesterase >20000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50151918 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50151918&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76313534 340132893 CHEMBL3086608 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481776 CC(=O)O[C@H]1C[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC=C2[C@@H]4CC(C)(C)CC[C@@]4(CC[C@@]32C)C(O)=O)C(C)(C)[C@H]1OC(C)=O InChI=1S/C34H52O6/c1-20(35)39-24-19-31(7)25(30(5,6)27(24)40-21(2)36)12-13-33(9)26(31)11-10-22-23-18-29(3,4)14-16-34(23,28(37)38)17-15-32(22,33)8/h10,23-27H,11-19H2,1-9H3,(H,37,38)/t23-,24-,25-,26+,27-,31-,32+,33+,34-/m0/s1 BZDICYRSPZNHNV-LGSBFBEMSA-N 50155577 CHEMBL3779951 Cholinesterase >20000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155577 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155577&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14010967 104042990 CHEMBL3779951 ZINC28398218 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481778 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OCCCI InChI=1S/C33H53IO4/c1-28(2)13-15-33(27(37)38-18-8-17-34)16-14-31(6)21(22(33)19-28)9-10-25-30(5)20-23(35)26(36)29(3,4)24(30)11-12-32(25,31)7/h9,22-26,35-36H,8,10-20H2,1-7H3/t22-,23+,24-,25+,26-,30-,31+,32+,33-/m0/s1 LLCOYELROSHDIP-RBNDYAJOSA-N 50151922 CHEMBL3086605 Cholinesterase >20000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50151922 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50151922&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76313533 340132897 CHEMBL3086605 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481779 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](OC(=O)CCl)[C@H](OC(=O)CCl)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)NCc1ccccc1 InChI=1S/C41H57Cl2NO5/c1-36(2)17-19-41(35(47)44-25-26-11-9-8-10-12-26)20-18-39(6)27(28(41)21-36)13-14-31-38(5)22-29(48-32(45)23-42)34(49-33(46)24-43)37(3,4)30(38)15-16-40(31,39)7/h8-13,28-31,34H,14-25H2,1-7H3,(H,44,47)/t28-,29+,30-,31+,34-,38-,39+,40+,41-/m0/s1 XOISDXOOPFKPPH-GNKHBCFJSA-N 50155576 CHEMBL3781042 Cholinesterase >30000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155576 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155576&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127031719 104042989 CHEMBL3781042 ZINC28377277 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481782 CC(=O)O[C@@H]1C[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC=C2[C@@H]4CC(C)(C)CC[C@@]4(CC[C@@]32C)C(=O)NCc2ccccc2)C(C)(C)[C@H]1OC(C)=O InChI=1S/C41H59NO5/c1-26(43)46-31-24-38(7)32(37(5,6)34(31)47-27(2)44)17-18-40(9)33(38)16-15-29-30-23-36(3,4)19-21-41(30,22-20-39(29,40)8)35(45)42-25-28-13-11-10-12-14-28/h10-15,30-34H,16-25H2,1-9H3,(H,42,45)/t30-,31+,32-,33+,34-,38-,39+,40+,41-/m0/s1 BFRXPUWFFUXTML-QQAODYGRSA-N 50155573 CHEMBL3780432 Cholinesterase 12430 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155573 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155573&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127031718 104042986 CHEMBL3780432 ZINC28455537 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481783 CC(=O)O[C@@H]1C[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC=C2[C@@H]4CC(C)(C)CC[C@@]4(CC[C@@]32C)C(=O)NCc2ccccc2)C(C)(C)[C@H]1OC(C)=O InChI=1S/C41H59NO5/c1-26(43)46-31-24-38(7)32(37(5,6)34(31)47-27(2)44)17-18-40(9)33(38)16-15-29-30-23-36(3,4)19-21-41(30,22-20-39(29,40)8)35(45)42-25-28-13-11-10-12-14-28/h10-15,30-34H,16-25H2,1-9H3,(H,42,45)/t30-,31+,32-,33+,34-,38-,39+,40+,41-/m0/s1 BFRXPUWFFUXTML-QQAODYGRSA-N 50155573 CHEMBL3780432 Cholinesterase 28200 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155573 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155573&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127031718 104042986 CHEMBL3780432 ZINC28455537 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481785 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OCCCCl InChI=1S/C33H53ClO4/c1-28(2)13-15-33(27(37)38-18-8-17-34)16-14-31(6)21(22(33)19-28)9-10-25-30(5)20-23(35)26(36)29(3,4)24(30)11-12-32(25,31)7/h9,22-26,35-36H,8,10-20H2,1-7H3/t22-,23+,24-,25+,26-,30-,31+,32+,33-/m0/s1 DZZYKCJDLIGXJS-RBNDYAJOSA-N 50155913 CHEMBL3086603 Cholinesterase >6000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155913 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155913&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76309816 340133712 CHEMBL3086603 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481786 CC(=O)O[C@@H]1C[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC=C2[C@@H]4CC(C)(C)CC[C@@]4(CC[C@@]32C)C(=O)NCC#C)C(C)(C)[C@H]1OC(C)=O InChI=1S/C37H55NO5/c1-11-20-38-31(41)37-18-16-32(4,5)21-26(37)25-12-13-29-34(8)22-27(42-23(2)39)30(43-24(3)40)33(6,7)28(34)14-15-36(29,10)35(25,9)17-19-37/h1,12,26-30H,13-22H2,2-10H3,(H,38,41)/t26-,27+,28-,29+,30-,34-,35+,36+,37-/m0/s1 NVIYQRQPFVMUJF-IOSPBWAASA-N 50155902 CHEMBL3780423 Cholinesterase >14000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155902 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155902&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73057104 340133701 CHEMBL3780423 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481788 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OCCCBr InChI=1S/C33H53BrO4/c1-28(2)13-15-33(27(37)38-18-8-17-34)16-14-31(6)21(22(33)19-28)9-10-25-30(5)20-23(35)26(36)29(3,4)24(30)11-12-32(25,31)7/h9,22-26,35-36H,8,10-20H2,1-7H3/t22-,23+,24-,25+,26-,30-,31+,32+,33-/m0/s1 JGXDFWXYEDYNAR-RBNDYAJOSA-N 50155912 CHEMBL3086604 Cholinesterase >80000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155912 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155912&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76324417 340133711 CHEMBL3086604 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481789 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)NCc1ccccc1 InChI=1S/C37H55NO3/c1-32(2)17-19-37(31(41)38-23-24-11-9-8-10-12-24)20-18-35(6)25(26(37)21-32)13-14-29-34(5)22-27(39)30(40)33(3,4)28(34)15-16-36(29,35)7/h8-13,26-30,39-40H,14-23H2,1-7H3,(H,38,41)/t26-,27+,28-,29+,30-,34-,35+,36+,37-/m0/s1 JISWMUKEXLMVGZ-IOSPBWAASA-N 50155905 CHEMBL3780395 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155905 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155905&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73056487 340133704 CHEMBL3780395 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481790 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OCC#C InChI=1S/C33H50O4/c1-9-18-37-27(36)33-16-14-28(2,3)19-22(33)21-10-11-25-30(6)20-23(34)26(35)29(4,5)24(30)12-13-32(25,8)31(21,7)15-17-33/h1,10,22-26,34-35H,11-20H2,2-8H3/t22-,23+,24-,25+,26-,30-,31+,32+,33-/m0/s1 WJRDKCLGVFADJL-RBNDYAJOSA-N 50155915 CHEMBL3086601 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155915 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155915&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46873066 340133714 CHEMBL3086601 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481791 CC(=O)O[C@@H]1C[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC=C2[C@@H]4CC(C)(C)CC[C@@]4(CC[C@@]32C)C(=O)NCC=C)C(C)(C)[C@H]1OC(C)=O InChI=1S/C37H57NO5/c1-11-20-38-31(41)37-18-16-32(4,5)21-26(37)25-12-13-29-34(8)22-27(42-23(2)39)30(43-24(3)40)33(6,7)28(34)14-15-36(29,10)35(25,9)17-19-37/h11-12,26-30H,1,13-22H2,2-10H3,(H,38,41)/t26-,27+,28-,29+,30-,34-,35+,36+,37-/m0/s1 OIKUFFGQDPLXOC-IOSPBWAASA-N 50155897 CHEMBL3781928 Cholinesterase >20000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155897 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155897&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73057103 340133696 CHEMBL3781928 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481792 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@H](OC(=O)CCl)[C@H](OC(=O)CCl)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)NCc1ccccc1 InChI=1S/C41H57Cl2NO5/c1-36(2)17-19-41(35(47)44-25-26-11-9-8-10-12-26)20-18-39(6)27(28(41)21-36)13-14-31-38(5)22-29(48-32(45)23-42)34(49-33(46)24-43)37(3,4)30(38)15-16-40(31,39)7/h8-13,28-31,34H,14-25H2,1-7H3,(H,44,47)/t28-,29-,30-,31+,34-,38-,39+,40+,41-/m0/s1 XOISDXOOPFKPPH-RVKVHZCSSA-N 50155899 CHEMBL3780430 Cholinesterase >6000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155899 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155899&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127032619 340133698 CHEMBL3780430 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481793 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OCCCO InChI=1S/C33H54O5/c1-28(2)13-15-33(27(37)38-18-8-17-34)16-14-31(6)21(22(33)19-28)9-10-25-30(5)20-23(35)26(36)29(3,4)24(30)11-12-32(25,31)7/h9,22-26,34-36H,8,10-20H2,1-7H3/t22-,23+,24-,25+,26-,30-,31+,32+,33-/m0/s1 ZWXRKXDTNZNWAV-RBNDYAJOSA-N 50155914 CHEMBL3086602 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155914 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155914&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76331622 340133713 CHEMBL3086602 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481794 CCCNC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)C[C@@H](OC(C)=O)[C@H](OC(C)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2 InChI=1S/C37H59NO5/c1-11-20-38-31(41)37-18-16-32(4,5)21-26(37)25-12-13-29-34(8)22-27(42-23(2)39)30(43-24(3)40)33(6,7)28(34)14-15-36(29,10)35(25,9)17-19-37/h12,26-30H,11,13-22H2,1-10H3,(H,38,41)/t26-,27+,28-,29+,30-,34-,35+,36+,37-/m0/s1 ROQYVYNMGWXAQV-IOSPBWAASA-N 50155900 CHEMBL3781417 Cholinesterase >6000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155900 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155900&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73056788 340133699 CHEMBL3781417 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481795 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@H](OC(=O)CCl)[C@H](OC(=O)CCl)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O InChI=1S/C34H50Cl2O6/c1-29(2)12-14-34(28(39)40)15-13-32(6)20(21(34)16-29)8-9-24-31(5)17-22(41-25(37)18-35)27(42-26(38)19-36)30(3,4)23(31)10-11-33(24,32)7/h8,21-24,27H,9-19H2,1-7H3,(H,39,40)/t21-,22-,23-,24+,27-,31-,32+,33+,34-/m0/s1 GGBRDAUMUXSKBB-PUZBIQRQSA-N 50155896 CHEMBL3781136 Cholinesterase >6000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155896 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155896&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127032004 340133695 CHEMBL3781136 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481800 COC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2 InChI=1S/C31H50O4/c1-26(2)13-15-31(25(34)35-8)16-14-29(6)19(20(31)17-26)9-10-23-28(5)18-21(32)24(33)27(3,4)22(28)11-12-30(23,29)7/h9,20-24,32-33H,10-18H2,1-8H3/t20-,21+,22-,23+,24-,28-,29+,30+,31-/m0/s1 OTDUGESKRJHFHR-SUXCAEKLSA-N 50175875 (4aS,6aS,6bR,8aR,10R,11R,12aR,12bR,14bS)-methyl 10,11-dihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylate::CHEMBL202346::Maslinic acid methyl ester::methyl (4aS,6aS,6bR,8aR,10R,11R,12aR,12bR,14bS)-10,11-dihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylate Cholinesterase >50000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50175875 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50175875&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 13653327 104061549 CHEMBL202346 ZINC28568752 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481801 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OCCCCBr InChI=1S/C34H55BrO4/c1-29(2)14-16-34(28(38)39-19-9-8-18-35)17-15-32(6)22(23(34)20-29)10-11-26-31(5)21-24(36)27(37)30(3,4)25(31)12-13-33(26,32)7/h10,23-27,36-37H,8-9,11-21H2,1-7H3/t23-,24+,25-,26+,27-,31-,32+,33+,34-/m0/s1 UOZGHCIJZMDPFA-LULZRBEKSA-N 50175878 4-bromobutyl (4aS,6aS,6bR,8aR,10R,11R,12aR,12bR,14bS)-10,11-dihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylate::CHEMBL372331 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50175878 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50175878&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44407673 104061552 CHEMBL372331 ZINC28568951 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481802 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 9370 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481803 CC1(C)CCC2(CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(C)C5CCC34C)C2C1)C(=O)OCc1ccc(cc1)[N+]([O-])=O InChI=1S/C37H53NO6/c1-32(2)16-18-37(31(41)44-22-23-8-10-24(11-9-23)38(42)43)19-17-35(6)25(26(37)20-32)12-13-29-34(5)21-27(39)30(40)33(3,4)28(34)14-15-36(29,35)7/h8-12,26-30,39-40H,13-22H2,1-7H3/t26-,27+,28-,29+,30-,34-,35+,36+,37-/m0/s1 RVDCVHDWRJLXKM-IOSPBWAASA-N 50155917 CHEMBL3780798 Cholinesterase >4000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155917 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155917&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73055916 340133716 CHEMBL3780798 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481806 CCNC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)C[C@@H](OC(C)=O)[C@H](OC(C)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2 InChI=1S/C36H57NO5/c1-11-37-30(40)36-18-16-31(4,5)20-25(36)24-12-13-28-33(8)21-26(41-22(2)38)29(42-23(3)39)32(6,7)27(33)14-15-35(28,10)34(24,9)17-19-36/h12,25-29H,11,13-21H2,1-10H3,(H,37,40)/t25-,26+,27-,28+,29-,33-,34+,35+,36-/m0/s1 FTZPUWOUSNGUAY-MXMJEZIOSA-N 50155921 CHEMBL3781640 Cholinesterase >14000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155921 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155921&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73056787 340133720 CHEMBL3781640 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481807 COc1ccc(COC(=O)[C@]23CCC(C)(C)C[C@H]2C2=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]2(C)CC3)cc1 InChI=1S/C38H56O5/c1-33(2)17-19-38(32(41)43-23-24-9-11-25(42-8)12-10-24)20-18-36(6)26(27(38)21-33)13-14-30-35(5)22-28(39)31(40)34(3,4)29(35)15-16-37(30,36)7/h9-13,27-31,39-40H,14-23H2,1-8H3/t27-,28+,29-,30+,31-,35-,36+,37+,38-/m0/s1 BRDPJHLLDFKNGI-FRXNWTSSSA-N 50155919 CHEMBL3779955 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155919 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155919&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73055917 340133718 CHEMBL3779955 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481808 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](OC(=O)CCl)[C@H](OC(=O)CCl)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O InChI=1S/C34H50Cl2O6/c1-29(2)12-14-34(28(39)40)15-13-32(6)20(21(34)16-29)8-9-24-31(5)17-22(41-25(37)18-35)27(42-26(38)19-36)30(3,4)23(31)10-11-33(24,32)7/h8,21-24,27H,9-19H2,1-7H3,(H,39,40)/t21-,22+,23-,24+,27-,31-,32+,33+,34-/m0/s1 GGBRDAUMUXSKBB-RAFPFBLHSA-N 50155920 CHEMBL3781812 Cholinesterase >20000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155920 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155920&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127032005 340133719 CHEMBL3781812 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481814 CCNC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2 InChI=1S/C32H53NO3/c1-9-33-26(36)32-16-14-27(2,3)18-21(32)20-10-11-24-29(6)19-22(34)25(35)28(4,5)23(29)12-13-31(24,8)30(20,7)15-17-32/h10,21-25,34-35H,9,11-19H2,1-8H3,(H,33,36)/t21-,22+,23-,24+,25-,29-,30+,31+,32-/m0/s1 LTLLHEBETZDVMB-PROZZQCMSA-N 50155904 CHEMBL3086616 Cholinesterase >20000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155904 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155904&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76309817 340133703 CHEMBL3086616 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481816 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OCC1CCCCC1 InChI=1S/C37H60O4/c1-32(2)17-19-37(31(40)41-23-24-11-9-8-10-12-24)20-18-35(6)25(26(37)21-32)13-14-29-34(5)22-27(38)30(39)33(3,4)28(34)15-16-36(29,35)7/h13,24,26-30,38-39H,8-12,14-23H2,1-7H3/t26-,27+,28-,29+,30-,34-,35+,36+,37-/m0/s1 GEJFJWCVMROOKA-IOSPBWAASA-N 50155572 CHEMBL3086615 Cholinesterase >14000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155572 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155572&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73055617 104042985 CHEMBL3086615 ZINC28395254 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481818 CCCCCCOC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2 InChI=1S/C36H60O4/c1-9-10-11-12-21-40-30(39)36-19-17-31(2,3)22-25(36)24-13-14-28-33(6)23-26(37)29(38)32(4,5)27(33)15-16-35(28,8)34(24,7)18-20-36/h13,25-29,37-38H,9-12,14-23H2,1-8H3/t25-,26+,27-,28+,29-,33-,34+,35+,36-/m0/s1 PFSOMHJLZBSMHR-MXMJEZIOSA-N 50155578 CHEMBL3086612 Cholinesterase >6000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155578 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155578&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76331624 104042991 CHEMBL3086612 ZINC28388410 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481819 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OCCC#CCl InChI=1S/C34H51ClO4/c1-29(2)14-16-34(28(38)39-19-9-8-18-35)17-15-32(6)22(23(34)20-29)10-11-26-31(5)21-24(36)27(37)30(3,4)25(31)12-13-33(26,32)7/h10,23-27,36-37H,9,11-17,19-21H2,1-7H3/t23-,24+,25-,26+,27-,31-,32+,33+,34-/m0/s1 VONPVYODSAGISA-LULZRBEKSA-N 50151914 CHEMBL3086611 Cholinesterase >6000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50151914 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50151914&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76324418 340132889 CHEMBL3086611 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481831 CC(=O)O[C@@H]1C[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC=C2[C@@H]4CC(C)(C)CC[C@@]4(CC[C@@]32C)C(O)=O)C(C)(C)[C@H]1OC(C)=O InChI=1S/C34H52O6/c1-20(35)39-24-19-31(7)25(30(5,6)27(24)40-21(2)36)12-13-33(9)26(31)11-10-22-23-18-29(3,4)14-16-34(23,28(37)38)17-15-32(22,33)8/h10,23-27H,11-19H2,1-9H3,(H,37,38)/t23-,24+,25-,26+,27-,31-,32+,33+,34-/m0/s1 BZDICYRSPZNHNV-LULZRBEKSA-N 50346699 CHEMBL508614 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346699 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346699&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14010966 136353385 CHEMBL508614 ZINC42809056 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481832 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(N)=O InChI=1S/C30H49NO3/c1-25(2)12-14-30(24(31)34)15-13-28(6)18(19(30)16-25)8-9-22-27(5)17-20(32)23(33)26(3,4)21(27)10-11-29(22,28)7/h8,19-23,32-33H,9-17H2,1-7H3,(H2,31,34)/t19-,20+,21-,22+,23-,27-,28+,29+,30-/m0/s1 SRGYXSUXXOCSCI-LLICELPBSA-N 50155911 CHEMBL1914930 Cholinesterase 34150 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155911 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155911&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56649597 340133710 CHEMBL1914930 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481833 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(N)=O InChI=1S/C30H49NO3/c1-25(2)12-14-30(24(31)34)15-13-28(6)18(19(30)16-25)8-9-22-27(5)17-20(32)23(33)26(3,4)21(27)10-11-29(22,28)7/h8,19-23,32-33H,9-17H2,1-7H3,(H2,31,34)/t19-,20+,21-,22+,23-,27-,28+,29+,30-/m0/s1 SRGYXSUXXOCSCI-LLICELPBSA-N 50155911 CHEMBL1914930 Cholinesterase 18110 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155911 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155911&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56649597 340133710 CHEMBL1914930 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481834 COC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)C[C@@H](O)[C@H](OS(N)(=O)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2 InChI=1S/C31H51NO6S/c1-26(2)13-15-31(25(34)37-8)16-14-29(6)19(20(31)17-26)9-10-23-28(5)18-21(33)24(38-39(32,35)36)27(3,4)22(28)11-12-30(23,29)7/h9,20-24,33H,10-18H2,1-8H3,(H2,32,35,36)/t20-,21+,22-,23+,24-,28-,29+,30+,31-/m0/s1 ZFHYOSPBLYPCBO-SUXCAEKLSA-N 50058829 CHEMBL3325867 Cholinesterase >20000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50058829 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50058829&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118711231 103954731 CHEMBL3325867 ZINC01636752 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481835 COC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)C[C@@H](OS(N)(=O)=O)[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2 InChI=1S/C31H51NO6S/c1-26(2)13-15-31(25(34)37-8)16-14-29(6)19(20(31)17-26)9-10-23-28(5)18-21(38-39(32,35)36)24(33)27(3,4)22(28)11-12-30(23,29)7/h9,20-24,33H,10-18H2,1-8H3,(H2,32,35,36)/t20-,21+,22-,23+,24-,28-,29+,30+,31-/m0/s1 MENMEXOXMYADPY-SUXCAEKLSA-N 50058828 CHEMBL3325866 Cholinesterase >40000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50058828 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50058828&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118711230 103954730 CHEMBL3325866 ZINC26168931 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50481836 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OCc1ccccc1 InChI=1S/C37H54O4/c1-32(2)17-19-37(31(40)41-23-24-11-9-8-10-12-24)20-18-35(6)25(26(37)21-32)13-14-29-34(5)22-27(38)30(39)33(3,4)28(34)15-16-36(29,35)7/h8-13,26-30,38-39H,14-23H2,1-7H3/t26-,27+,28-,29+,30-,34-,35+,36+,37-/m0/s1 VCQDNEMHUASJMM-IOSPBWAASA-N 50155898 Benzyl Maslinate Cholinesterase >14000 ChEMBL 10.1016/j.ejmech.2015.09.007 10.7270/Q2WS8W46 26383128 Schwarz, S; Loesche, A; Lucas, SD; Sommerwerk, S; Serbian, I; Siewert, B; Pianowski, E; Csuk, R Martin-Luther-Universit£t Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50155898 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50155898&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 21599838 340133697 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50472119 COC(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C27H29BrN6O5S/c28-19-9-12-24(31-16-19)34-25(35)14-22(33-26(36)18-4-3-13-30-15-18)27(37)32-20-10-7-17(8-11-20)21-5-1-2-6-23(21)40(29,38)39/h1-2,5-12,16,18,22,30H,3-4,13-15H2,(H,32,37)(H,33,36)(H2,29,38,39)(H,31,34,35) ZRQJKONBYKQALT-UHFFFAOYSA-N 50149956 CHEMBL3770401 Cholinesterase 90320 ChEMBL 10.1016/j.bmc.2016.02.033 10.7270/Q2XW4MPW 26947959 Pejchal, V; Štepánková, Š; Pejchalová, M; Královec, K; Havelek, R; Ružicková, Z; Ajani, H; Lo, R; Lepšík, M University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50149956 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50149956&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44393311 104038014 CHEMBL3770401 ZINC28376959 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50472120 CCOC(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C26H26BrN5O7S2/c27-19-9-10-23(29-16-19)31-24(33)15-21(26(35)32-11-13-40(36,37)14-12-32)30-25(34)18-7-5-17(6-8-18)20-3-1-2-4-22(20)41(28,38)39/h1-10,16,21H,11-15H2,(H,30,34)(H2,28,38,39)(H,29,31,33) CMEMNRPGNWPZQB-UHFFFAOYSA-N 50149957 CHEMBL3769730 Cholinesterase 20110 ChEMBL 10.1016/j.bmc.2016.02.033 10.7270/Q2XW4MPW 26947959 Pejchal, V; Štepánková, Š; Pejchalová, M; Královec, K; Havelek, R; Ružicková, Z; Ajani, H; Lo, R; Lepšík, M University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50149957 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50149957&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10122481 104038015 CHEMBL3769730 ZINC28354578 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50472121 CCCOC(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C23H21ClN4O5S2/c24-18-9-10-20-17(13-18)14-22(28-20)35(32,33)27-12-11-26-23(29)16-7-5-15(6-8-16)19-3-1-2-4-21(19)34(25,30)31/h1-10,13-14,27-28H,11-12H2,(H,26,29)(H2,25,30,31) JUXBZIWRJRQFTA-UHFFFAOYSA-N 50149958 CHEMBL3770152 Cholinesterase 34610 ChEMBL 10.1016/j.bmc.2016.02.033 10.7270/Q2XW4MPW 26947959 Pejchal, V; Štepánková, Š; Pejchalová, M; Královec, K; Havelek, R; Ružicková, Z; Ajani, H; Lo, R; Lepšík, M University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50149958 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50149958&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44392937 104038016 CHEMBL3770152 ZINC28360228 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50472122 CCCCOC(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C27H28BrN5O5S/c28-20-12-13-24(30-17-20)32-25(34)16-22(27(36)33-14-4-1-5-15-33)31-26(35)19-10-8-18(9-11-19)21-6-2-3-7-23(21)39(29,37)38/h2-3,6-13,17,22H,1,4-5,14-16H2,(H,31,35)(H2,29,37,38)(H,30,32,34) FDRKJXHUGXZBQD-UHFFFAOYSA-N 50149959 CHEMBL3769959 Cholinesterase 40940 ChEMBL 10.1016/j.bmc.2016.02.033 10.7270/Q2XW4MPW 26947959 Pejchal, V; Štepánková, Š; Pejchalová, M; Královec, K; Havelek, R; Ružicková, Z; Ajani, H; Lo, R; Lepšík, M University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50149959 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50149959&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10189176 104038017 CHEMBL3769959 ZINC28365096 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50472123 CC(C)OC(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C30H34BrN5O3/c1-35(2)20-23-8-4-5-9-25(23)21-10-12-22(13-11-21)29(38)33-26(30(39)36-16-6-3-7-17-36)18-28(37)34-27-15-14-24(31)19-32-27/h4-5,8-15,19,26H,3,6-7,16-18,20H2,1-2H3,(H,33,38)(H,32,34,37)/t26-/m0/s1 WVDHICHMHDMFMK-SANMLTNESA-N 50149960 CHEMBL3771281 Cholinesterase 32710 ChEMBL 10.1016/j.bmc.2016.02.033 10.7270/Q2XW4MPW 26947959 Pejchal, V; Štepánková, Š; Pejchalová, M; Královec, K; Havelek, R; Ružicková, Z; Ajani, H; Lo, R; Lepšík, M University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50149960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50149960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44393371 104038018 CHEMBL3771281 ZINC28376220 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50472124 CC(C)COC(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C22H20BrN3O4S/c23-16-7-11-18(12-8-16)26-22(28)14-13-21(27)25-17-9-5-15(6-10-17)19-3-1-2-4-20(19)31(24,29)30/h1-12H,13-14H2,(H,25,27)(H,26,28)(H2,24,29,30) LZGRJZKMVMPPFX-UHFFFAOYSA-N 50149961 CHEMBL3770054 Cholinesterase 40210 ChEMBL 10.1016/j.bmc.2016.02.033 10.7270/Q2XW4MPW 26947959 Pejchal, V; Štepánková, Š; Pejchalová, M; Královec, K; Havelek, R; Ružicková, Z; Ajani, H; Lo, R; Lepšík, M University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50149961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50149961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44393251 104038019 CHEMBL3770054 ZINC28376992 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50472125 C[C@@H](NC(=O)OC(C)(C)C)c1nc2ccc(F)cc2s1 InChI=1S/C20H18ClN3O4S2/c21-18-10-9-16(29-18)20(26)23-12-11-19(25)24-14-7-5-13(6-8-14)15-3-1-2-4-17(15)30(22,27)28/h1-10H,11-12H2,(H,23,26)(H,24,25)(H2,22,27,28) FCPOJRLQTNEPSJ-UHFFFAOYSA-N 50149962 CHEMBL3770856 Cholinesterase 23090 ChEMBL 10.1016/j.bmc.2016.02.033 10.7270/Q2XW4MPW 26947959 Pejchal, V; Štepánková, Š; Pejchalová, M; Královec, K; Havelek, R; Ružicková, Z; Ajani, H; Lo, R; Lepšík, M University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50149962 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50149962&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44393190 104038020 CHEMBL3770856 ZINC28381681 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50472126 C[C@@H](NC(=O)OCCCl)c1nc2ccc(F)cc2s1 InChI=1S/C32H38BrN5O4/c1-37(18-19-42-2)22-25-8-4-5-9-27(25)23-10-12-24(13-11-23)31(40)35-28(32(41)38-16-6-3-7-17-38)20-30(39)36-29-15-14-26(33)21-34-29/h4-5,8-15,21,28H,3,6-7,16-20,22H2,1-2H3,(H,35,40)(H,34,36,39)/t28-/m0/s1 DPROMYPNLAQOTF-NDEPHWFRSA-N 50149939 CHEMBL3769807 Cholinesterase 41190 ChEMBL 10.1016/j.bmc.2016.02.033 10.7270/Q2XW4MPW 26947959 Pejchal, V; Štepánková, Š; Pejchalová, M; Královec, K; Havelek, R; Ružicková, Z; Ajani, H; Lo, R; Lepšík, M University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50149939 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50149939&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44393255 104037997 CHEMBL3769807 ZINC28374637 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50472127 C[C@@H](NC(=O)OCCBr)c1nc2ccc(F)cc2s1 InChI=1S/C21H19BrN4O4S/c22-15-7-10-19(24-13-15)26-21(28)12-11-20(27)25-16-8-5-14(6-9-16)17-3-1-2-4-18(17)31(23,29)30/h1-10,13H,11-12H2,(H,25,27)(H2,23,29,30)(H,24,26,28) LQTXWCFYJKNNIH-UHFFFAOYSA-N 50149948 CHEMBL3770816 Cholinesterase 38380 ChEMBL 10.1016/j.bmc.2016.02.033 10.7270/Q2XW4MPW 26947959 Pejchal, V; Štepánková, Š; Pejchalová, M; Královec, K; Havelek, R; Ružicková, Z; Ajani, H; Lo, R; Lepšík, M University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50149948 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50149948&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44393271 104038006 CHEMBL3770816 ZINC28378870 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50472128 C[C@@H](NC(=O)OCCCCl)c1nc2ccc(F)cc2s1 InChI=1S/C22H21N3O4S/c23-30(28,29)20-9-5-4-8-19(20)16-10-12-18(13-11-16)22(27)25-15-14-24-21(26)17-6-2-1-3-7-17/h1-13H,14-15H2,(H,24,26)(H,25,27)(H2,23,28,29) ZRHQOVPMWCTAEX-UHFFFAOYSA-N 50149949 CHEMBL3769638 Cholinesterase 38810 ChEMBL 10.1016/j.bmc.2016.02.033 10.7270/Q2XW4MPW 26947959 Pejchal, V; Štepánková, Š; Pejchalová, M; Královec, K; Havelek, R; Ružicková, Z; Ajani, H; Lo, R; Lepšík, M University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50149949 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50149949&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44392942 104038007 CHEMBL3769638 ZINC28364600 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50472129 C[C@@H](NC(=O)OCC(Cl)(Cl)Cl)c1nc2ccc(F)cc2s1 InChI=1S/C22H20ClN3O4S/c23-18-11-9-17(10-12-18)22(28)26-14-13-25-21(27)16-7-5-15(6-8-16)19-3-1-2-4-20(19)31(24,29)30/h1-12H,13-14H2,(H,25,27)(H,26,28)(H2,24,29,30) YLKKITNLIQQRQD-UHFFFAOYSA-N 50149950 CHEMBL3770572 Cholinesterase 8310 ChEMBL 10.1016/j.bmc.2016.02.033 10.7270/Q2XW4MPW 26947959 Pejchal, V; Štepánková, Š; Pejchalová, M; Královec, K; Havelek, R; Ružicková, Z; Ajani, H; Lo, R; Lepšík, M University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50149950 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50149950&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44392923 104038008 CHEMBL3770572 ZINC28367377 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50472131 C[C@@H](NC(=O)OCC(F)(F)Cl)c1nc2ccc(F)cc2s1 InChI=1S/C23H23N3O5S/c1-31-19-12-10-18(11-13-19)23(28)26-15-14-25-22(27)17-8-6-16(7-9-17)20-4-2-3-5-21(20)32(24,29)30/h2-13H,14-15H2,1H3,(H,25,27)(H,26,28)(H2,24,29,30) UDNDTKUXDRZAGR-UHFFFAOYSA-N 50149951 CHEMBL3771191 Cholinesterase 25620 ChEMBL 10.1016/j.bmc.2016.02.033 10.7270/Q2XW4MPW 26947959 Pejchal, V; Štepánková, Š; Pejchalová, M; Královec, K; Havelek, R; Ružicková, Z; Ajani, H; Lo, R; Lepšík, M University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50149951 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50149951&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 9933620 104038009 CHEMBL3771191 ZINC28360317 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50472132 C[C@@H](NC(=O)OCC(F)(F)F)c1nc2ccc(F)cc2s1 InChI=1S/C32H38BrN5O4/c1-37(18-19-42-2)22-25-8-4-5-9-27(25)23-10-12-24(13-11-23)31(40)35-28(32(41)38-16-6-3-7-17-38)20-30(39)36-29-15-14-26(33)21-34-29/h4-5,8-15,21,28H,3,6-7,16-20,22H2,1-2H3,(H,35,40)(H,34,36,39)/t28-/m1/s1 DPROMYPNLAQOTF-MUUNZHRXSA-N 50149952 CHEMBL3770851 Cholinesterase 63420 ChEMBL 10.1016/j.bmc.2016.02.033 10.7270/Q2XW4MPW 26947959 Pejchal, V; Štepánková, Š; Pejchalová, M; Královec, K; Havelek, R; Ružicková, Z; Ajani, H; Lo, R; Lepšík, M University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50149952 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50149952&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44393256 104038010 CHEMBL3770851 ZINC28372362 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50472133 C[C@@H](NC(=O)OCC(F)(F)C(F)F)c1nc2ccc(F)cc2s1 InChI=1S/C32H36ClN5O4/c33-26-12-13-29(34-21-26)36-30(39)20-28(32(41)38-14-4-1-5-15-38)35-31(40)24-10-8-23(9-11-24)27-7-3-2-6-25(27)22-37-16-18-42-19-17-37/h2-3,6-13,21,28H,1,4-5,14-20,22H2,(H,35,40)(H,34,36,39)/t28-/m1/s1 RNIJHAMGTJDJFY-MUUNZHRXSA-N 50149953 CHEMBL3771027 Cholinesterase 25000 ChEMBL 10.1016/j.bmc.2016.02.033 10.7270/Q2XW4MPW 26947959 Pejchal, V; Štepánková, Š; Pejchalová, M; Královec, K; Havelek, R; Ružicková, Z; Ajani, H; Lo, R; Lepšík, M University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50149953 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50149953&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44393198 104038011 CHEMBL3771027 ZINC28376984 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50472138 C[C@@H](NC(=O)OCC(F)(F)C(F)(F)C(F)(F)F)c1nc2ccc(F)cc2s1 InChI=1S/C32H36BrN5O3/c33-26-14-15-29(34-21-26)36-30(39)20-28(32(41)38-18-4-1-5-19-38)35-31(40)24-12-10-23(11-13-24)27-9-3-2-8-25(27)22-37-16-6-7-17-37/h2-3,8-15,21,28H,1,4-7,16-20,22H2,(H,35,40)(H,34,36,39)/t28-/m1/s1 JBZYNUVBPMFUDV-MUUNZHRXSA-N 50149954 CHEMBL3770408 Cholinesterase 74510 ChEMBL 10.1016/j.bmc.2016.02.033 10.7270/Q2XW4MPW 26947959 Pejchal, V; Štepánková, Š; Pejchalová, M; Královec, K; Havelek, R; Ružicková, Z; Ajani, H; Lo, R; Lepšík, M University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50149954 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50149954&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44393197 104038012 CHEMBL3770408 ZINC28377806 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50472139 COCCOC(=O)N[C@H](C)c1nc2ccc(F)cc2s1 InChI=1S/C22H20ClN3O4S/c23-17-9-11-18(12-10-17)26-21(27)13-14-25-22(28)16-7-5-15(6-8-16)19-3-1-2-4-20(19)31(24,29)30/h1-12H,13-14H2,(H,25,28)(H,26,27)(H2,24,29,30) BJVUBCMRIXFEGX-UHFFFAOYSA-N 50149955 CHEMBL3770297 Cholinesterase 66330 ChEMBL 10.1016/j.bmc.2016.02.033 10.7270/Q2XW4MPW 26947959 Pejchal, V; Štepánková, Š; Pejchalová, M; Královec, K; Havelek, R; Ružicková, Z; Ajani, H; Lo, R; Lepšík, M University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50149955 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50149955&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44392902 104038013 CHEMBL3770297 ZINC28359763 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50472140 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 10620 (S)-3-(1-(dimethylamino)ethyl)phenyl ethyl(methyl)carbamate::3-((1S)-1-(Dimethylamino)ethyl)phenyl N-ethyl N-methyl carbamate::3-(1-(dimethylamino)ethyl)phenyl ethyl(methyl)carbamate::3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::CHEMBL636::ENA-713::Ethyl-methyl-carbamic acid 3-((R)-1-dimethylamino-ethyl)-phenyl ester::Ethyl-methyl-carbamic acid 3-((S)-1-dimethylamino-ethyl)-phenyl ester::Ethyl-methyl-carbamic acid 3-(1-dimethylamino-ethyl)-phenyl ester::Exelon::Rivastigmine::Rivastigmine (1)::SDZ-212-713::SDZ-ENA-713 Cholinesterase 38420 ChEMBL 10.1016/j.bmc.2016.02.033 10.7270/Q2XW4MPW 26947959 Pejchal, V; Štepánková, Š; Pejchalová, M; Královec, K; Havelek, R; Ružicková, Z; Ajani, H; Lo, R; Lepšík, M University of Pardubice http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10620 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10620&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46511221 8874 CHEMBL636 DB00989 6602 C11766 ZINC00004413 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50468220 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 20 ChEMBL 10.1016/j.bmc.2016.02.023 10.7270/Q2125VHK 26917219 Xie, SS; Lan, JS; Wang, X; Wang, ZM; Jiang, N; Li, F; Wu, JJ; Wang, J; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50468221 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 3790 ChEMBL 10.1016/j.bmc.2016.02.023 10.7270/Q2125VHK 26917219 Xie, SS; Lan, JS; Wang, X; Wang, ZM; Jiang, N; Li, F; Wu, JJ; Wang, J; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50468222 Cc1cc(=O)oc2cc(CNCCC3CCN(Cc4ccccc4)CC3)ccc12 InChI=1S/C25H30N2O2/c1-19-15-25(28)29-24-16-22(7-8-23(19)24)17-26-12-9-20-10-13-27(14-11-20)18-21-5-3-2-4-6-21/h2-8,15-16,20,26H,9-14,17-18H2,1H3 HZEOKPNLIUABIQ-UHFFFAOYSA-N 50147611 CHEMBL3764211 Cholinesterase 960 ChEMBL 10.1016/j.bmc.2016.02.023 10.7270/Q2125VHK 26917219 Xie, SS; Lan, JS; Wang, X; Wang, ZM; Jiang, N; Li, F; Wu, JJ; Wang, J; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50147611 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50147611&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44340461 85476506 CHEMBL3764211 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50468223 Cc1cc(=O)oc2cc(CNC3CCN(Cc4ccccc4)CC3)ccc12 InChI=1S/C23H26N2O2/c1-17-13-23(26)27-22-14-19(7-8-21(17)22)15-24-20-9-11-25(12-10-20)16-18-5-3-2-4-6-18/h2-8,13-14,20,24H,9-12,15-16H2,1H3 PDEVIVJKZGXTTC-UHFFFAOYSA-N 50147610 CHEMBL3765442 Cholinesterase 10830 ChEMBL 10.1016/j.bmc.2016.02.023 10.7270/Q2125VHK 26917219 Xie, SS; Lan, JS; Wang, X; Wang, ZM; Jiang, N; Li, F; Wu, JJ; Wang, J; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50147610 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50147610&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10039905 85476232 CHEMBL3765442 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50468224 O=c1oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc2c2CCCCc12 InChI=1S/C27H32N2O3/c30-27-25-9-5-4-8-23(25)24-11-10-22(18-26(24)32-27)31-17-14-28-21-12-15-29(16-13-21)19-20-6-2-1-3-7-20/h1-3,6-7,10-11,18,21,28H,4-5,8-9,12-17,19H2 QZRBOLHGJBENEV-UHFFFAOYSA-N 50147609 CHEMBL3763535 Cholinesterase 930 ChEMBL 10.1016/j.bmc.2016.02.023 10.7270/Q2125VHK 26917219 Xie, SS; Lan, JS; Wang, X; Wang, ZM; Jiang, N; Li, F; Wu, JJ; Wang, J; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50147609 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50147609&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44340470 85476518 CHEMBL3763535 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50468225 Cc1c(Cl)c(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 InChI=1S/C24H27ClN2O3/c1-17-21-8-7-20(15-22(21)30-24(28)23(17)25)29-14-11-26-19-9-12-27(13-10-19)16-18-5-3-2-4-6-18/h2-8,15,19,26H,9-14,16H2,1H3 UUZIPHVUUZOBHC-UHFFFAOYSA-N 50147608 CHEMBL3764762 Cholinesterase 1420 ChEMBL 10.1016/j.bmc.2016.02.023 10.7270/Q2125VHK 26917219 Xie, SS; Lan, JS; Wang, X; Wang, ZM; Jiang, N; Li, F; Wu, JJ; Wang, J; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50147608 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50147608&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44340324 85476181 CHEMBL3764762 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50468226 Cc1c(C)c(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 InChI=1S/C25H30N2O3/c1-18-19(2)25(28)30-24-16-22(8-9-23(18)24)29-15-12-26-21-10-13-27(14-11-21)17-20-6-4-3-5-7-20/h3-9,16,21,26H,10-15,17H2,1-2H3 IPJZSNUPIXZHAU-UHFFFAOYSA-N 50147607 CHEMBL3764609 Cholinesterase 1670 ChEMBL 10.1016/j.bmc.2016.02.023 10.7270/Q2125VHK 26917219 Xie, SS; Lan, JS; Wang, X; Wang, ZM; Jiang, N; Li, F; Wu, JJ; Wang, J; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50147607 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50147607&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44340730 85477260 CHEMBL3764609 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50468227 Cc1cc2ccc(OCCNC3CCN(Cc4ccccc4)CC3)cc2oc1=O InChI=1S/C24H28N2O3/c1-18-15-20-7-8-22(16-23(20)29-24(18)27)28-14-11-25-21-9-12-26(13-10-21)17-19-5-3-2-4-6-19/h2-8,15-16,21,25H,9-14,17H2,1H3 JURRMYXCDPPYMK-UHFFFAOYSA-N 50147606 CHEMBL3764644 Cholinesterase 7530 ChEMBL 10.1016/j.bmc.2016.02.023 10.7270/Q2125VHK 26917219 Xie, SS; Lan, JS; Wang, X; Wang, ZM; Jiang, N; Li, F; Wu, JJ; Wang, J; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50147606 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50147606&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44340433 85476448 CHEMBL3764644 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50468228 O=c1cc(-c2ccccc2)c2ccc(OCCNC3CCN(Cc4ccccc4)CC3)cc2o1 InChI=1S/C29H30N2O3/c32-29-20-27(23-9-5-2-6-10-23)26-12-11-25(19-28(26)34-29)33-18-15-30-24-13-16-31(17-14-24)21-22-7-3-1-4-8-22/h1-12,19-20,24,30H,13-18,21H2 KOAOVWXOZSDQBP-UHFFFAOYSA-N 50147605 CHEMBL3764334 Cholinesterase 8930 ChEMBL 10.1016/j.bmc.2016.02.023 10.7270/Q2125VHK 26917219 Xie, SS; Lan, JS; Wang, X; Wang, ZM; Jiang, N; Li, F; Wu, JJ; Wang, J; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50147605 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50147605&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44340469 85476517 CHEMBL3764334 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50468229 FC(F)(F)c1cc(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 InChI=1S/C24H25F3N2O3/c25-24(26,27)21-15-23(30)32-22-14-19(6-7-20(21)22)31-13-10-28-18-8-11-29(12-9-18)16-17-4-2-1-3-5-17/h1-7,14-15,18,28H,8-13,16H2 FDDWWWOIEISVTE-UHFFFAOYSA-N 50147604 CHEMBL3764408 Cholinesterase 10220 ChEMBL 10.1016/j.bmc.2016.02.023 10.7270/Q2125VHK 26917219 Xie, SS; Lan, JS; Wang, X; Wang, ZM; Jiang, N; Li, F; Wu, JJ; Wang, J; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50147604 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50147604&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44340487 85476552 CHEMBL3764408 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50468230 CCOc1cc(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 InChI=1S/C25H30N2O4/c1-2-29-23-17-25(28)31-24-16-21(8-9-22(23)24)30-15-12-26-20-10-13-27(14-11-20)18-19-6-4-3-5-7-19/h3-9,16-17,20,26H,2,10-15,18H2,1H3 GKYZWZKQBZYQOH-UHFFFAOYSA-N 50147603 CHEMBL3764112 Cholinesterase 6950 ChEMBL 10.1016/j.bmc.2016.02.023 10.7270/Q2125VHK 26917219 Xie, SS; Lan, JS; Wang, X; Wang, ZM; Jiang, N; Li, F; Wu, JJ; Wang, J; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50147603 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50147603&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44340418 85476411 CHEMBL3764112 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50468231 COc1cc(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 InChI=1S/C24H28N2O4/c1-28-22-16-24(27)30-23-15-20(7-8-21(22)23)29-14-11-25-19-9-12-26(13-10-19)17-18-5-3-2-4-6-18/h2-8,15-16,19,25H,9-14,17H2,1H3 LQNPMZWHOLIOEU-UHFFFAOYSA-N 50147602 CHEMBL3764166 Cholinesterase 5640 ChEMBL 10.1016/j.bmc.2016.02.023 10.7270/Q2125VHK 26917219 Xie, SS; Lan, JS; Wang, X; Wang, ZM; Jiang, N; Li, F; Wu, JJ; Wang, J; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50147602 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50147602&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44340336 85476198 CHEMBL3764166 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50468232 Clc1cc(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 InChI=1S/C23H25ClN2O3/c24-21-15-23(27)29-22-14-19(6-7-20(21)22)28-13-10-25-18-8-11-26(12-9-18)16-17-4-2-1-3-5-17/h1-7,14-15,18,25H,8-13,16H2 XATVGNRTOUJFHU-UHFFFAOYSA-N 50147601 CHEMBL3765293 Cholinesterase 1480 ChEMBL 10.1016/j.bmc.2016.02.023 10.7270/Q2125VHK 26917219 Xie, SS; Lan, JS; Wang, X; Wang, ZM; Jiang, N; Li, F; Wu, JJ; Wang, J; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50147601 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50147601&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44340325 85476182 CHEMBL3765293 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50468233 Cc1cc(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 InChI=1S/C24H28N2O3/c1-18-15-24(27)29-23-16-21(7-8-22(18)23)28-14-11-25-20-9-12-26(13-10-20)17-19-5-3-2-4-6-19/h2-8,15-16,20,25H,9-14,17H2,1H3 VCCISXVIIKLUNO-UHFFFAOYSA-N 50147600 CHEMBL3764436 Cholinesterase 4380 ChEMBL 10.1016/j.bmc.2016.02.023 10.7270/Q2125VHK 26917219 Xie, SS; Lan, JS; Wang, X; Wang, ZM; Jiang, N; Li, F; Wu, JJ; Wang, J; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50147600 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50147600&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44340436 85476454 CHEMBL3764436 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50468234 O=c1ccc2ccc(OCCNCCC3CCN(Cc4ccccc4)CC3)cc2o1 InChI=1S/C25H30N2O3/c28-25-9-7-22-6-8-23(18-24(22)30-25)29-17-14-26-13-10-20-11-15-27(16-12-20)19-21-4-2-1-3-5-21/h1-9,18,20,26H,10-17,19H2 OLXGWSKUULDSEJ-UHFFFAOYSA-N 50147599 CHEMBL3765760 Cholinesterase 9790 ChEMBL 10.1016/j.bmc.2016.02.023 10.7270/Q2125VHK 26917219 Xie, SS; Lan, JS; Wang, X; Wang, ZM; Jiang, N; Li, F; Wu, JJ; Wang, J; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50147599 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50147599&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44340216 104036091 CHEMBL3765760 ZINC38155052 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50468235 O=c1ccc2ccc(OCCCNC3CCN(Cc4ccccc4)CC3)cc2o1 InChI=1S/C24H28N2O3/c27-24-10-8-20-7-9-22(17-23(20)29-24)28-16-4-13-25-21-11-14-26(15-12-21)18-19-5-2-1-3-6-19/h1-3,5-10,17,21,25H,4,11-16,18H2 HXYMYZXCUHALCL-UHFFFAOYSA-N 50147598 CHEMBL3763819 Cholinesterase 9860 ChEMBL 10.1016/j.bmc.2016.02.023 10.7270/Q2125VHK 26917219 Xie, SS; Lan, JS; Wang, X; Wang, ZM; Jiang, N; Li, F; Wu, JJ; Wang, J; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50147598 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50147598&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44340135 104036090 CHEMBL3763819 ZINC26983164 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50468236 O=c1ccc2ccc(OCCNC3CCN(Cc4ccccc4)CC3)cc2o1 InChI=1S/C23H26N2O3/c26-23-9-7-19-6-8-21(16-22(19)28-23)27-15-12-24-20-10-13-25(14-11-20)17-18-4-2-1-3-5-18/h1-9,16,20,24H,10-15,17H2 BOXHJLTYYUXRSS-UHFFFAOYSA-N 50147597 CHEMBL3764276 Cholinesterase 5340 ChEMBL 10.1016/j.bmc.2016.02.023 10.7270/Q2125VHK 26917219 Xie, SS; Lan, JS; Wang, X; Wang, ZM; Jiang, N; Li, F; Wu, JJ; Wang, J; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50147597 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50147597&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44340218 104036089 CHEMBL3764276 ZINC38155050 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50490187 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 28300 ChEMBL 10.1016/j.bmcl.2016.03.039 10.7270/Q2ZP481G 26995529 Delogu, GL; Matos, MJ; Fanti, M; Era, B; Medda, R; Pieroni, E; Fais, A; Kumar, A; Pintus, F University of Cagliari http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50490188 Oc1ccc(cc1)-c1cc2cccc(Cl)c2o1 InChI=1S/C14H9ClO2/c15-12-3-1-2-10-8-13(17-14(10)12)9-4-6-11(16)7-5-9/h1-8,16H LHBDJOOCOGNAPZ-UHFFFAOYSA-N 50162930 CHEMBL3794413 Cholinesterase 30300 ChEMBL 10.1016/j.bmcl.2016.03.039 10.7270/Q2ZP481G 26995529 Delogu, GL; Matos, MJ; Fanti, M; Era, B; Medda, R; Pieroni, E; Fais, A; Kumar, A; Pintus, F University of Cagliari http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50162930 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50162930&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 114735973 341097095 CHEMBL3794413 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50490189 Oc1ccc(cc1)-c1cc2cc(Cl)ccc2o1 InChI=1S/C14H9ClO2/c15-11-3-6-13-10(7-11)8-14(17-13)9-1-4-12(16)5-2-9/h1-8,16H IZMHRHFIVMPTQG-UHFFFAOYSA-N 50162931 CHEMBL3792674 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2016.03.039 10.7270/Q2ZP481G 26995529 Delogu, GL; Matos, MJ; Fanti, M; Era, B; Medda, R; Pieroni, E; Fais, A; Kumar, A; Pintus, F University of Cagliari http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50162931 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50162931&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10171444 341097096 CHEMBL3792674 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50490190 Oc1ccc(cc1)-c1cc2cccc(Br)c2o1 InChI=1S/C14H9BrO2/c15-12-3-1-2-10-8-13(17-14(10)12)9-4-6-11(16)7-5-9/h1-8,16H RPWDVRCFSAOPBZ-UHFFFAOYSA-N 50162932 CHEMBL3794353 Cholinesterase 82500 ChEMBL 10.1016/j.bmcl.2016.03.039 10.7270/Q2ZP481G 26995529 Delogu, GL; Matos, MJ; Fanti, M; Era, B; Medda, R; Pieroni, E; Fais, A; Kumar, A; Pintus, F University of Cagliari http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50162932 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50162932&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127032396 341097097 CHEMBL3794353 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50490191 Oc1ccc(cc1)-c1cc2cc(Br)ccc2o1 InChI=1S/C14H9BrO2/c15-11-3-6-13-10(7-11)8-14(17-13)9-1-4-12(16)5-2-9/h1-8,16H RHFCUYVQYMOTMK-UHFFFAOYSA-N 50162933 CHEMBL3794374 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2016.03.039 10.7270/Q2ZP481G 26995529 Delogu, GL; Matos, MJ; Fanti, M; Era, B; Medda, R; Pieroni, E; Fais, A; Kumar, A; Pintus, F University of Cagliari http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50162933 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50162933&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10286214 341097098 CHEMBL3794374 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50490192 Cc1cccc2cc(oc12)-c1ccc(O)cc1 InChI=1S/C15H12O2/c1-10-3-2-4-12-9-14(17-15(10)12)11-5-7-13(16)8-6-11/h2-9,16H,1H3 HMSPSLJLOGCTTH-UHFFFAOYSA-N 50162934 CHEMBL3794486 Cholinesterase 77000 ChEMBL 10.1016/j.bmcl.2016.03.039 10.7270/Q2ZP481G 26995529 Delogu, GL; Matos, MJ; Fanti, M; Era, B; Medda, R; Pieroni, E; Fais, A; Kumar, A; Pintus, F University of Cagliari http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50162934 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50162934&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 113624418 341097099 CHEMBL3794486 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50490193 Cc1ccc2oc(cc2c1)-c1ccc(O)cc1 InChI=1S/C15H12O2/c1-10-2-7-14-12(8-10)9-15(17-14)11-3-5-13(16)6-4-11/h2-9,16H,1H3 ONDYQJNXLVLOEL-UHFFFAOYSA-N 50162935 CHEMBL3793479 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2016.03.039 10.7270/Q2ZP481G 26995529 Delogu, GL; Matos, MJ; Fanti, M; Era, B; Medda, R; Pieroni, E; Fais, A; Kumar, A; Pintus, F University of Cagliari http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50162935 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50162935&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 85522734 341097100 CHEMBL3793479 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50490194 Oc1ccc(cc1)-c1cc2ccccc2o1 InChI=1S/C14H10O2/c15-12-7-5-10(6-8-12)14-9-11-3-1-2-4-13(11)16-14/h1-9,15H YTEKHDAKURIPLM-UHFFFAOYSA-N 50162937 CHEMBL3794402 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2016.03.039 10.7270/Q2ZP481G 26995529 Delogu, GL; Matos, MJ; Fanti, M; Era, B; Medda, R; Pieroni, E; Fais, A; Kumar, A; Pintus, F University of Cagliari http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50162937 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50162937&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10125163 341097101 CHEMBL3794402 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50490195 Brc1cccc2cc(oc12)-c1ccccc1 InChI=1S/C14H9BrO/c15-12-8-4-7-11-9-13(16-14(11)12)10-5-2-1-3-6-10/h1-9H UNCGWZHKOBPZNR-UHFFFAOYSA-N 50162938 CHEMBL3793173 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2016.03.039 10.7270/Q2ZP481G 26995529 Delogu, GL; Matos, MJ; Fanti, M; Era, B; Medda, R; Pieroni, E; Fais, A; Kumar, A; Pintus, F University of Cagliari http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50162938 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50162938&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 16120366 341097102 CHEMBL3793173 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50490196 COc1ccc(cc1)-c1cc2cccc(Cl)c2o1 InChI=1S/C15H11ClO2/c1-17-12-7-5-10(6-8-12)14-9-11-3-2-4-13(16)15(11)18-14/h2-9H,1H3 WPWUPBWJICPLME-UHFFFAOYSA-N 50162939 CHEMBL3794002 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2016.03.039 10.7270/Q2ZP481G 26995529 Delogu, GL; Matos, MJ; Fanti, M; Era, B; Medda, R; Pieroni, E; Fais, A; Kumar, A; Pintus, F University of Cagliari http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50162939 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50162939&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127030028 341097103 CHEMBL3794002 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50490197 COc1ccc(cc1)-c1cc2ccccc2o1 InChI=1S/C15H12O2/c1-16-13-8-6-11(7-9-13)15-10-12-4-2-3-5-14(12)17-15/h2-10H,1H3 UKHHJBHJLJNZRN-UHFFFAOYSA-N 50162940 CHEMBL3794170 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2016.03.039 10.7270/Q2ZP481G 26995529 Delogu, GL; Matos, MJ; Fanti, M; Era, B; Medda, R; Pieroni, E; Fais, A; Kumar, A; Pintus, F University of Cagliari http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50162940 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50162940&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10727834 341097104 CHEMBL3794170 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50490198 c1c(oc2ccccc12)-c1ccccc1 InChI=1S/C14H10O/c1-2-6-11(7-3-1)14-10-12-8-4-5-9-13(12)15-14/h1-10H HXMZLDUBSSPQIB-UHFFFAOYSA-N 50162941 2-Phenylbenzofuran::CHEMBL1643182 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2016.03.039 10.7270/Q2ZP481G 26995529 Delogu, GL; Matos, MJ; Fanti, M; Era, B; Medda, R; Pieroni, E; Fais, A; Kumar, A; Pintus, F University of Cagliari http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50162941 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50162941&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3517936 341097105 CHEMBL1643182 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50490199 Oc1ccc(cc1)-c1cc2cccc(Cl)c2o1 InChI=1S/C14H9ClO2/c15-12-3-1-2-10-8-13(17-14(10)12)9-4-6-11(16)7-5-9/h1-8,16H LHBDJOOCOGNAPZ-UHFFFAOYSA-N 50162930 CHEMBL3794413 Cholinesterase 5000 ChEMBL 10.1016/j.bmcl.2016.03.039 10.7270/Q2ZP481G 26995529 Delogu, GL; Matos, MJ; Fanti, M; Era, B; Medda, R; Pieroni, E; Fais, A; Kumar, A; Pintus, F University of Cagliari http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50162930 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50162930&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 114735973 341097095 CHEMBL3794413 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50490200 Oc1ccc(cc1)-c1cc2cccc(Cl)c2o1 InChI=1S/C14H9ClO2/c15-12-3-1-2-10-8-13(17-14(10)12)9-4-6-11(16)7-5-9/h1-8,16H LHBDJOOCOGNAPZ-UHFFFAOYSA-N 50162930 CHEMBL3794413 Cholinesterase 87400 ChEMBL 10.1016/j.bmcl.2016.03.039 10.7270/Q2ZP481G 26995529 Delogu, GL; Matos, MJ; Fanti, M; Era, B; Medda, R; Pieroni, E; Fais, A; Kumar, A; Pintus, F University of Cagliari http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50162930 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50162930&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 114735973 341097095 CHEMBL3794413 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50490281 O=C1N(CCCCCCCCCN2CCN(Cc3ccccc3)CC2)C(=O)c2ccccc12 InChI=1S/C28H37N3O2/c32-27-25-15-9-10-16-26(25)28(33)31(27)18-12-5-3-1-2-4-11-17-29-19-21-30(22-20-29)23-24-13-7-6-8-14-24/h6-10,13-16H,1-5,11-12,17-23H2 ZSVRCSKJPOPYPJ-UHFFFAOYSA-N 50163321 CHEMBL3793136 Cholinesterase 33 ChEMBL 10.1016/j.bmcl.2015.07.052 10.7270/Q29Z96TQ 27017111 Si, W; Zhang, T; Zhang, L; Mei, X; Dong, M; Zhang, K; Ning, J Chinese Academy of Agricultural Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50163321 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50163321&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127029744 341097139 CHEMBL3793136 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50492729 COc1ccc(CC(=O)OCC(=O)Nc2c3CCCCc3nc3ccccc23)cc1 InChI=1S/C24H24N2O4/c1-29-17-12-10-16(11-13-17)14-23(28)30-15-22(27)26-24-18-6-2-4-8-20(18)25-21-9-5-3-7-19(21)24/h2,4,6,8,10-13H,3,5,7,9,14-15H2,1H3,(H,25,26,27) CZVXWOOGMCGBKP-UHFFFAOYSA-N 50165321 CHEMBL3797646 Cholinesterase 319 ChEMBL 10.1016/j.ejmech.2016.03.077 10.7270/Q2XK8HGC 27061983 Zhang, C; Du, QY; Chen, LD; Wu, WH; Liao, SY; Yu, LH; Liang, XT Guangzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50165321 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50165321&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127045901 341097649 CHEMBL3797646 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50492730 COc1ccc(CC(=O)OCC(=O)Nc2c3CCCCc3nc3ccccc23)cc1OC InChI=1S/C25H26N2O5/c1-30-21-12-11-16(13-22(21)31-2)14-24(29)32-15-23(28)27-25-17-7-3-5-9-19(17)26-20-10-6-4-8-18(20)25/h3,5,7,9,11-13H,4,6,8,10,14-15H2,1-2H3,(H,26,27,28) GGGDUGIJPHCLIV-UHFFFAOYSA-N 50165322 CHEMBL3797706 Cholinesterase 554 ChEMBL 10.1016/j.ejmech.2016.03.077 10.7270/Q2XK8HGC 27061983 Zhang, C; Du, QY; Chen, LD; Wu, WH; Liao, SY; Yu, LH; Liang, XT Guangzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50165322 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50165322&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127045902 341097650 CHEMBL3797706 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50492731 COc1ccc(CC(=O)OCC(=O)Nc2c3CCCCc3nc3ccccc23)c(OC)c1OC InChI=1S/C26H28N2O6/c1-31-21-13-12-16(25(32-2)26(21)33-3)14-23(30)34-15-22(29)28-24-17-8-4-6-10-19(17)27-20-11-7-5-9-18(20)24/h4,6,8,10,12-13H,5,7,9,11,14-15H2,1-3H3,(H,27,28,29) AYFDPIXHKLCDIY-UHFFFAOYSA-N 50165323 CHEMBL3799558 Cholinesterase 364 ChEMBL 10.1016/j.ejmech.2016.03.077 10.7270/Q2XK8HGC 27061983 Zhang, C; Du, QY; Chen, LD; Wu, WH; Liao, SY; Yu, LH; Liang, XT Guangzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50165323 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50165323&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127045903 341097651 CHEMBL3799558 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50492732 Oc1ccc(CC(=O)OCC(=O)Nc2c3CCCCc3nc3ccccc23)cc1 InChI=1S/C23H22N2O4/c26-16-11-9-15(10-12-16)13-22(28)29-14-21(27)25-23-17-5-1-3-7-19(17)24-20-8-4-2-6-18(20)23/h1,3,5,7,9-12,26H,2,4,6,8,13-14H2,(H,24,25,27) PHSRKEFFSKISFF-UHFFFAOYSA-N 50165324 CHEMBL3798857 Cholinesterase 239 ChEMBL 10.1016/j.ejmech.2016.03.077 10.7270/Q2XK8HGC 27061983 Zhang, C; Du, QY; Chen, LD; Wu, WH; Liao, SY; Yu, LH; Liang, XT Guangzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50165324 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50165324&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127045904 341097652 CHEMBL3798857 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50492733 Clc1ccc(CC(=O)OCC(=O)Nc2c3CCCCc3nc3ccccc23)cc1 InChI=1S/C23H21ClN2O3/c24-16-11-9-15(10-12-16)13-22(28)29-14-21(27)26-23-17-5-1-3-7-19(17)25-20-8-4-2-6-18(20)23/h1,3,5,7,9-12H,2,4,6,8,13-14H2,(H,25,26,27) SHUHJCFIELPSHE-UHFFFAOYSA-N 50165327 CHEMBL3797623 Cholinesterase 218 ChEMBL 10.1016/j.ejmech.2016.03.077 10.7270/Q2XK8HGC 27061983 Zhang, C; Du, QY; Chen, LD; Wu, WH; Liao, SY; Yu, LH; Liang, XT Guangzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50165327 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50165327&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127046118 104050883 CHEMBL3797623 ZINC13642897 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50492734 COc1cc(OC)cc(c1)C(=O)OCC(=O)Nc1c2CCCCc2nc2ccccc12 InChI=1S/C24H24N2O5/c1-29-16-11-15(12-17(13-16)30-2)24(28)31-14-22(27)26-23-18-7-3-5-9-20(18)25-21-10-6-4-8-19(21)23/h3,5,7,9,11-13H,4,6,8,10,14H2,1-2H3,(H,25,26,27) VLLAJKSEOZIMSD-UHFFFAOYSA-N 50165333 CHEMBL3798989 Cholinesterase 224 ChEMBL 10.1016/j.ejmech.2016.03.077 10.7270/Q2XK8HGC 27061983 Zhang, C; Du, QY; Chen, LD; Wu, WH; Liao, SY; Yu, LH; Liang, XT Guangzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50165333 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50165333&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127047951 104050889 CHEMBL3798989 ZINC13642881 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50492735 COc1cc(cc(OC)c1OC)C(=O)OCC(=O)Nc1c2CCCCc2nc2ccccc12 InChI=1S/C25H26N2O6/c1-30-20-12-15(13-21(31-2)24(20)32-3)25(29)33-14-22(28)27-23-16-8-4-6-10-18(16)26-19-11-7-5-9-17(19)23/h4,6,8,10,12-13H,5,7,9,11,14H2,1-3H3,(H,26,27,28) QRCYPMQEZQPTCX-UHFFFAOYSA-N 50165334 CHEMBL3797363 Cholinesterase 329 ChEMBL 10.1016/j.ejmech.2016.03.077 10.7270/Q2XK8HGC 27061983 Zhang, C; Du, QY; Chen, LD; Wu, WH; Liao, SY; Yu, LH; Liang, XT Guangzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50165334 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50165334&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127047952 104050890 CHEMBL3797363 ZINC13642892 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488454 CNC(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1 InChI=1S/C15H21N3O2/c1-15-7-8-17(3)13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2/h5-6,9,13H,7-8H2,1-4H3,(H,16,19)/t13-,15+/m1/s1 PIJVFDBKTWXHHD-HIFRSBDPSA-N 50004000 (3aS,8aR)-1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol-5-yl methylcarbamate::Antilirium::CHEMBL94::Eserine::Physostol::physostigmine Cholinesterase 78 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50004000 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50004000&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5983 103917788 27953 CHEMBL94 DB00981 6598 C06535 ZINC33971762 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488455 CCCCCCCNC(=O)Oc1ccc2nc(ncc2c1)-c1ccccc1 InChI=1S/C22H25N3O2/c1-2-3-4-5-9-14-23-22(26)27-19-12-13-20-18(15-19)16-24-21(25-20)17-10-7-6-8-11-17/h6-8,10-13,15-16H,2-5,9,14H2,1H3,(H,23,26) UFHGBKIPPJJYSN-UHFFFAOYSA-N 50160245 CHEMBL3785462 Cholinesterase 1800 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160245 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160245&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127033068 104046805 CHEMBL3785462 ZINC28342474 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488456 CCCCCCCNC(=O)Oc1ccc2N(C)C(N(Cc3ccccc3)Cc2c1)c1ccccc1 InChI=1S/C18H21NOS/c1-14-6-5-9-16(12-14)21-18(15-7-3-2-4-8-15)17-13-19-10-11-20-17/h2-9,12,17-19H,10-11,13H2,1H3/t17-,18-/m0/s1 HIOVXNATPKFXOD-ROUUACIJSA-N 50160247 CHEMBL3786119 Cholinesterase 34 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160247 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160247&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127032755 104046807 CHEMBL3786119 ZINC28343448 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488457 CCCCCCCNC(=O)Oc1ccc2N(C)C(N(CCC)Cc2c1)c1ccccc1 InChI=1S/C17H19NOS/c1-3-7-14(8-4-1)17(16-13-18-11-12-19-16)20-15-9-5-2-6-10-15/h1-10,16-18H,11-13H2/t16-,17-/m0/s1 ZUWZVCUMVJKALO-IRXDYDNUSA-N 50160249 CHEMBL3785181 Cholinesterase 40 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160249 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160249&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127032754 104046809 CHEMBL3785181 ZINC28134053 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488458 CCCCCCCNC(=O)Oc1ccc2N(C)C(N(Cc2c1)C(C)C)c1ccccc1 InChI=1S/C26H37N3O2/c1-5-6-7-8-12-17-27-26(30)31-23-15-16-24-22(18-23)19-29(20(2)3)25(28(24)4)21-13-10-9-11-14-21/h9-11,13-16,18,20,25H,5-8,12,17,19H2,1-4H3,(H,27,30) DFFDKRZSZRYYMY-UHFFFAOYSA-N 50160250 CHEMBL3785472 Cholinesterase 21 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160250 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160250&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127032753 340134681 CHEMBL3785472 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488459 CCCCCCCNC(=O)Oc1ccc2N(C)C(N(C)Cc2c1)c1c(Cl)cccc1Cl InChI=1S/C24H31Cl2N3O2/c1-4-5-6-7-8-14-27-24(30)31-18-12-13-21-17(15-18)16-28(2)23(29(21)3)22-19(25)10-9-11-20(22)26/h9-13,15,23H,4-8,14,16H2,1-3H3,(H,27,30) MYYOBQOWADXWAI-UHFFFAOYSA-N 50160251 CHEMBL3785766 Cholinesterase 531 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160251 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160251&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127032752 340134682 CHEMBL3785766 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488460 CCCCCCCNC(=O)Oc1ccc2N(C)C(N(C)Cc2c1)c1ccc2ccccc2c1 InChI=1S/C28H35N3O2/c1-4-5-6-7-10-17-29-28(32)33-25-15-16-26-24(19-25)20-30(2)27(31(26)3)23-14-13-21-11-8-9-12-22(21)18-23/h8-9,11-16,18-19,27H,4-7,10,17,20H2,1-3H3,(H,29,32) OQRDVVUYPKWCEN-UHFFFAOYSA-N 50160252 CHEMBL3786979 Cholinesterase 374 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160252 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160252&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127032751 340134683 CHEMBL3786979 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488461 CCCCCCCNC(=O)Oc1ccc2N(C)C(N(C)Cc2c1)c1cccc2ccccc12 InChI=1S/C28H35N3O2/c1-4-5-6-7-10-18-29-28(32)33-23-16-17-26-22(19-23)20-30(2)27(31(26)3)25-15-11-13-21-12-8-9-14-24(21)25/h8-9,11-17,19,27H,4-7,10,18,20H2,1-3H3,(H,29,32) YENIHISRLSWEEW-UHFFFAOYSA-N 50160253 CHEMBL3786556 Cholinesterase 36200 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160253 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160253&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127033916 340134684 CHEMBL3786556 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488462 CCCCCCCNC(=O)Oc1ccc2N(C)C(N(C)Cc2c1)c1cc[nH]c1 InChI=1S/C22H32N4O2/c1-4-5-6-7-8-12-24-22(27)28-19-9-10-20-18(14-19)16-25(2)21(26(20)3)17-11-13-23-15-17/h9-11,13-15,21,23H,4-8,12,16H2,1-3H3,(H,24,27) BIHHINRPCUFIJM-UHFFFAOYSA-N 50160077 CHEMBL3785861 Cholinesterase 23 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160077 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160077&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127033915 104046637 CHEMBL3785861 ZINC28343710 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488463 CCCCCCCNC(=O)Oc1ccc2N(C)C(N(C)Cc2c1)c1ccoc1 InChI=1S/C22H31N3O3/c1-4-5-6-7-8-12-23-22(26)28-19-9-10-20-18(14-19)15-24(2)21(25(20)3)17-11-13-27-16-17/h9-11,13-14,16,21H,4-8,12,15H2,1-3H3,(H,23,26) SRQSNBAGODSRFW-UHFFFAOYSA-N 50160254 CHEMBL3786737 Cholinesterase 83 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160254 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160254&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127032709 340134685 CHEMBL3786737 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488464 CCCCCCCNC(=O)Oc1ccc2N(C)C(N(C)Cc2c1)c1cccs1 InChI=1S/C22H31N3O2S/c1-4-5-6-7-8-13-23-22(26)27-18-11-12-19-17(15-18)16-24(2)21(25(19)3)20-10-9-14-28-20/h9-12,14-15,21H,4-8,13,16H2,1-3H3,(H,23,26) UWWRFVZRXFROOL-UHFFFAOYSA-N 50160078 CHEMBL3787613 Cholinesterase 14 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160078 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160078&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127033914 104046638 CHEMBL3787613 ZINC28343155 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488465 CCCCCCCNC(=O)Oc1ccc2N(C)C(N(C)Cc2c1)c1ccsc1 InChI=1S/C22H31N3O2S/c1-4-5-6-7-8-12-23-22(26)27-19-9-10-20-18(14-19)15-24(2)21(25(20)3)17-11-13-28-16-17/h9-11,13-14,16,21H,4-8,12,15H2,1-3H3,(H,23,26) HKIHOAMUQYITIL-UHFFFAOYSA-N 50160255 CHEMBL3785189 Cholinesterase 22 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160255 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160255&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127030346 340134686 CHEMBL3785189 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488466 CCCCCCCNC(=O)Oc1ccc2N(C)C(N(C)Cc2c1)c1cccnc1 InChI=1S/C23H32N4O2/c1-4-5-6-7-8-14-25-23(28)29-20-11-12-21-19(15-20)17-26(2)22(27(21)3)18-10-9-13-24-16-18/h9-13,15-16,22H,4-8,14,17H2,1-3H3,(H,25,28) HSLBXTBWUDJLPO-UHFFFAOYSA-N 50160256 CHEMBL3785190 Cholinesterase 565 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160256 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160256&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127033913 340134687 CHEMBL3785190 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488467 CCCCCCCNC(=O)Oc1ccc2N(C)C(N(C)Cc2c1)c1ccncc1 InChI=1S/C23H32N4O2/c1-4-5-6-7-8-13-25-23(28)29-20-9-10-21-19(16-20)17-26(2)22(27(21)3)18-11-14-24-15-12-18/h9-12,14-16,22H,4-8,13,17H2,1-3H3,(H,25,28) FQQJQAAPPUXZRY-UHFFFAOYSA-N 50160257 CHEMBL3787554 Cholinesterase 723 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160257 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160257&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127032112 340134688 CHEMBL3787554 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488468 CCCCCCCNC(=O)Oc1ccc2N(C)C(N(C)Cc2c1)c1ccc(cc1)C(F)(F)F InChI=1S/C25H32F3N3O2/c1-4-5-6-7-8-15-29-24(32)33-21-13-14-22-19(16-21)17-30(2)23(31(22)3)18-9-11-20(12-10-18)25(26,27)28/h9-14,16,23H,4-8,15,17H2,1-3H3,(H,29,32) KFCJVSBXRUAKCE-UHFFFAOYSA-N 50160258 CHEMBL3787268 Cholinesterase 2700 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160258 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160258&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127034175 340134689 CHEMBL3787268 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488469 CCCCCCCNC(=O)Oc1ccc2N(C)C(N(C)Cc2c1)c1ccc(F)cc1 InChI=1S/C24H32FN3O2/c1-4-5-6-7-8-15-26-24(29)30-21-13-14-22-19(16-21)17-27(2)23(28(22)3)18-9-11-20(25)12-10-18/h9-14,16,23H,4-8,15,17H2,1-3H3,(H,26,29) OBQDVIVZFXUYBQ-UHFFFAOYSA-N 50160076 CHEMBL3787116 Cholinesterase 44 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160076 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160076&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127034174 104046636 CHEMBL3787116 ZINC28341484 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488470 CCCCCCCNC(=O)Oc1ccc2N(C)C(N(C)Cc2c1)c1ccccc1OC InChI=1S/C25H35N3O3/c1-5-6-7-8-11-16-26-25(29)31-20-14-15-22-19(17-20)18-27(2)24(28(22)3)21-12-9-10-13-23(21)30-4/h9-10,12-15,17,24H,5-8,11,16,18H2,1-4H3,(H,26,29) MSXUHEGCKUOYPX-UHFFFAOYSA-N 50160259 CHEMBL3785401 Cholinesterase 238 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160259 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160259&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127034173 340134690 CHEMBL3785401 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488471 CCCCCCCNC(=O)Oc1ccc2N(C)C(N(C)Cc2c1)c1cccc(OC)c1 InChI=1S/C25H35N3O3/c1-5-6-7-8-9-15-26-25(29)31-22-13-14-23-20(17-22)18-27(2)24(28(23)3)19-11-10-12-21(16-19)30-4/h10-14,16-17,24H,5-9,15,18H2,1-4H3,(H,26,29) BORQKBAQWORZCV-UHFFFAOYSA-N 50160260 CHEMBL3786761 Cholinesterase 208 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160260 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160260&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127034172 340134691 CHEMBL3786761 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488472 CCCCCCCNC(=O)Oc1ccc2N(C)C(N(C)Cc2c1)c1ccc(OC)cc1 InChI=1S/C25H35N3O3/c1-5-6-7-8-9-16-26-25(29)31-22-14-15-23-20(17-22)18-27(2)24(28(23)3)19-10-12-21(30-4)13-11-19/h10-15,17,24H,5-9,16,18H2,1-4H3,(H,26,29) HSPXGMDTHHIXNR-UHFFFAOYSA-N 50160261 CHEMBL3785495 Cholinesterase 875 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160261 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160261&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127034171 340134692 CHEMBL3785495 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488473 CCCCCCCNC(=O)Oc1ccc2N(C)C(N(C)Cc2c1)c1ccccc1C InChI=1S/C25H35N3O2/c1-5-6-7-8-11-16-26-25(29)30-21-14-15-23-20(17-21)18-27(3)24(28(23)4)22-13-10-9-12-19(22)2/h9-10,12-15,17,24H,5-8,11,16,18H2,1-4H3,(H,26,29) RQOKFPUUYQITDH-UHFFFAOYSA-N 50160262 CHEMBL3787015 Cholinesterase 251 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160262 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160262&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127034170 340134693 CHEMBL3787015 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488474 CCCCCCCNC(=O)Oc1ccc2N(C)C(N(C)Cc2c1)c1cccc(C)c1 InChI=1S/C25H35N3O2/c1-5-6-7-8-9-15-26-25(29)30-22-13-14-23-21(17-22)18-27(3)24(28(23)4)20-12-10-11-19(2)16-20/h10-14,16-17,24H,5-9,15,18H2,1-4H3,(H,26,29) DOFWOAYNOXVTDG-UHFFFAOYSA-N 50160263 CHEMBL3786599 Cholinesterase 199 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160263 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160263&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127030697 340134694 CHEMBL3786599 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488476 CCCCCCCNC(=O)Oc1ccc2N(C)C(N(C)Cc2c1)c1ccc(C)cc1 InChI=1S/C25H35N3O2/c1-5-6-7-8-9-16-26-25(29)30-22-14-15-23-21(17-22)18-27(3)24(28(23)4)20-12-10-19(2)11-13-20/h10-15,17,24H,5-9,16,18H2,1-4H3,(H,26,29) LXSWPOFQJMGBJG-UHFFFAOYSA-N 50160264 CHEMBL3787432 Cholinesterase 231 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160264 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160264&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127030696 340134695 CHEMBL3787432 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488477 CCCCCCCNC(=O)Oc1ccc2N(C)C(N(C)Cc2c1)c1ccccc1Cl InChI=1S/C24H32ClN3O2/c1-4-5-6-7-10-15-26-24(29)30-19-13-14-22-18(16-19)17-27(2)23(28(22)3)20-11-8-9-12-21(20)25/h8-9,11-14,16,23H,4-7,10,15,17H2,1-3H3,(H,26,29) SBGOWCHZUIPOPY-UHFFFAOYSA-N 50160265 CHEMBL3785143 Cholinesterase 474 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160265 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160265&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127030389 340134696 CHEMBL3785143 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488478 CCCCCCCNC(=O)Oc1ccc2N(C)C(N(C)Cc2c1)c1cccc(Cl)c1 InChI=1S/C24H32ClN3O2/c1-4-5-6-7-8-14-26-24(29)30-21-12-13-22-19(16-21)17-27(2)23(28(22)3)18-10-9-11-20(25)15-18/h9-13,15-16,23H,4-8,14,17H2,1-3H3,(H,26,29) YYHXAAIBLPXSIH-UHFFFAOYSA-N 50160266 CHEMBL3787106 Cholinesterase 96 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160266 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160266&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127031556 340134697 CHEMBL3787106 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488480 CCCCCCCNC(=O)Oc1ccc2N(C)C(N(C)Cc2c1)c1ccc(Cl)cc1 InChI=1S/C24H32ClN3O2/c1-4-5-6-7-8-15-26-24(29)30-21-13-14-22-19(16-21)17-27(2)23(28(22)3)18-9-11-20(25)12-10-18/h9-14,16,23H,4-8,15,17H2,1-3H3,(H,26,29) YNMMIXXWCBSETH-UHFFFAOYSA-N 50160267 CHEMBL3785533 Cholinesterase 115 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160267 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160267&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127030724 340134698 CHEMBL3785533 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488481 CCCCCCCNC(=O)Oc1ccc2N(C)C(N(C)Cc2c1)c1ccccc1 InChI=1S/C24H33N3O2/c1-4-5-6-7-11-16-25-24(28)29-21-14-15-22-20(17-21)18-26(2)23(27(22)3)19-12-9-8-10-13-19/h8-10,12-15,17,23H,4-7,11,16,18H2,1-3H3,(H,25,28) BSXKOKTVXBSLTC-UHFFFAOYSA-N 50160268 CHEMBL3786381 Cholinesterase 106 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160268 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160268&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127031337 340134699 CHEMBL3786381 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50492736 COc1ccc(C(=O)OCC(=O)Nc2c3CCCCc3nc3ccccc23)c(OC)c1OC InChI=1S/C25H26N2O6/c1-30-20-13-12-17(23(31-2)24(20)32-3)25(29)33-14-21(28)27-22-15-8-4-6-10-18(15)26-19-11-7-5-9-16(19)22/h4,6,8,10,12-13H,5,7,9,11,14H2,1-3H3,(H,26,27,28) FDUCSKVHXCNNFD-UHFFFAOYSA-N 50165336 CHEMBL3799703 Cholinesterase 255 ChEMBL 10.1016/j.ejmech.2016.03.077 10.7270/Q2XK8HGC 27061983 Zhang, C; Du, QY; Chen, LD; Wu, WH; Liao, SY; Yu, LH; Liang, XT Guangzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50165336 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50165336&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127047953 104050892 CHEMBL3799703 ZINC13642889 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50492737 COc1cc(ccc1O)C(=O)OCC(=O)Nc1c2CCCCc2nc2ccccc12 InChI=1S/C23H22N2O5/c1-29-20-12-14(10-11-19(20)26)23(28)30-13-21(27)25-22-15-6-2-4-8-17(15)24-18-9-5-3-7-16(18)22/h2,4,6,8,10-12,26H,3,5,7,9,13H2,1H3,(H,24,25,27) VELGHALMVDDDFE-UHFFFAOYSA-N 50165343 CHEMBL3797381 Cholinesterase 319 ChEMBL 10.1016/j.ejmech.2016.03.077 10.7270/Q2XK8HGC 27061983 Zhang, C; Du, QY; Chen, LD; Wu, WH; Liao, SY; Yu, LH; Liang, XT Guangzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50165343 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50165343&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127047954 104050899 CHEMBL3797381 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50492738 Oc1ccc(cc1O)C(=O)OCC(=O)Nc1c2CCCCc2nc2ccccc12 InChI=1S/C22H20N2O5/c25-18-10-9-13(11-19(18)26)22(28)29-12-20(27)24-21-14-5-1-3-7-16(14)23-17-8-4-2-6-15(17)21/h1,3,5,7,9-11,25-26H,2,4,6,8,12H2,(H,23,24,27) HHLCROZHGUNHDB-UHFFFAOYSA-N 50165344 CHEMBL3800453 Cholinesterase 344 ChEMBL 10.1016/j.ejmech.2016.03.077 10.7270/Q2XK8HGC 27061983 Zhang, C; Du, QY; Chen, LD; Wu, WH; Liao, SY; Yu, LH; Liang, XT Guangzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50165344 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50165344&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127047955 104050900 CHEMBL3800453 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50492739 COc1ccc(\C=C\C(=O)OCC(=O)Nc2c3CCCCc3nc3ccccc23)cc1OC InChI=1S/C26H26N2O5/c1-31-22-13-11-17(15-23(22)32-2)12-14-25(30)33-16-24(29)28-26-18-7-3-5-9-20(18)27-21-10-6-4-8-19(21)26/h3,5,7,9,11-15H,4,6,8,10,16H2,1-2H3,(H,27,28,29)/b14-12+ ZETLFYVRVQQPJA-WYMLVPIESA-N 50165345 CHEMBL3800317 Cholinesterase 159 ChEMBL 10.1016/j.ejmech.2016.03.077 10.7270/Q2XK8HGC 27061983 Zhang, C; Du, QY; Chen, LD; Wu, WH; Liao, SY; Yu, LH; Liang, XT Guangzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50165345 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50165345&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127047956 104050901 CHEMBL3800317 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50492740 COc1cc(\C=C\C(=O)OCC(=O)Nc2c3CCCCc3nc3ccccc23)cc(OC)c1OC InChI=1S/C27H28N2O6/c1-32-22-14-17(15-23(33-2)27(22)34-3)12-13-25(31)35-16-24(30)29-26-18-8-4-6-10-20(18)28-21-11-7-5-9-19(21)26/h4,6,8,10,12-15H,5,7,9,11,16H2,1-3H3,(H,28,29,30)/b13-12+ MENQFHJNIXLXBP-OUKQBFOZSA-N 50165346 CHEMBL3799950 Cholinesterase 299 ChEMBL 10.1016/j.ejmech.2016.03.077 10.7270/Q2XK8HGC 27061983 Zhang, C; Du, QY; Chen, LD; Wu, WH; Liao, SY; Yu, LH; Liang, XT Guangzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50165346 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50165346&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search ZOL 4KFA,1ZW5,6G31,3N46,3N45,2Q58,3EZ3,4KQ5,2F8Z,3LDW,2E91,4P0V,4P0W,2F9K,3IBA,2F8C 127047722 104050902 46557 CHEMBL3799950 ZINC19632644 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50492741 COc1ccc(\C=C\C(=O)OCC(=O)Nc2c3CCCCc3nc3ccccc23)cc1O InChI=1S/C25H24N2O5/c1-31-22-12-10-16(14-21(22)28)11-13-24(30)32-15-23(29)27-25-17-6-2-4-8-19(17)26-20-9-5-3-7-18(20)25/h2,4,6,8,10-14,28H,3,5,7,9,15H2,1H3,(H,26,27,29)/b13-11+ PNEWAIXXVRKTND-ACCUITESSA-N 50165347 CHEMBL3798813 Cholinesterase 355 ChEMBL 10.1016/j.ejmech.2016.03.077 10.7270/Q2XK8HGC 27061983 Zhang, C; Du, QY; Chen, LD; Wu, WH; Liao, SY; Yu, LH; Liang, XT Guangzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50165347 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50165347&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127047832 341097653 CHEMBL3798813 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50492742 Clc1ccc(\C=C\C(=O)OCC(=O)Nc2c3CCCCc3nc3ccccc23)cc1 InChI=1S/C24H21ClN2O3/c25-17-12-9-16(10-13-17)11-14-23(29)30-15-22(28)27-24-18-5-1-3-7-20(18)26-21-8-4-2-6-19(21)24/h1,3,5,7,9-14H,2,4,6,8,15H2,(H,26,27,28)/b14-11+ NCFVPBIKQCXQSR-SDNWHVSQSA-N 50165354 CHEMBL3799175 Cholinesterase 542 ChEMBL 10.1016/j.ejmech.2016.03.077 10.7270/Q2XK8HGC 27061983 Zhang, C; Du, QY; Chen, LD; Wu, WH; Liao, SY; Yu, LH; Liang, XT Guangzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50165354 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50165354&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127047833 341097654 CHEMBL3799175 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50492743 O=C(COC(=O)Cc1c[nH]c2ccccc12)Nc1c2CCCCc2nc2ccccc12 InChI=1S/C25H23N3O3/c29-23(15-31-24(30)13-16-14-26-20-10-4-1-7-17(16)20)28-25-18-8-2-5-11-21(18)27-22-12-6-3-9-19(22)25/h1-2,4-5,7-8,10-11,14,26H,3,6,9,12-13,15H2,(H,27,28,29) IFSLBJMWVPZHLL-UHFFFAOYSA-N 50165358 CHEMBL3799641 Cholinesterase 292 ChEMBL 10.1016/j.ejmech.2016.03.077 10.7270/Q2XK8HGC 27061983 Zhang, C; Du, QY; Chen, LD; Wu, WH; Liao, SY; Yu, LH; Liang, XT Guangzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50165358 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50165358&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127047834 341097655 CHEMBL3799641 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50492744 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 14 ChEMBL 10.1016/j.ejmech.2016.03.077 10.7270/Q2XK8HGC 27061983 Zhang, C; Du, QY; Chen, LD; Wu, WH; Liao, SY; Yu, LH; Liang, XT Guangzhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488483 Oc1ccc2nc(ncc2c1)-c1ccccc1 InChI=1S/C14H10N2O/c17-12-6-7-13-11(8-12)9-15-14(16-13)10-4-2-1-3-5-10/h1-9,17H FBIFCFFECWRTPQ-UHFFFAOYSA-N 50160269 CHEMBL3787351 Cholinesterase 98100 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160269 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160269&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 20506492 340134700 CHEMBL3787351 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488484 CN1C(N(Cc2ccccc2)Cc2cc(O)ccc12)c1ccccc1 InChI=1S/C22H22N2O/c1-23-21-13-12-20(25)14-19(21)16-24(15-17-8-4-2-5-9-17)22(23)18-10-6-3-7-11-18/h2-14,22,25H,15-16H2,1H3 HLMXMLZTJSAWHE-UHFFFAOYSA-N 50160270 CHEMBL3786576 Cholinesterase 14800 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160270 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160270&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127031027 340134701 CHEMBL3786576 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488485 CCCN1Cc2cc(O)ccc2N(C)C1c1ccccc1 InChI=1S/C18H22N2O/c1-3-11-20-13-15-12-16(21)9-10-17(15)19(2)18(20)14-7-5-4-6-8-14/h4-10,12,18,21H,3,11,13H2,1-2H3 VLUQMRAVRAFVKP-UHFFFAOYSA-N 50160079 CHEMBL3786544 Cholinesterase 22800 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160079 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160079&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127031026 104046639 CHEMBL3786544 ZINC28127345 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488486 CC(C)N1Cc2cc(O)ccc2N(C)C1c1ccccc1 InChI=1S/C18H22N2O/c1-13(2)20-12-15-11-16(21)9-10-17(15)19(3)18(20)14-7-5-4-6-8-14/h4-11,13,18,21H,12H2,1-3H3 KRNZIDZPBRRUJF-UHFFFAOYSA-N 50160080 CHEMBL3787307 Cholinesterase 55800 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160080 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160080&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127031025 104046640 CHEMBL3787307 ZINC28333865 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488487 CN1Cc2cc(O)ccc2N(C)C1c1c(Cl)cccc1Cl InChI=1S/C16H16Cl2N2O/c1-19-9-10-8-11(21)6-7-14(10)20(2)16(19)15-12(17)4-3-5-13(15)18/h3-8,16,21H,9H2,1-2H3 BMOGOJGTAVLCMW-UHFFFAOYSA-N 50160081 CHEMBL3786666 Cholinesterase 7100 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160081 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160081&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127033012 104046641 CHEMBL3786666 ZINC28344803 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488488 CN1Cc2cc(O)ccc2N(C)C1c1ccc2ccccc2c1 InChI=1S/C20H20N2O/c1-21-13-17-12-18(23)9-10-19(17)22(2)20(21)16-8-7-14-5-3-4-6-15(14)11-16/h3-12,20,23H,13H2,1-2H3 XLIXDHIMVZFZLO-UHFFFAOYSA-N 50160271 CHEMBL3786390 Cholinesterase 16500 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160271 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160271&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127031024 340134702 CHEMBL3786390 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488489 CN1Cc2cc(O)ccc2N(C)C1c1cccc2ccccc12 InChI=1S/C20H20N2O/c1-21-13-15-12-16(23)10-11-19(15)22(2)20(21)18-9-5-7-14-6-3-4-8-17(14)18/h3-12,20,23H,13H2,1-2H3 VOBATKILOCMTNF-UHFFFAOYSA-N 50160082 CHEMBL3785481 Cholinesterase 2800 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160082 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160082&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127031023 104046642 CHEMBL3785481 ZINC28331555 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488490 CN1Cc2cc(O)ccc2N(C)C1c1cc[nH]c1 InChI=1S/C14H17N3O/c1-16-9-11-7-12(18)3-4-13(11)17(2)14(16)10-5-6-15-8-10/h3-8,14-15,18H,9H2,1-2H3 VCQQBALKFNTEFM-UHFFFAOYSA-N 50160083 CHEMBL3786655 Cholinesterase 15300 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160083 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160083&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127030955 104046643 CHEMBL3786655 ZINC28334008 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488491 CN1Cc2cc(O)ccc2N(C)C1c1ccoc1 InChI=1S/C14H16N2O2/c1-15-8-11-7-12(17)3-4-13(11)16(2)14(15)10-5-6-18-9-10/h3-7,9,14,17H,8H2,1-2H3 ILXKIHSZEQKNED-UHFFFAOYSA-N 50160084 CHEMBL3785526 Cholinesterase 196100 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160084 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160084&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127031022 104046644 CHEMBL3785526 ZINC28344070 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488492 CN1Cc2cc(O)ccc2N(C)C1c1cccs1 InChI=1S/C14H16N2OS/c1-15-9-10-8-11(17)5-6-12(10)16(2)14(15)13-4-3-7-18-13/h3-8,14,17H,9H2,1-2H3 DKTWWSUBNKHJLL-UHFFFAOYSA-N 50160085 CHEMBL3786843 Cholinesterase 63200 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160085 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160085&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127031021 104046645 CHEMBL3786843 ZINC28339513 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488494 CN1Cc2cc(O)ccc2N(C)C1c1ccsc1 InChI=1S/C14H16N2OS/c1-15-8-11-7-12(17)3-4-13(11)16(2)14(15)10-5-6-18-9-10/h3-7,9,14,17H,8H2,1-2H3 OWQWIYXGXCEIRI-UHFFFAOYSA-N 50160272 CHEMBL3785457 Cholinesterase 193700 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160272 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160272&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127031020 340134703 CHEMBL3785457 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488496 CN1Cc2cc(O)ccc2N(C)C1c1cccnc1 InChI=1S/C15H17N3O/c1-17-10-12-8-13(19)5-6-14(12)18(2)15(17)11-4-3-7-16-9-11/h3-9,15,19H,10H2,1-2H3 QNFZYGQNVRUCFO-UHFFFAOYSA-N 50160273 CHEMBL3785347 Cholinesterase 70700 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160273 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160273&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127031019 340134704 CHEMBL3785347 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488497 CN1Cc2cc(O)ccc2N(C)C1c1ccncc1 InChI=1S/C15H17N3O/c1-17-10-12-9-13(19)3-4-14(12)18(2)15(17)11-5-7-16-8-6-11/h3-9,15,19H,10H2,1-2H3 OVWJOMXHLUFNTI-UHFFFAOYSA-N 50160086 CHEMBL3786447 Cholinesterase 2100 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160086 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160086&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127030052 104046646 CHEMBL3786447 ZINC28344198 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488499 CN1Cc2cc(O)ccc2N(C)C1c1ccc(cc1)C(F)(F)F InChI=1S/C17H17F3N2O/c1-21-10-12-9-14(23)7-8-15(12)22(2)16(21)11-3-5-13(6-4-11)17(18,19)20/h3-9,16,23H,10H2,1-2H3 NHAMFIVNNIMRNF-UHFFFAOYSA-N 50160274 CHEMBL3787156 Cholinesterase 64600 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160274 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160274&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127031018 340134705 CHEMBL3787156 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488500 CN1Cc2cc(O)ccc2N(C)C1c1ccc(F)cc1 InChI=1S/C16H17FN2O/c1-18-10-12-9-14(20)7-8-15(12)19(2)16(18)11-3-5-13(17)6-4-11/h3-9,16,20H,10H2,1-2H3 JTWIQFYMXMWDSZ-UHFFFAOYSA-N 50160087 CHEMBL3787666 Cholinesterase 58900 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160087 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160087&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127031540 104046647 CHEMBL3787666 ZINC28343214 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488507 COc1ccccc1C1N(C)Cc2cc(O)ccc2N1C InChI=1S/C17H20N2O2/c1-18-11-12-10-13(20)8-9-15(12)19(2)17(18)14-6-4-5-7-16(14)21-3/h4-10,17,20H,11H2,1-3H3 VXFFOWOMDLBPGS-UHFFFAOYSA-N 50160088 CHEMBL3785229 Cholinesterase 9900 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160088 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160088&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127030969 104046648 CHEMBL3785229 ZINC28333858 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488508 COc1cccc(c1)C1N(C)Cc2cc(O)ccc2N1C InChI=1S/C17H20N2O2/c1-18-11-13-9-14(20)7-8-16(13)19(2)17(18)12-5-4-6-15(10-12)21-3/h4-10,17,20H,11H2,1-3H3 LZMLZSIFIQDHKO-UHFFFAOYSA-N 50160275 CHEMBL3785561 Cholinesterase 7800 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160275 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160275&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127033322 340134706 CHEMBL3785561 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488510 COc1ccc(cc1)C1N(C)Cc2cc(O)ccc2N1C InChI=1S/C17H20N2O2/c1-18-11-13-10-14(20)6-9-16(13)19(2)17(18)12-4-7-15(21-3)8-5-12/h4-10,17,20H,11H2,1-3H3 OSKRSHSETOXOBQ-UHFFFAOYSA-N 50160089 CHEMBL3785187 Cholinesterase 39500 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160089 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160089&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127031608 104046649 CHEMBL3785187 ZINC28336017 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488513 CN1Cc2cc(O)ccc2N(C)C1c1ccccc1C InChI=1S/C17H20N2O/c1-12-6-4-5-7-15(12)17-18(2)11-13-10-14(20)8-9-16(13)19(17)3/h4-10,17,20H,11H2,1-3H3 JGNPRRKHYQKBKS-UHFFFAOYSA-N 50160090 CHEMBL3785803 Cholinesterase 92400 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160090 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160090&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127031607 104046650 CHEMBL3785803 ZINC28334820 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488514 CN1Cc2cc(O)ccc2N(C)C1c1cccc(C)c1 InChI=1S/C17H20N2O/c1-12-5-4-6-13(9-12)17-18(2)11-14-10-15(20)7-8-16(14)19(17)3/h4-10,17,20H,11H2,1-3H3 HOZFLEKVZVRHEP-UHFFFAOYSA-N 50160091 CHEMBL3786323 Cholinesterase 17400 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160091 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160091&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127031606 104046651 CHEMBL3786323 ZINC28342525 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488515 CN1Cc2cc(O)ccc2N(C)C1c1ccc(C)cc1 InChI=1S/C17H20N2O/c1-12-4-6-13(7-5-12)17-18(2)11-14-10-15(20)8-9-16(14)19(17)3/h4-10,17,20H,11H2,1-3H3 JUFUSIPLWUVGNN-UHFFFAOYSA-N 50160139 CHEMBL3786589 Cholinesterase 22600 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160139 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160139&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127031605 104046699 CHEMBL3786589 ZINC28338072 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488517 CN1Cc2cc(O)ccc2N(C)C1c1ccccc1Cl InChI=1S/C16H17ClN2O/c1-18-10-11-9-12(20)7-8-15(11)19(2)16(18)13-5-3-4-6-14(13)17/h3-9,16,20H,10H2,1-2H3 HLNXLOICSZGEJY-UHFFFAOYSA-N 50160276 CHEMBL3786978 Cholinesterase 56000 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160276 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160276&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127030362 340134707 CHEMBL3786978 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488518 CN1Cc2cc(O)ccc2N(C)C1c1cccc(Cl)c1 InChI=1S/C16H17ClN2O/c1-18-10-12-9-14(20)6-7-15(12)19(2)16(18)11-4-3-5-13(17)8-11/h3-9,16,20H,10H2,1-2H3 SNZNPULZXJWTKB-UHFFFAOYSA-N 50160181 CHEMBL3786505 Cholinesterase 2100 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160181 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160181&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127031336 104046741 CHEMBL3786505 ZINC36351999 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488519 CN1Cc2cc(O)ccc2N(C)C1c1ccc(Cl)cc1 InChI=1S/C16H17ClN2O/c1-18-10-12-9-14(20)7-8-15(12)19(2)16(18)11-3-5-13(17)6-4-11/h3-9,16,20H,10H2,1-2H3 DAJRFRZOXZIRPD-UHFFFAOYSA-N 50160237 CHEMBL3785644 Cholinesterase 13800 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160237 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160237&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127031335 104046797 CHEMBL3785644 ZINC28341698 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50488520 CN1Cc2cc(O)ccc2N(C)C1c1ccccc1 InChI=1S/C16H18N2O/c1-17-11-13-10-14(19)8-9-15(13)18(2)16(17)12-6-4-3-5-7-12/h3-10,16,19H,11H2,1-2H3 LFEVRAXGBSBRNX-UHFFFAOYSA-N 50160244 CHEMBL3785808 Cholinesterase 39900 ChEMBL 10.1021/acs.jmedchem.5b01674 10.7270/Q25H7J4D 26886849 Sawatzky, E; Wehle, S; Kling, B; Wendrich, J; Bringmann, G; Sotriffer, CA; Heilmann, J; Decker, M Universit£t W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50160244 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50160244&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127031334 104046804 CHEMBL3785808 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50489684 COc1cccc(\C=C2/CCC\C(=C/c3cccc(OC)c3Cl)C2=O)c1Cl InChI=1S/C22H20Cl2O3/c1-26-18-10-4-6-14(20(18)23)12-16-8-3-9-17(22(16)25)13-15-7-5-11-19(27-2)21(15)24/h4-7,10-13H,3,8-9H2,1-2H3/b16-12+,17-13+ KAADRHVFDXKCJK-UNZYHPAISA-N 50161772 CHEMBL3786095 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2016.04.015 10.7270/Q2S46TVJ 27083471 Zha, GF; Zhang, CP; Qin, HL; Jantan, I; Sher, M; Amjad, MW; Hussain, MA; Hussain, Z; Bukhari, SN Wuhan University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50161772 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50161772&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127033968 104048077 CHEMBL3786095 ZINC06251171 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50489685 COc1ccc(\C=C2/CCC\C(=C/c3ccc(OC)c(OC)c3Cl)C2=O)c(Cl)c1OC InChI=1S/C24H24Cl2O5/c1-28-18-10-8-14(20(25)23(18)30-3)12-16-6-5-7-17(22(16)27)13-15-9-11-19(29-2)24(31-4)21(15)26/h8-13H,5-7H2,1-4H3/b16-12+,17-13+ XNNDFLRRBWKGOE-UNZYHPAISA-N 50161773 CHEMBL3786643 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2016.04.015 10.7270/Q2S46TVJ 27083471 Zha, GF; Zhang, CP; Qin, HL; Jantan, I; Sher, M; Amjad, MW; Hussain, MA; Hussain, Z; Bukhari, SN Wuhan University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50161773 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50161773&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127033969 104048078 CHEMBL3786643 ZINC13608971 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50489686 COc1cc(\C=C2/CCC\C(=C/c3cc(OC)c(OC)c(OC)c3Br)C2=O)c(Br)c(OC)c1OC InChI=1S/C26H28Br2O7/c1-30-18-12-16(20(27)25(34-5)23(18)32-3)10-14-8-7-9-15(22(14)29)11-17-13-19(31-2)24(33-4)26(35-6)21(17)28/h10-13H,7-9H2,1-6H3/b14-10+,15-11+ MPXOYYFJPSXBFR-WFYKWJGLSA-N 50161774 CHEMBL3785268 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2016.04.015 10.7270/Q2S46TVJ 27083471 Zha, GF; Zhang, CP; Qin, HL; Jantan, I; Sher, M; Amjad, MW; Hussain, MA; Hussain, Z; Bukhari, SN Wuhan University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50161774 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50161774&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127030667 104048079 CHEMBL3785268 ZINC13608954 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50489687 COc1cccc(\C=C2/CC(C)C\C(=C/c3cccc(OC)c3Cl)C2=O)c1Cl InChI=1S/C23H22Cl2O3/c1-14-10-17(12-15-6-4-8-19(27-2)21(15)24)23(26)18(11-14)13-16-7-5-9-20(28-3)22(16)25/h4-9,12-14H,10-11H2,1-3H3/b17-12+,18-13+ SQYVMMZDPPVSLB-PWDIZTEBSA-N 50161792 CHEMBL3786205 Cholinesterase 49700 ChEMBL 10.1016/j.bmc.2016.04.015 10.7270/Q2S46TVJ 27083471 Zha, GF; Zhang, CP; Qin, HL; Jantan, I; Sher, M; Amjad, MW; Hussain, MA; Hussain, Z; Bukhari, SN Wuhan University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50161792 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50161792&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127032398 104048097 CHEMBL3786205 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50489688 COc1ccc(\C=C2/CC(C)C\C(=C/c3ccc(OC)c(OC)c3Cl)C2=O)c(Cl)c1OC InChI=1S/C25H26Cl2O5/c1-14-10-17(12-15-6-8-19(29-2)24(31-4)21(15)26)23(28)18(11-14)13-16-7-9-20(30-3)25(32-5)22(16)27/h6-9,12-14H,10-11H2,1-5H3/b17-12+,18-13+ MYQYJVPPGPHKGO-PWDIZTEBSA-N 50161793 CHEMBL3785504 Cholinesterase 11200 ChEMBL 10.1016/j.bmc.2016.04.015 10.7270/Q2S46TVJ 27083471 Zha, GF; Zhang, CP; Qin, HL; Jantan, I; Sher, M; Amjad, MW; Hussain, MA; Hussain, Z; Bukhari, SN Wuhan University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50161793 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50161793&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127032817 104048098 CHEMBL3785504 ZINC13609288 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50489689 COc1cc(\C=C2/CC(C)C\C(=C/c3cc(OC)c(OC)c(OC)c3Br)C2=O)c(Br)c(OC)c1OC InChI=1S/C27H30Br2O7/c1-14-8-17(10-15-12-19(31-2)24(33-4)26(35-6)21(15)28)23(30)18(9-14)11-16-13-20(32-3)25(34-5)27(36-7)22(16)29/h10-14H,8-9H2,1-7H3/b17-10+,18-11+ HUOJMWSQPRYGFS-ODPUSEOTSA-N 50161794 CHEMBL3786129 Cholinesterase 19500 ChEMBL 10.1016/j.bmc.2016.04.015 10.7270/Q2S46TVJ 27083471 Zha, GF; Zhang, CP; Qin, HL; Jantan, I; Sher, M; Amjad, MW; Hussain, MA; Hussain, Z; Bukhari, SN Wuhan University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50161794 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50161794&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127033123 104048099 CHEMBL3786129 ZINC13609273 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50489690 COc1cccc(\C=C2/CC(C\C(=C/c3cccc(OC)c3Cl)C2=O)C(C)C)c1Cl InChI=1S/C25H26Cl2O3/c1-15(2)18-13-19(11-16-7-5-9-21(29-3)23(16)26)25(28)20(14-18)12-17-8-6-10-22(30-4)24(17)27/h5-12,15,18H,13-14H2,1-4H3/b19-11+,20-12+ XAGTXLCDOKWMSG-AYKLPDECSA-N 50161795 CHEMBL3787274 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2016.04.015 10.7270/Q2S46TVJ 27083471 Zha, GF; Zhang, CP; Qin, HL; Jantan, I; Sher, M; Amjad, MW; Hussain, MA; Hussain, Z; Bukhari, SN Wuhan University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50161795 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50161795&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127033124 104048100 CHEMBL3787274 ZINC13609233 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50489691 COc1ccc(\C=C2/CC(C\C(=C/c3ccc(OC)c(OC)c3Cl)C2=O)C(C)C)c(Cl)c1OC InChI=1S/C27H30Cl2O5/c1-15(2)18-13-19(11-16-7-9-21(31-3)26(33-5)23(16)28)25(30)20(14-18)12-17-8-10-22(32-4)27(34-6)24(17)29/h7-12,15,18H,13-14H2,1-6H3/b19-11+,20-12+ WVEFETMAQSNUPL-AYKLPDECSA-N 50161796 CHEMBL3787250 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2016.04.015 10.7270/Q2S46TVJ 27083471 Zha, GF; Zhang, CP; Qin, HL; Jantan, I; Sher, M; Amjad, MW; Hussain, MA; Hussain, Z; Bukhari, SN Wuhan University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50161796 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50161796&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127033125 104048101 CHEMBL3787250 ZINC13609261 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50489692 COc1cc(\C=C2/CC(C\C(=C/c3cc(OC)c(OC)c(OC)c3Br)C2=O)C(C)C)c(Br)c(OC)c1OC InChI=1S/C29H34Br2O7/c1-15(2)16-9-19(11-17-13-21(33-3)26(35-5)28(37-7)23(17)30)25(32)20(10-16)12-18-14-22(34-4)27(36-6)29(38-8)24(18)31/h11-16H,9-10H2,1-8H3/b19-11+,20-12+ NWAPNKNUYAVZOA-AYKLPDECSA-N 50161797 CHEMBL3785402 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2016.04.015 10.7270/Q2S46TVJ 27083471 Zha, GF; Zhang, CP; Qin, HL; Jantan, I; Sher, M; Amjad, MW; Hussain, MA; Hussain, Z; Bukhari, SN Wuhan University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50161797 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50161797&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127033126 104048102 CHEMBL3785402 ZINC13609269 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50489693 COc1cccc(\C=C2/CNC\C(=C/c3cccc(OC)c3Cl)C2=O)c1Cl InChI=1S/C21H19Cl2NO3/c1-26-17-7-3-5-13(19(17)22)9-15-11-24-12-16(21(15)25)10-14-6-4-8-18(27-2)20(14)23/h3-10,24H,11-12H2,1-2H3/b15-9+,16-10+ QNJVASMRVBPKFS-KAVGSWPWSA-N 50161798 CHEMBL3785522 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2016.04.015 10.7270/Q2S46TVJ 27083471 Zha, GF; Zhang, CP; Qin, HL; Jantan, I; Sher, M; Amjad, MW; Hussain, MA; Hussain, Z; Bukhari, SN Wuhan University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50161798 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50161798&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127033127 104048103 CHEMBL3785522 ZINC13609258 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50489694 COc1ccc(\C=C2/CNC\C(=C/c3ccc(OC)c(OC)c3Cl)C2=O)c(Cl)c1OC InChI=1S/C23H23Cl2NO5/c1-28-17-7-5-13(19(24)22(17)30-3)9-15-11-26-12-16(21(15)27)10-14-6-8-18(29-2)23(31-4)20(14)25/h5-10,26H,11-12H2,1-4H3/b15-9+,16-10+ ZPGLTKZQGIBQNR-KAVGSWPWSA-N 50161799 CHEMBL3787626 Cholinesterase 16700 ChEMBL 10.1016/j.bmc.2016.04.015 10.7270/Q2S46TVJ 27083471 Zha, GF; Zhang, CP; Qin, HL; Jantan, I; Sher, M; Amjad, MW; Hussain, MA; Hussain, Z; Bukhari, SN Wuhan University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50161799 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50161799&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127030363 104048104 CHEMBL3787626 ZINC03797383 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50489695 COc1cc(\C=C2/CNC\C(=C/c3cc(OC)c(OC)c(OC)c3Br)C2=O)c(Br)c(OC)c1OC InChI=1S/C25H27Br2NO7/c1-30-17-9-13(19(26)24(34-5)22(17)32-3)7-15-11-28-12-16(21(15)29)8-14-10-18(31-2)23(33-4)25(35-6)20(14)27/h7-10,28H,11-12H2,1-6H3/b15-7+,16-8+ YXTIQDJXBWVNDH-BGPOSVGRSA-N 50161800 CHEMBL3786742 Cholinesterase 68800 ChEMBL 10.1016/j.bmc.2016.04.015 10.7270/Q2S46TVJ 27083471 Zha, GF; Zhang, CP; Qin, HL; Jantan, I; Sher, M; Amjad, MW; Hussain, MA; Hussain, Z; Bukhari, SN Wuhan University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50161800 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50161800&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127032820 104048105 CHEMBL3786742 ZINC28119590 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50489696 COc1cccc(\C=C2/CN(C)C\C(=C/c3cccc(OC)c3Cl)C2=O)c1Cl InChI=1S/C22H21Cl2NO3/c1-25-12-16(10-14-6-4-8-18(27-2)20(14)23)22(26)17(13-25)11-15-7-5-9-19(28-3)21(15)24/h4-11H,12-13H2,1-3H3/b16-10+,17-11+ FPGQZYXKJYWXRA-OTYYAQKOSA-N 50161801 CHEMBL3787510 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2016.04.015 10.7270/Q2S46TVJ 27083471 Zha, GF; Zhang, CP; Qin, HL; Jantan, I; Sher, M; Amjad, MW; Hussain, MA; Hussain, Z; Bukhari, SN Wuhan University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50161801 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50161801&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127032821 104048106 CHEMBL3787510 ZINC13609218 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50489697 COc1ccc(\C=C2/CN(C)C\C(=C/c3ccc(OC)c(OC)c3Cl)C2=O)c(Cl)c1OC InChI=1S/C24H25Cl2NO5/c1-27-12-16(10-14-6-8-18(29-2)23(31-4)20(14)25)22(28)17(13-27)11-15-7-9-19(30-3)24(32-5)21(15)26/h6-11H,12-13H2,1-5H3/b16-10+,17-11+ MMSWIHVXABXVBG-OTYYAQKOSA-N 50161802 CHEMBL3787299 Cholinesterase 2900 ChEMBL 10.1016/j.bmc.2016.04.015 10.7270/Q2S46TVJ 27083471 Zha, GF; Zhang, CP; Qin, HL; Jantan, I; Sher, M; Amjad, MW; Hussain, MA; Hussain, Z; Bukhari, SN Wuhan University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50161802 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50161802&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127033160 104048107 CHEMBL3787299 ZINC13609240 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50489698 COc1cc(\C=C2/CN(C)C\C(=C/c3cc(OC)c(OC)c(OC)c3Br)C2=O)c(Br)c(OC)c1OC InChI=1S/C26H29Br2NO7/c1-29-12-16(8-14-10-18(31-2)23(33-4)25(35-6)20(14)27)22(30)17(13-29)9-15-11-19(32-3)24(34-5)26(36-7)21(15)28/h8-11H,12-13H2,1-7H3/b16-8+,17-9+ DODVFUPEXQCVGM-GONBZBRSSA-N 50161803 CHEMBL3785375 Cholinesterase 10500 ChEMBL 10.1016/j.bmc.2016.04.015 10.7270/Q2S46TVJ 27083471 Zha, GF; Zhang, CP; Qin, HL; Jantan, I; Sher, M; Amjad, MW; Hussain, MA; Hussain, Z; Bukhari, SN Wuhan University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50161803 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50161803&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127033161 104048108 CHEMBL3785375 ZINC13609237 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50489699 COc1cccc(\C=C2/CN(Cc3ccccc3)C\C(=C/c3cccc(OC)c3Cl)C2=O)c1Cl InChI=1S/C28H25Cl2NO3/c1-33-24-12-6-10-20(26(24)29)14-22-17-31(16-19-8-4-3-5-9-19)18-23(28(22)32)15-21-11-7-13-25(34-2)27(21)30/h3-15H,16-18H2,1-2H3/b22-14+,23-15+ YCVFDMDTLUWKEJ-HOFJZWJUSA-N 50161804 CHEMBL3786212 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2016.04.015 10.7270/Q2S46TVJ 27083471 Zha, GF; Zhang, CP; Qin, HL; Jantan, I; Sher, M; Amjad, MW; Hussain, MA; Hussain, Z; Bukhari, SN Wuhan University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50161804 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50161804&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127033323 104048109 CHEMBL3786212 ZINC01540415 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50489700 COc1ccc(\C=C2/CN(Cc3ccccc3)C\C(=C/c3ccc(OC)c(OC)c3Cl)C2=O)c(Cl)c1OC InChI=1S/C30H29Cl2NO5/c1-35-24-12-10-20(26(31)29(24)37-3)14-22-17-33(16-19-8-6-5-7-9-19)18-23(28(22)34)15-21-11-13-25(36-2)30(38-4)27(21)32/h5-15H,16-18H2,1-4H3/b22-14+,23-15+ LAEWLSNHUNUNGV-HOFJZWJUSA-N 50161805 CHEMBL3787471 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2016.04.015 10.7270/Q2S46TVJ 27083471 Zha, GF; Zhang, CP; Qin, HL; Jantan, I; Sher, M; Amjad, MW; Hussain, MA; Hussain, Z; Bukhari, SN Wuhan University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50161805 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50161805&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127033425 104048110 CHEMBL3787471 ZINC01890590 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50489701 COc1cc(\C=C2/CN(Cc3ccccc3)C\C(=C/c3cc(OC)c(OC)c(OC)c3Br)C2=O)c(Br)c(OC)c1OC InChI=1S/C32H33Br2NO7/c1-37-24-14-20(26(33)31(41-5)29(24)39-3)12-22-17-35(16-19-10-8-7-9-11-19)18-23(28(22)36)13-21-15-25(38-2)30(40-4)32(42-6)27(21)34/h7-15H,16-18H2,1-6H3/b22-12+,23-13+ WIHVLDMNJALTNU-FWSOMWAYSA-N 50161806 CHEMBL3786242 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2016.04.015 10.7270/Q2S46TVJ 27083471 Zha, GF; Zhang, CP; Qin, HL; Jantan, I; Sher, M; Amjad, MW; Hussain, MA; Hussain, Z; Bukhari, SN Wuhan University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50161806 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50161806&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127033426 104048111 CHEMBL3786242 ZINC13609230 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50489702 COc1cccc(\C=C2/COC\C(=C/c3cccc(OC)c3Cl)C2=O)c1Cl InChI=1S/C21H18Cl2O4/c1-25-17-7-3-5-13(19(17)22)9-15-11-27-12-16(21(15)24)10-14-6-4-8-18(26-2)20(14)23/h3-10H,11-12H2,1-2H3/b15-9+,16-10+ LCJPMSMQRPUMNO-KAVGSWPWSA-N 50161807 CHEMBL3786918 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2016.04.015 10.7270/Q2S46TVJ 27083471 Zha, GF; Zhang, CP; Qin, HL; Jantan, I; Sher, M; Amjad, MW; Hussain, MA; Hussain, Z; Bukhari, SN Wuhan University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50161807 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50161807&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127030361 104048112 CHEMBL3786918 ZINC13609280 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50489703 COc1ccc(\C=C2/COC\C(=C/c3ccc(OC)c(OC)c3Cl)C2=O)c(Cl)c1OC InChI=1S/C23H22Cl2O6/c1-27-17-7-5-13(19(24)22(17)29-3)9-15-11-31-12-16(21(15)26)10-14-6-8-18(28-2)23(30-4)20(14)25/h5-10H,11-12H2,1-4H3/b15-9+,16-10+ RFGLDPSNJSFBJC-KAVGSWPWSA-N 50161808 CHEMBL3785460 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2016.04.015 10.7270/Q2S46TVJ 27083471 Zha, GF; Zhang, CP; Qin, HL; Jantan, I; Sher, M; Amjad, MW; Hussain, MA; Hussain, Z; Bukhari, SN Wuhan University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50161808 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50161808&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127034535 104048113 CHEMBL3785460 ZINC02003495 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50489704 COc1cc(\C=C2/COC\C(=C/c3cc(OC)c(OC)c(OC)c3Br)C2=O)c(Br)c(OC)c1OC InChI=1S/C25H26Br2O8/c1-29-17-9-13(19(26)24(33-5)22(17)31-3)7-15-11-35-12-16(21(15)28)8-14-10-18(30-2)23(32-4)25(34-6)20(14)27/h7-10H,11-12H2,1-6H3/b15-7+,16-8+ KJPUOSJHTPMKNW-BGPOSVGRSA-N 50161809 CHEMBL3787119 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2016.04.015 10.7270/Q2S46TVJ 27083471 Zha, GF; Zhang, CP; Qin, HL; Jantan, I; Sher, M; Amjad, MW; Hussain, MA; Hussain, Z; Bukhari, SN Wuhan University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50161809 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50161809&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127034536 104048114 CHEMBL3787119 ZINC01890596 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50489705 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 6500 ChEMBL 10.1016/j.bmc.2016.04.015 10.7270/Q2S46TVJ 27083471 Zha, GF; Zhang, CP; Qin, HL; Jantan, I; Sher, M; Amjad, MW; Hussain, MA; Hussain, Z; Bukhari, SN Wuhan University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50489706 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 5.2 ChEMBL 10.1016/j.bmc.2016.04.015 10.7270/Q2S46TVJ 27083471 Zha, GF; Zhang, CP; Qin, HL; Jantan, I; Sher, M; Amjad, MW; Hussain, MA; Hussain, Z; Bukhari, SN Wuhan University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50508651 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 50 ChEMBL 10.1016/j.bmc.2016.07.025 10.7270/Q2DV1MV0 27460699 Wang, J; Wang, ZM; Li, XM; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50508652 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 3360 ChEMBL 10.1016/j.bmc.2016.07.025 10.7270/Q2DV1MV0 27460699 Wang, J; Wang, ZM; Li, XM; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50508653 O=C(CCc1c[nH]c2ccccc12)NCCC1CCN(Cc2ccccc2)CC1 InChI=1S/C25H31N3O/c29-25(11-10-22-18-27-24-9-5-4-8-23(22)24)26-15-12-20-13-16-28(17-14-20)19-21-6-2-1-3-7-21/h1-9,18,20,27H,10-17,19H2,(H,26,29) WXTKBXGKRLFVQP-UHFFFAOYSA-N 50187201 CHEMBL3824248 Cholinesterase 73 ChEMBL 10.1016/j.bmc.2016.07.025 10.7270/Q2DV1MV0 27460699 Wang, J; Wang, ZM; Li, XM; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187201 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187201&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11625278 346534712 CHEMBL3824248 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50508654 O=C(CCc1c[nH]c2ccccc12)NC1CCN(Cc2ccccc2)CC1 InChI=1S/C23H27N3O/c27-23(11-10-19-16-24-22-9-5-4-8-21(19)22)25-20-12-14-26(15-13-20)17-18-6-2-1-3-7-18/h1-9,16,20,24H,10-15,17H2,(H,25,27) PBCGIIRIOLOMJH-UHFFFAOYSA-N 50187200 CHEMBL3823197 Cholinesterase 370 ChEMBL 10.1016/j.bmc.2016.07.025 10.7270/Q2DV1MV0 27460699 Wang, J; Wang, ZM; Li, XM; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187200 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187200&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 4885038 346534711 CHEMBL3823197 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50508655 COc1ccc2[nH]cc(CCNC(=O)C3CCN(Cc4ccccc4[N+]([O-])=O)CC3)c2c1 InChI=1S/C24H28N4O4/c1-32-20-6-7-22-21(14-20)18(15-26-22)8-11-25-24(29)17-9-12-27(13-10-17)16-19-4-2-3-5-23(19)28(30)31/h2-7,14-15,17,26H,8-13,16H2,1H3,(H,25,29) ZMDMLFRVIBOLCC-UHFFFAOYSA-N 50187199 CHEMBL3823251 Cholinesterase 28500 ChEMBL 10.1016/j.bmc.2016.07.025 10.7270/Q2DV1MV0 27460699 Wang, J; Wang, ZM; Li, XM; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187199 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187199&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050859 346534710 CHEMBL3823251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50508656 [O-][N+](=O)c1ccccc1CN1CCC(CC1)C(=O)NCCc1c[nH]c2ccccc12 InChI=1S/C23H26N4O3/c28-23(24-12-9-18-15-25-21-7-3-2-6-20(18)21)17-10-13-26(14-11-17)16-19-5-1-4-8-22(19)27(29)30/h1-8,15,17,25H,9-14,16H2,(H,24,28) AOFKRLHLJQSQAU-UHFFFAOYSA-N 50187131 CHEMBL3822921 Cholinesterase 10800 ChEMBL 10.1016/j.bmc.2016.07.025 10.7270/Q2DV1MV0 27460699 Wang, J; Wang, ZM; Li, XM; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187131 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187131&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050858 104071148 CHEMBL3822921 ZINC34804710 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50508657 COc1ccc2[nH]cc(CCNC(=O)C3CCN(Cc4ccccc4C)CC3)c2c1 InChI=1S/C25H31N3O2/c1-18-5-3-4-6-21(18)17-28-13-10-19(11-14-28)25(29)26-12-9-20-16-27-24-8-7-22(30-2)15-23(20)24/h3-8,15-16,19,27H,9-14,17H2,1-2H3,(H,26,29) VITNUIFTUFCBDI-UHFFFAOYSA-N 50187130 CHEMBL3823578 Cholinesterase 3210 ChEMBL 10.1016/j.bmc.2016.07.025 10.7270/Q2DV1MV0 27460699 Wang, J; Wang, ZM; Li, XM; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187130 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187130&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127051624 104071147 CHEMBL3823578 ZINC34804704 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50508658 Cc1ccccc1CN1CCC(CC1)C(=O)NCCc1c[nH]c2ccccc12 InChI=1S/C24H29N3O/c1-18-6-2-3-7-21(18)17-27-14-11-19(12-15-27)24(28)25-13-10-20-16-26-23-9-5-4-8-22(20)23/h2-9,16,19,26H,10-15,17H2,1H3,(H,25,28) VQNHLBHTNLUGAW-UHFFFAOYSA-N 50187129 CHEMBL3822890 Cholinesterase 1500 ChEMBL 10.1016/j.bmc.2016.07.025 10.7270/Q2DV1MV0 27460699 Wang, J; Wang, ZM; Li, XM; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187129 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187129&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127051623 104071146 CHEMBL3822890 ZINC34804716 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50508659 COc1ccc2[nH]cc(CCNC(=O)C3CCN(Cc4ccccc4)CC3)c2c1 InChI=1S/C24H29N3O2/c1-29-21-7-8-23-22(15-21)20(16-26-23)9-12-25-24(28)19-10-13-27(14-11-19)17-18-5-3-2-4-6-18/h2-8,15-16,19,26H,9-14,17H2,1H3,(H,25,28) FYNDPJGSQYTAKR-UHFFFAOYSA-N 50187128 CHEMBL3824362 Cholinesterase 8210 ChEMBL 10.1016/j.bmc.2016.07.025 10.7270/Q2DV1MV0 27460699 Wang, J; Wang, ZM; Li, XM; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187128 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187128&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050845 104071145 CHEMBL3824362 ZINC34804708 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50508660 O=C(NCCc1c[nH]c2ccccc12)C1CCN(Cc2ccccc2)CC1 InChI=1S/C23H27N3O/c27-23(24-13-10-20-16-25-22-9-5-4-8-21(20)22)19-11-14-26(15-12-19)17-18-6-2-1-3-7-18/h1-9,16,19,25H,10-15,17H2,(H,24,27) QTSKGKRAUSQIQD-UHFFFAOYSA-N 50187127 CHEMBL3824057 Cholinesterase 3300 ChEMBL 10.1016/j.bmc.2016.07.025 10.7270/Q2DV1MV0 27460699 Wang, J; Wang, ZM; Li, XM; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187127 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187127&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5152006 104071144 CHEMBL3824057 ZINC34804713 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50508661 COc1ccc2[nH]cc(CCNC(=O)CC3CCN(Cc4ccc(Cl)cc4)CC3)c2c1 InChI=1S/C25H30ClN3O2/c1-31-22-6-7-24-23(15-22)20(16-28-24)8-11-27-25(30)14-18-9-12-29(13-10-18)17-19-2-4-21(26)5-3-19/h2-7,15-16,18,28H,8-14,17H2,1H3,(H,27,30) PQMNGGZQAQQCBO-UHFFFAOYSA-N 50187126 CHEMBL3824237 Cholinesterase 6480 ChEMBL 10.1016/j.bmc.2016.07.025 10.7270/Q2DV1MV0 27460699 Wang, J; Wang, ZM; Li, XM; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187126 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187126&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050844 104071143 CHEMBL3824237 ZINC34804719 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50508662 Clc1ccc(CN2CCC(CC(=O)NCCc3c[nH]c4ccccc34)CC2)cc1 InChI=1S/C24H28ClN3O/c25-21-7-5-19(6-8-21)17-28-13-10-18(11-14-28)15-24(29)26-12-9-20-16-27-23-4-2-1-3-22(20)23/h1-8,16,18,27H,9-15,17H2,(H,26,29) SEBOWRDZPAEFHP-UHFFFAOYSA-N 50187125 CHEMBL3823430 Cholinesterase 5290 ChEMBL 10.1016/j.bmc.2016.07.025 10.7270/Q2DV1MV0 27460699 Wang, J; Wang, ZM; Li, XM; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187125 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187125&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050843 346534709 CHEMBL3823430 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50508663 COc1ccc2[nH]cc(CCNC(=O)CC3CCN(Cc4cccc(Cl)c4)CC3)c2c1 InChI=1S/C25H30ClN3O2/c1-31-22-5-6-24-23(15-22)20(16-28-24)7-10-27-25(30)14-18-8-11-29(12-9-18)17-19-3-2-4-21(26)13-19/h2-6,13,15-16,18,28H,7-12,14,17H2,1H3,(H,27,30) ISXDWWZNJTUJSL-UHFFFAOYSA-N 50187124 CHEMBL3823191 Cholinesterase 4400 ChEMBL 10.1016/j.bmc.2016.07.025 10.7270/Q2DV1MV0 27460699 Wang, J; Wang, ZM; Li, XM; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187124 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187124&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050842 346534708 CHEMBL3823191 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50508664 Clc1cccc(CN2CCC(CC(=O)NCCc3c[nH]c4ccccc34)CC2)c1 InChI=1S/C24H28ClN3O/c25-21-5-3-4-19(14-21)17-28-12-9-18(10-13-28)15-24(29)26-11-8-20-16-27-23-7-2-1-6-22(20)23/h1-7,14,16,18,27H,8-13,15,17H2,(H,26,29) SVUDZLKUEMZXNW-UHFFFAOYSA-N 50187123 CHEMBL3823309 Cholinesterase 950 ChEMBL 10.1016/j.bmc.2016.07.025 10.7270/Q2DV1MV0 27460699 Wang, J; Wang, ZM; Li, XM; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187123 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187123&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127052937 346534707 CHEMBL3823309 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50508665 COc1ccc2[nH]cc(CCNC(=O)CC3CCN(Cc4ccccc4Cl)CC3)c2c1 InChI=1S/C25H30ClN3O2/c1-31-21-6-7-24-22(15-21)19(16-28-24)8-11-27-25(30)14-18-9-12-29(13-10-18)17-20-4-2-3-5-23(20)26/h2-7,15-16,18,28H,8-14,17H2,1H3,(H,27,30) KUZCIBBEDSNZAX-UHFFFAOYSA-N 50187122 CHEMBL3823598 Cholinesterase 1280 ChEMBL 10.1016/j.bmc.2016.07.025 10.7270/Q2DV1MV0 27460699 Wang, J; Wang, ZM; Li, XM; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187122 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187122&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127049128 346534706 CHEMBL3823598 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50508666 Clc1ccccc1CN1CCC(CC(=O)NCCc2c[nH]c3ccccc23)CC1 InChI=1S/C24H28ClN3O/c25-22-7-3-1-5-20(22)17-28-13-10-18(11-14-28)15-24(29)26-12-9-19-16-27-23-8-4-2-6-21(19)23/h1-8,16,18,27H,9-15,17H2,(H,26,29) PZQXXBORCKVRAX-UHFFFAOYSA-N 50187121 CHEMBL3823858 Cholinesterase 1490 ChEMBL 10.1016/j.bmc.2016.07.025 10.7270/Q2DV1MV0 27460699 Wang, J; Wang, ZM; Li, XM; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187121 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187121&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127049127 346534705 CHEMBL3823858 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50508667 COc1ccc2[nH]cc(CCNC(=O)CC3CCN(Cc4ccc(C)cc4)CC3)c2c1 InChI=1S/C26H33N3O2/c1-19-3-5-21(6-4-19)18-29-13-10-20(11-14-29)15-26(30)27-12-9-22-17-28-25-8-7-23(31-2)16-24(22)25/h3-8,16-17,20,28H,9-15,18H2,1-2H3,(H,27,30) CAKSHRZUNPHCQP-UHFFFAOYSA-N 50187120 CHEMBL3822790 Cholinesterase 1480 ChEMBL 10.1016/j.bmc.2016.07.025 10.7270/Q2DV1MV0 27460699 Wang, J; Wang, ZM; Li, XM; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187120 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187120&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127049126 346534704 CHEMBL3822790 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50508668 Cc1ccc(CN2CCC(CC(=O)NCCc3c[nH]c4ccccc34)CC2)cc1 InChI=1S/C25H31N3O/c1-19-6-8-21(9-7-19)18-28-14-11-20(12-15-28)16-25(29)26-13-10-22-17-27-24-5-3-2-4-23(22)24/h2-9,17,20,27H,10-16,18H2,1H3,(H,26,29) AIGIECZGNBILAQ-UHFFFAOYSA-N 50187119 CHEMBL3822670 Cholinesterase 1290 ChEMBL 10.1016/j.bmc.2016.07.025 10.7270/Q2DV1MV0 27460699 Wang, J; Wang, ZM; Li, XM; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187119 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187119&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127049125 346534703 CHEMBL3822670 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50508669 COc1ccc2[nH]cc(CCNC(=O)CC3CCN(Cc4cccc(C)c4)CC3)c2c1 InChI=1S/C26H33N3O2/c1-19-4-3-5-21(14-19)18-29-12-9-20(10-13-29)15-26(30)27-11-8-22-17-28-25-7-6-23(31-2)16-24(22)25/h3-7,14,16-17,20,28H,8-13,15,18H2,1-2H3,(H,27,30) NQRYVGBVQHMKOV-UHFFFAOYSA-N 50187202 CHEMBL3823538 Cholinesterase 4400 ChEMBL 10.1016/j.bmc.2016.07.025 10.7270/Q2DV1MV0 27460699 Wang, J; Wang, ZM; Li, XM; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187202 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187202&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127049124 346534713 CHEMBL3823538 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50508670 Cc1cccc(CN2CCC(CC(=O)NCCc3c[nH]c4ccccc34)CC2)c1 InChI=1S/C25H31N3O/c1-19-5-4-6-21(15-19)18-28-13-10-20(11-14-28)16-25(29)26-12-9-22-17-27-24-8-3-2-7-23(22)24/h2-8,15,17,20,27H,9-14,16,18H2,1H3,(H,26,29) QZHMJQWRHNORFP-UHFFFAOYSA-N 50187203 CHEMBL3823464 Cholinesterase 950 ChEMBL 10.1016/j.bmc.2016.07.025 10.7270/Q2DV1MV0 27460699 Wang, J; Wang, ZM; Li, XM; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187203 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187203&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127049123 346534714 CHEMBL3823464 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50508671 COc1ccc2[nH]cc(CCNC(=O)CC3CCN(Cc4ccccc4C)CC3)c2c1 InChI=1S/C26H33N3O2/c1-19-5-3-4-6-22(19)18-29-13-10-20(11-14-29)15-26(30)27-12-9-21-17-28-25-8-7-23(31-2)16-24(21)25/h3-8,16-17,20,28H,9-15,18H2,1-2H3,(H,27,30) YIQUNQOTSWAGGT-UHFFFAOYSA-N 50187204 CHEMBL3823317 Cholinesterase 1280 ChEMBL 10.1016/j.bmc.2016.07.025 10.7270/Q2DV1MV0 27460699 Wang, J; Wang, ZM; Li, XM; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187204 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187204&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050513 346534715 CHEMBL3823317 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50508672 Cc1ccccc1CN1CCC(CC(=O)NCCc2c[nH]c3ccccc23)CC1 InChI=1S/C25H31N3O/c1-19-6-2-3-7-22(19)18-28-14-11-20(12-15-28)16-25(29)26-13-10-21-17-27-24-9-5-4-8-23(21)24/h2-9,17,20,27H,10-16,18H2,1H3,(H,26,29) LZDWBBQKRMLWKK-UHFFFAOYSA-N 50187205 CHEMBL3824239 Cholinesterase 1490 ChEMBL 10.1016/j.bmc.2016.07.025 10.7270/Q2DV1MV0 27460699 Wang, J; Wang, ZM; Li, XM; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187205 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187205&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050512 346534716 CHEMBL3824239 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50508673 O=C(CC1CCN(Cc2ccccc2)CC1)NCCc1c[nH]c2ccccc12 InChI=1S/C24H29N3O/c28-24(25-13-10-21-17-26-23-9-5-4-8-22(21)23)16-19-11-14-27(15-12-19)18-20-6-2-1-3-7-20/h1-9,17,19,26H,10-16,18H2,(H,25,28) PDZMHDSORBHDFP-UHFFFAOYSA-N 50187206 CHEMBL3822559 Cholinesterase 1100 ChEMBL 10.1016/j.bmc.2016.07.025 10.7270/Q2DV1MV0 27460699 Wang, J; Wang, ZM; Li, XM; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187206 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187206&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050511 346534717 CHEMBL3822559 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50510879 COc1cc2CCN[C@H]3Cc4cc5OCOc5cc4-c(c1OC)c23 InChI=1S/C19H19NO4/c1-21-16-6-10-3-4-20-13-5-11-7-14-15(24-9-23-14)8-12(11)18(17(10)13)19(16)22-2/h6-8,13,20H,3-5,9H2,1-2H3/t13-/m0/s1 JWXKBCGJLCEZTJ-ZDUSSCGKSA-N 50187679 CHEMBL3827872 Cholinesterase 94450 ChEMBL 10.1016/j.bmc.2016.07.043 10.7270/Q2MG7RFM 27492195 Wan Othman, WNN; Liew, SY; Khaw, KY; Murugaiyah, V; Litaudon, M; Awang, K University of Malaya http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187679 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187679&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14395308 346534867 CHEMBL3827872 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50510880 COc1ccc(cc1OC)C1=C(CN2CCC[C@@H]2C1)c1ccc(O)cc1 InChI=1S/C22H25NO3/c1-25-21-10-7-16(12-22(21)26-2)19-13-17-4-3-11-23(17)14-20(19)15-5-8-18(24)9-6-15/h5-10,12,17,24H,3-4,11,13-14H2,1-2H3/t17-/m1/s1 JOMCLUGDXHCAGV-QGZVFWFLSA-N 50187680 CHEMBL483227 Cholinesterase 166690 ChEMBL 10.1016/j.bmc.2016.07.043 10.7270/Q2MG7RFM 27492195 Wan Othman, WNN; Liew, SY; Khaw, KY; Murugaiyah, V; Litaudon, M; Awang, K University of Malaya http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187680 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187680&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11783104 346534868 CHEMBL483227 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50510881 COc1cc2CCNC3CC4(CCC(O)CC4)c(c23)c1O InChI=1S/C17H23NO3/c1-21-13-8-10-4-7-18-12-9-17(5-2-11(19)3-6-17)15(14(10)12)16(13)20/h8,11-12,18-20H,2-7,9H2,1H3 PPRCPJNOUHNSOE-UHFFFAOYSA-N 50187682 CHEMBL3827670 Cholinesterase 288340 ChEMBL 10.1016/j.bmc.2016.07.043 10.7270/Q2MG7RFM 27492195 Wan Othman, WNN; Liew, SY; Khaw, KY; Murugaiyah, V; Litaudon, M; Awang, K University of Malaya http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 74178442 346534870 CHEMBL3827670 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50510882 COc1cc(CCN(C)C)c2ccc3ccccc3c2c1OC InChI=1S/C20H23NO2/c1-21(2)12-11-15-13-18(22-3)20(23-4)19-16-8-6-5-7-14(16)9-10-17(15)19/h5-10,13H,11-12H2,1-4H3 UZZFAUDNCIFFPM-UHFFFAOYSA-N 50187683 CHEMBL1186488 Cholinesterase 19340 ChEMBL 10.1016/j.bmc.2016.07.043 10.7270/Q2MG7RFM 27492195 Wan Othman, WNN; Liew, SY; Khaw, KY; Murugaiyah, V; Litaudon, M; Awang, K University of Malaya http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187683 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187683&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 96918 346534871 CHEMBL1186488 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50510883 COc1cc-2c(C[C@@H]3N(C)CCc4cc(OC)c(OC)c-2c34)cc1O InChI=1S/C20H23NO4/c1-21-6-5-11-9-17(24-3)20(25-4)19-13-10-16(23-2)15(22)8-12(13)7-14(21)18(11)19/h8-10,14,22H,5-7H2,1-4H3/t14-/m0/s1 ZFLRVRLYWHNAEC-AWEZNQCLSA-N 50250422 (+)-N-methyl-laurotetanine::CHEMBL464099::N-methyllaurotetanine Cholinesterase 218810 ChEMBL 10.1016/j.bmc.2016.07.043 10.7270/Q2MG7RFM 27492195 Wan Othman, WNN; Liew, SY; Khaw, KY; Murugaiyah, V; Litaudon, M; Awang, K University of Malaya http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50250422 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50250422&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 16573 104104200 CHEMBL464099 ZINC00338123 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50510884 COc1c(OC)c(OC)c2c(ccc3ccccc23)c1CCN(C)C InChI=1S/C21H25NO3/c1-22(2)13-12-17-16-11-10-14-8-6-7-9-15(14)18(16)20(24-4)21(25-5)19(17)23-3/h6-11H,12-13H2,1-5H3 CCVOLLCITTYDJG-UHFFFAOYSA-N 50187684 CHEMBL3827910 Cholinesterase 3950 ChEMBL 10.1016/j.bmc.2016.07.043 10.7270/Q2MG7RFM 27492195 Wan Othman, WNN; Liew, SY; Khaw, KY; Murugaiyah, V; Litaudon, M; Awang, K University of Malaya http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187684 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187684&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 261479 346534872 CHEMBL3827910 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50510885 COc1ccc(C[C@@H]2N(C)CCc3cc(OC)c(O)cc23)cc1O InChI=1S/C19H23NO4/c1-20-7-6-13-10-19(24-3)17(22)11-14(13)15(20)8-12-4-5-18(23-2)16(21)9-12/h4-5,9-11,15,21-22H,6-8H2,1-3H3/t15-/m0/s1 BHLYRWXGMIUIHG-HNNXBMFYSA-N 50187681 (+)-Reticuline::(S)-Reticuline::CHEBI:16718::L-(+)-Reticuline::Reticuline::S-Reticuline Cholinesterase 65040 ChEMBL 10.1016/j.bmc.2016.07.043 10.7270/Q2MG7RFM 27492195 Wan Othman, WNN; Liew, SY; Khaw, KY; Murugaiyah, V; Litaudon, M; Awang, K University of Malaya http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187681 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187681&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search REN 4EC3,3D2D,3FWA 439653 346534869 C02105 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50510886 CNC(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1 InChI=1S/C15H21N3O2/c1-15-7-8-17(3)13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2/h5-6,9,13H,7-8H2,1-4H3,(H,16,19)/t13-,15+/m1/s1 PIJVFDBKTWXHHD-HIFRSBDPSA-N 50004000 (3aS,8aR)-1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol-5-yl methylcarbamate::Antilirium::CHEMBL94::Eserine::Physostol::physostigmine Cholinesterase 580 ChEMBL 10.1016/j.bmc.2016.07.043 10.7270/Q2MG7RFM 27492195 Wan Othman, WNN; Liew, SY; Khaw, KY; Murugaiyah, V; Litaudon, M; Awang, K University of Malaya http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50004000 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50004000&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5983 103917788 27953 CHEMBL94 DB00981 6598 C06535 ZINC33971762 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50510887 COc1c(OC)c(OC)c2c(ccc3ccccc23)c1CCN(C)C InChI=1S/C21H25NO3/c1-22(2)13-12-17-16-11-10-14-8-6-7-9-15(14)18(16)20(24-4)21(25-5)19(17)23-3/h6-11H,12-13H2,1-5H3 CCVOLLCITTYDJG-UHFFFAOYSA-N 50187684 CHEMBL3827910 Cholinesterase 6720 ChEMBL 10.1016/j.bmc.2016.07.043 10.7270/Q2MG7RFM 27492195 Wan Othman, WNN; Liew, SY; Khaw, KY; Murugaiyah, V; Litaudon, M; Awang, K University of Malaya http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187684 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187684&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 261479 346534872 CHEMBL3827910 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50503476 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 3360 ChEMBL 10.1016/j.bmc.2016.06.027 10.7270/Q24Q7WXM 27353888 Mishra, CB; Manral, A; Kumari, S; Saini, V; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50503477 O=C1C(=Cc2ccc(cc2)N2CCN(CC2)c2ncccn2)C(=O)c2ccccc12 InChI=1S/C24H20N4O2/c29-22-19-4-1-2-5-20(19)23(30)21(22)16-17-6-8-18(9-7-17)27-12-14-28(15-13-27)24-25-10-3-11-26-24/h1-11,16H,12-15H2 BALUHLXDWKRXCC-UHFFFAOYSA-N 50183044 CHEMBL3818053 Cholinesterase 2778 ChEMBL 10.1016/j.bmc.2016.06.027 10.7270/Q24Q7WXM 27353888 Mishra, CB; Manral, A; Kumari, S; Saini, V; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50183044 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50183044&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127048771 346550192 CHEMBL3818053 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50503478 O=C1C(=Cc2ccc(cc2)N2CCN(CC2)c2ccccn2)C(=O)c2ccccc12 InChI=1S/C25H21N3O2/c29-24-20-5-1-2-6-21(20)25(30)22(24)17-18-8-10-19(11-9-18)27-13-15-28(16-14-27)23-7-3-4-12-26-23/h1-12,17H,13-16H2 KATSAUONYMCTIF-UHFFFAOYSA-N 50183046 CHEMBL3817925 Cholinesterase 880 ChEMBL 10.1016/j.bmc.2016.06.027 10.7270/Q24Q7WXM 27353888 Mishra, CB; Manral, A; Kumari, S; Saini, V; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50183046 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50183046&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050946 346550193 CHEMBL3817925 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50503479 O=C1C(=Cc2ccc(cc2)N2CCN(Cc3ccc4OCOc4c3)CC2)C(=O)c2ccccc12 InChI=1S/C28H24N2O4/c31-27-22-3-1-2-4-23(22)28(32)24(27)15-19-5-8-21(9-6-19)30-13-11-29(12-14-30)17-20-7-10-25-26(16-20)34-18-33-25/h1-10,15-16H,11-14,17-18H2 RQSFKRZXBDSWEE-UHFFFAOYSA-N 50183047 CHEMBL3819248 Cholinesterase 4249 ChEMBL 10.1016/j.bmc.2016.06.027 10.7270/Q24Q7WXM 27353888 Mishra, CB; Manral, A; Kumari, S; Saini, V; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50183047 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50183047&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050662 346550194 CHEMBL3819248 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50503480 O=C1C(=Cc2ccc(cc2)N2CCN(CC2)C(c2ccccc2)c2ccccc2)C(=O)c2ccccc12 InChI=1S/C33H28N2O2/c36-32-28-13-7-8-14-29(28)33(37)30(32)23-24-15-17-27(18-16-24)34-19-21-35(22-20-34)31(25-9-3-1-4-10-25)26-11-5-2-6-12-26/h1-18,23,31H,19-22H2 VGNZCNSIYXPDGN-UHFFFAOYSA-N 50183043 CHEMBL3819454 Cholinesterase 3352 ChEMBL 10.1016/j.bmc.2016.06.027 10.7270/Q24Q7WXM 27353888 Mishra, CB; Manral, A; Kumari, S; Saini, V; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50183043 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50183043&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050661 346550191 CHEMBL3819454 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50503481 O=C(N1CCN(CC1)c1ccc(C=C2C(=O)c3ccccc3C2=O)cc1)c1ccco1 InChI=1S/C25H20N2O4/c28-23-19-4-1-2-5-20(19)24(29)21(23)16-17-7-9-18(10-8-17)26-11-13-27(14-12-26)25(30)22-6-3-15-31-22/h1-10,15-16H,11-14H2 UXNNBWHSRNIPJN-UHFFFAOYSA-N 50183042 CHEMBL3818600 Cholinesterase 2605 ChEMBL 10.1016/j.bmc.2016.06.027 10.7270/Q24Q7WXM 27353888 Mishra, CB; Manral, A; Kumari, S; Saini, V; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50183042 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50183042&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050660 346550190 CHEMBL3818600 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50503482 O=C(N1CCN(CC1)c1ccc(C=C2C(=O)c3ccccc3C2=O)cc1)c1ccccc1 InChI=1S/C27H22N2O3/c30-25-22-8-4-5-9-23(22)26(31)24(25)18-19-10-12-21(13-11-19)28-14-16-29(17-15-28)27(32)20-6-2-1-3-7-20/h1-13,18H,14-17H2 GNGMUNQVTZBDMB-UHFFFAOYSA-N 50183048 CHEMBL3818091 Cholinesterase 13370 ChEMBL 10.1016/j.bmc.2016.06.027 10.7270/Q24Q7WXM 27353888 Mishra, CB; Manral, A; Kumari, S; Saini, V; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50183048 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50183048&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050659 346550195 CHEMBL3818091 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50503483 Cc1ccc(N2CCN(CC2)c2ccc(C=C3C(=O)c4ccccc4C3=O)cc2)c(C)c1 InChI=1S/C28H26N2O2/c1-19-7-12-26(20(2)17-19)30-15-13-29(14-16-30)22-10-8-21(9-11-22)18-25-27(31)23-5-3-4-6-24(23)28(25)32/h3-12,17-18H,13-16H2,1-2H3 PQFNFRSEXIYWLB-UHFFFAOYSA-N 50183049 CHEMBL3819593 Cholinesterase 415 ChEMBL 10.1016/j.bmc.2016.06.027 10.7270/Q24Q7WXM 27353888 Mishra, CB; Manral, A; Kumari, S; Saini, V; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50183049 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50183049&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050344 346550196 CHEMBL3819593 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50503484 Cc1ccc(cc1)N1CCN(CC1)c1ccc(C=C2C(=O)c3ccccc3C2=O)cc1 InChI=1S/C27H24N2O2/c1-19-6-10-21(11-7-19)28-14-16-29(17-15-28)22-12-8-20(9-13-22)18-25-26(30)23-4-2-3-5-24(23)27(25)31/h2-13,18H,14-17H2,1H3 IAJXDQINNGAKBZ-UHFFFAOYSA-N 50183050 CHEMBL3818518 Cholinesterase 392 ChEMBL 10.1016/j.bmc.2016.06.027 10.7270/Q24Q7WXM 27353888 Mishra, CB; Manral, A; Kumari, S; Saini, V; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50183050 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50183050&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050343 346550197 CHEMBL3818518 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50503485 Clc1ccc(cc1)N1CCN(CC1)c1ccc(C=C2C(=O)c3ccccc3C2=O)cc1 InChI=1S/C26H21ClN2O2/c27-19-7-11-21(12-8-19)29-15-13-28(14-16-29)20-9-5-18(6-10-20)17-24-25(30)22-3-1-2-4-23(22)26(24)31/h1-12,17H,13-16H2 GPYAHJUSGKQNLP-UHFFFAOYSA-N 50183051 CHEMBL3819042 Cholinesterase 1109 ChEMBL 10.1016/j.bmc.2016.06.027 10.7270/Q24Q7WXM 27353888 Mishra, CB; Manral, A; Kumari, S; Saini, V; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50183051 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50183051&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050655 346550198 CHEMBL3819042 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50503486 FC(F)(F)c1ccc(cc1)N1CCN(CC1)c1ccc(C=C2C(=O)c3ccccc3C2=O)cc1 InChI=1S/C27H21F3N2O2/c28-27(29,30)19-7-11-21(12-8-19)32-15-13-31(14-16-32)20-9-5-18(6-10-20)17-24-25(33)22-3-1-2-4-23(22)26(24)34/h1-12,17H,13-16H2 IBZZAQSQRCIFKW-UHFFFAOYSA-N 50183052 CHEMBL3819316 Cholinesterase 2137 ChEMBL 10.1016/j.bmc.2016.06.027 10.7270/Q24Q7WXM 27353888 Mishra, CB; Manral, A; Kumari, S; Saini, V; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50183052 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50183052&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050654 346550199 CHEMBL3819316 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50503487 Fc1ccc(cc1)N1CCN(CC1)c1ccc(C=C2C(=O)c3ccccc3C2=O)cc1 InChI=1S/C26H21FN2O2/c27-19-7-11-21(12-8-19)29-15-13-28(14-16-29)20-9-5-18(6-10-20)17-24-25(30)22-3-1-2-4-23(22)26(24)31/h1-12,17H,13-16H2 XUJJBMZPMLNONI-UHFFFAOYSA-N 50183053 CHEMBL3819571 Cholinesterase 5134 ChEMBL 10.1016/j.bmc.2016.06.027 10.7270/Q24Q7WXM 27353888 Mishra, CB; Manral, A; Kumari, S; Saini, V; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50183053 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50183053&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050653 346550200 CHEMBL3819571 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50503488 O=C1C(=Cc2ccc(cc2)N2CCN(CC2)c2ccccc2)C(=O)c2ccccc12 InChI=1S/C26H22N2O2/c29-25-22-8-4-5-9-23(22)26(30)24(25)18-19-10-12-21(13-11-19)28-16-14-27(15-17-28)20-6-2-1-3-7-20/h1-13,18H,14-17H2 XFUAIDJRQHJHQZ-UHFFFAOYSA-N 50183054 CHEMBL3818978 Cholinesterase 4660 ChEMBL 10.1016/j.bmc.2016.06.027 10.7270/Q24Q7WXM 27353888 Mishra, CB; Manral, A; Kumari, S; Saini, V; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50183054 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50183054&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127049701 346550201 CHEMBL3818978 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502576 COc1cc2C(=O)\C(Cc2cc1O)=C\C1CCN(Cc2ccccc2)CC1 InChI=1S/C23H25NO3/c1-27-22-14-20-18(13-21(22)25)12-19(23(20)26)11-16-7-9-24(10-8-16)15-17-5-3-2-4-6-17/h2-6,11,13-14,16,25H,7-10,12,15H2,1H3/b19-11+ ZEAXIVSYMLISJH-YBFXNURJSA-N 50182433 CHEMBL3819155 Cholinesterase 10611 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182433 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182433&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050028 346550044 CHEMBL3819155 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502577 Oc1ccc2C\C(=C/C3CCN(Cc4ccccc4)CC3)C(=O)c2c1 InChI=1S/C22H23NO2/c24-20-7-6-18-13-19(22(25)21(18)14-20)12-16-8-10-23(11-9-16)15-17-4-2-1-3-5-17/h1-7,12,14,16,24H,8-11,13,15H2/b19-12+ BXAOZDHJHXGRFU-XDHOZWIPSA-N 50182434 CHEMBL3818230 Cholinesterase 5613 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182434 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182434&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050029 346550045 CHEMBL3818230 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502578 COc1ccc2C(=O)\C(Cc2c1)=C\C1CCN(Cc2ccccc2)CC1 InChI=1S/C23H25NO2/c1-26-21-7-8-22-19(15-21)14-20(23(22)25)13-17-9-11-24(12-10-17)16-18-5-3-2-4-6-18/h2-8,13,15,17H,9-12,14,16H2,1H3/b20-13+ CNIWTTNRVIMZIP-DEDYPNTBSA-N 50182435 CHEMBL3818084 Cholinesterase 3140 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182435 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182435&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search DZ0 5NAU 10521609 346550046 CHEMBL3818084 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502579 O=C1\C(Cc2cc3OCOc3cc12)=C\C1CCN(Cc2ccccc2)CC1 InChI=1S/C23H23NO3/c25-23-19(11-18-12-21-22(13-20(18)23)27-15-26-21)10-16-6-8-24(9-7-16)14-17-4-2-1-3-5-17/h1-5,10,12-13,16H,6-9,11,14-15H2/b19-10+ VXQFGUJASGKRMS-VXLYETTFSA-N 50182436 CHEMBL3818801 Cholinesterase 7254 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182436 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182436&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14553581 346550047 CHEMBL3818801 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502580 COc1ccc2C(=O)\C(Cc2c1)=C\C1CCN(Cc2cccc(OC)c2)CC1 InChI=1S/C24H27NO3/c1-27-21-5-3-4-18(13-21)16-25-10-8-17(9-11-25)12-20-14-19-15-22(28-2)6-7-23(19)24(20)26/h3-7,12-13,15,17H,8-11,14,16H2,1-2H3/b20-12+ JATSNZSQYDITNU-UDWIEESQSA-N 50182437 CHEMBL3819531 Cholinesterase 3490 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182437 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182437&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127049377 346550048 CHEMBL3819531 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502581 COc1ccc2C\C(=C/C3CCN(Cc4cccc(OC)c4)CC3)C(=O)c2c1 InChI=1S/C24H27NO3/c1-27-21-5-3-4-18(13-21)16-25-10-8-17(9-11-25)12-20-14-19-6-7-22(28-2)15-23(19)24(20)26/h3-7,12-13,15,17H,8-11,14,16H2,1-2H3/b20-12+ VRHAQRBXZOTBMX-UDWIEESQSA-N 50182438 CHEMBL3819113 Cholinesterase 3888 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182438 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182438&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127049378 346550049 CHEMBL3819113 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502582 COc1cccc(CN2CCC(CC2)\C=C2/Cc3cccc(OC)c3C2=O)c1 InChI=1S/C24H27NO3/c1-27-21-7-3-5-18(14-21)16-25-11-9-17(10-12-25)13-20-15-19-6-4-8-22(28-2)23(19)24(20)26/h3-8,13-14,17H,9-12,15-16H2,1-2H3/b20-13+ GJQQDXQGUWSLSC-DEDYPNTBSA-N 50182439 CHEMBL3819574 Cholinesterase 2378 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182439 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182439&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127048735 346550050 CHEMBL3819574 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502583 COc1ccc2C\C(=C/C3CCN(Cc4ccc5OCOc5c4)CC3)C(=O)c2c1 InChI=1S/C24H25NO4/c1-27-20-4-3-18-12-19(24(26)21(18)13-20)10-16-6-8-25(9-7-16)14-17-2-5-22-23(11-17)29-15-28-22/h2-5,10-11,13,16H,6-9,12,14-15H2,1H3/b19-10+ SSNKBYPYCIBWEY-VXLYETTFSA-N 50182440 CHEMBL3819247 Cholinesterase 4328 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182440 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182440&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127048388 346550051 CHEMBL3819247 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502584 COc1cccc2C\C(=C/C3CCN(Cc4ccc5OCOc5c4)CC3)C(=O)c12 InChI=1S/C24H25NO4/c1-27-21-4-2-3-18-13-19(24(26)23(18)21)11-16-7-9-25(10-8-16)14-17-5-6-20-22(12-17)29-15-28-20/h2-6,11-12,16H,7-10,13-15H2,1H3/b19-11+ SVXQNAFUZDCNTM-YBFXNURJSA-N 50182441 CHEMBL3818918 Cholinesterase 6437 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182441 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182441&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127048389 346550052 CHEMBL3818918 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502607 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 1270 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502608 COc1cc2C\C(=C/C3CCN(Cc4ccccc4)CC3)C(=O)c2cc1O InChI=1S/C23H25NO3/c1-27-22-13-18-12-19(23(26)20(18)14-21(22)25)11-16-7-9-24(10-8-16)15-17-5-3-2-4-6-17/h2-6,11,13-14,16,25H,7-10,12,15H2,1H3/b19-11+ LQKGQMXOOLGDAM-YBFXNURJSA-N 50182444 CHEMBL3818415 Cholinesterase 7350 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182444 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182444&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14553576 346550055 CHEMBL3818415 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502609 COc1cc2C(=O)\C(Cc2cc1O)=C\C1CCN(Cc2ccccc2)CC1 InChI=1S/C23H25NO3/c1-27-22-14-20-18(13-21(22)25)12-19(23(20)26)11-16-7-9-24(10-8-16)15-17-5-3-2-4-6-17/h2-6,11,13-14,16,25H,7-10,12,15H2,1H3/b19-11+ ZEAXIVSYMLISJH-YBFXNURJSA-N 50182433 CHEMBL3819155 Cholinesterase 7350 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182433 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182433&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050028 346550044 CHEMBL3819155 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502610 Oc1ccc2C\C(=C/C3CCN(Cc4ccccc4)CC3)C(=O)c2c1 InChI=1S/C22H23NO2/c24-20-7-6-18-13-19(22(25)21(18)14-20)12-16-8-10-23(11-9-16)15-17-4-2-1-3-5-17/h1-7,12,14,16,24H,8-11,13,15H2/b19-12+ BXAOZDHJHXGRFU-XDHOZWIPSA-N 50182434 CHEMBL3818230 Cholinesterase 5800 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182434 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182434&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050029 346550045 CHEMBL3818230 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502611 Oc1cccc2C\C(=C/C3CCN(Cc4ccccc4)CC3)C(=O)c12 InChI=1S/C22H23NO2/c24-20-8-4-7-18-14-19(22(25)21(18)20)13-16-9-11-23(12-10-16)15-17-5-2-1-3-6-17/h1-8,13,16,24H,9-12,14-15H2/b19-13+ RLSKFCOIMMXSLS-CPNJWEJPSA-N 50182442 CHEMBL3818616 Cholinesterase 4760 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182442 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182442&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050318 346550053 CHEMBL3818616 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502612 Oc1ccc2C(=O)\C(Cc2c1)=C\C1CCN(Cc2ccccc2)CC1 InChI=1S/C22H23NO2/c24-20-6-7-21-18(14-20)13-19(22(21)25)12-16-8-10-23(11-9-16)15-17-4-2-1-3-5-17/h1-7,12,14,16,24H,8-11,13,15H2/b19-12+ PIJDCHBRSITJLS-XDHOZWIPSA-N 50182443 CHEMBL3819646 Cholinesterase 7590 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182443 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182443&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050319 346550054 CHEMBL3819646 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502613 COc1cc2C\C(=C/C3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H27NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,12,14-15,17H,8-11,13,16H2,1-2H3/b20-12+ LPMOTUSFDTTWJL-UDWIEESQSA-N 50280646 2-[1-(1-Benzyl-piperidin-4-yl)-meth-(E)-ylidene]-5,6-dimethoxy-indan-1-one::CHEMBL168938 Cholinesterase 4740 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50280646 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50280646&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search DZ7 5NAP 10762160 104122350 CHEMBL168938 ZINC00597028 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502614 COc1ccc2C\C(=C/C3CCN(Cc4ccccc4)CC3)C(=O)c2c1 InChI=1S/C23H25NO2/c1-26-21-8-7-19-14-20(23(25)22(19)15-21)13-17-9-11-24(12-10-17)16-18-5-3-2-4-6-18/h2-8,13,15,17H,9-12,14,16H2,1H3/b20-13+ DPIFFAVGHCOCCC-DEDYPNTBSA-N 50182445 CHEMBL3819220 Cholinesterase 2650 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182445 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182445&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10807621 346550056 CHEMBL3819220 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502615 COc1cccc2C\C(=C/C3CCN(Cc4ccccc4)CC3)C(=O)c12 InChI=1S/C23H25NO2/c1-26-21-9-5-8-19-15-20(23(25)22(19)21)14-17-10-12-24(13-11-17)16-18-6-3-2-4-7-18/h2-9,14,17H,10-13,15-16H2,1H3/b20-14+ PBMKYXADBLYWBA-XSFVSMFZSA-N 50182446 CHEMBL3818167 Cholinesterase 1140 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182446 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182446&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127049058 346550057 CHEMBL3818167 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502616 COc1ccc2C(=O)\C(Cc2c1)=C\C1CCN(Cc2ccccc2)CC1 InChI=1S/C23H25NO2/c1-26-21-7-8-22-19(15-21)14-20(23(22)25)13-17-9-11-24(12-10-17)16-18-5-3-2-4-6-18/h2-8,13,15,17H,9-12,14,16H2,1H3/b20-13+ CNIWTTNRVIMZIP-DEDYPNTBSA-N 50182435 CHEMBL3818084 Cholinesterase 5734 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182435 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182435&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search DZ0 5NAU 10521609 346550046 CHEMBL3818084 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502617 O=C1\C(Cc2cc3OCOc3cc12)=C\C1CCN(Cc2ccccc2)CC1 InChI=1S/C23H23NO3/c25-23-19(11-18-12-21-22(13-20(18)23)27-15-26-21)10-16-6-8-24(9-7-16)14-17-4-2-1-3-5-17/h1-5,10,12-13,16H,6-9,11,14-15H2/b19-10+ VXQFGUJASGKRMS-VXLYETTFSA-N 50182436 CHEMBL3818801 Cholinesterase 15130 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182436 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182436&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14553581 346550047 CHEMBL3818801 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502618 COc1ccc2C(=O)\C(Cc2c1)=C\C1CCN(Cc2cccc(OC)c2)CC1 InChI=1S/C24H27NO3/c1-27-21-5-3-4-18(13-21)16-25-10-8-17(9-11-25)12-20-14-19-15-22(28-2)6-7-23(19)24(20)26/h3-7,12-13,15,17H,8-11,14,16H2,1-2H3/b20-12+ JATSNZSQYDITNU-UDWIEESQSA-N 50182437 CHEMBL3819531 Cholinesterase 2170 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182437 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182437&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127049377 346550048 CHEMBL3819531 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502619 COc1ccc2C\C(=C/C3CCN(Cc4cccc(OC)c4)CC3)C(=O)c2c1 InChI=1S/C24H27NO3/c1-27-21-5-3-4-18(13-21)16-25-10-8-17(9-11-25)12-20-14-19-6-7-22(28-2)15-23(19)24(20)26/h3-7,12-13,15,17H,8-11,14,16H2,1-2H3/b20-12+ VRHAQRBXZOTBMX-UDWIEESQSA-N 50182438 CHEMBL3819113 Cholinesterase 1620 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182438 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182438&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127049378 346550049 CHEMBL3819113 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502620 COc1cccc(CN2CCC(CC2)\C=C2/Cc3cccc(OC)c3C2=O)c1 InChI=1S/C24H27NO3/c1-27-21-7-3-5-18(14-21)16-25-11-9-17(10-12-25)13-20-15-19-6-4-8-22(28-2)23(19)24(20)26/h3-8,13-14,17H,9-12,15-16H2,1-2H3/b20-13+ GJQQDXQGUWSLSC-DEDYPNTBSA-N 50182439 CHEMBL3819574 Cholinesterase 5410 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182439 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182439&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127048735 346550050 CHEMBL3819574 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502621 COc1ccc2C\C(=C/C3CCN(Cc4ccc5OCOc5c4)CC3)C(=O)c2c1 InChI=1S/C24H25NO4/c1-27-20-4-3-18-12-19(24(26)21(18)13-20)10-16-6-8-25(9-7-16)14-17-2-5-22-23(11-17)29-15-28-22/h2-5,10-11,13,16H,6-9,12,14-15H2,1H3/b19-10+ SSNKBYPYCIBWEY-VXLYETTFSA-N 50182440 CHEMBL3819247 Cholinesterase 9820 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182440 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182440&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127048388 346550051 CHEMBL3819247 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502622 COc1cccc2C\C(=C/C3CCN(Cc4ccc5OCOc5c4)CC3)C(=O)c12 InChI=1S/C24H25NO4/c1-27-21-4-2-3-18-13-19(24(26)23(18)21)11-16-7-9-25(10-8-16)14-17-5-6-20-22(12-17)29-15-28-20/h2-6,11-12,16H,7-10,13-15H2,1H3/b19-11+ SVXQNAFUZDCNTM-YBFXNURJSA-N 50182441 CHEMBL3818918 Cholinesterase 4820 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182441 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182441&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127048389 346550052 CHEMBL3818918 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502639 Oc1cccc2C\C(=C/C3CCN(Cc4ccccc4)CC3)C(=O)c12 InChI=1S/C22H23NO2/c24-20-8-4-7-18-14-19(22(25)21(18)20)13-16-9-11-23(12-10-16)15-17-5-2-1-3-6-17/h1-8,13,16,24H,9-12,14-15H2/b19-13+ RLSKFCOIMMXSLS-CPNJWEJPSA-N 50182442 CHEMBL3818616 Cholinesterase 6480 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182442 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182442&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050318 346550053 CHEMBL3818616 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502640 Oc1ccc2C(=O)\C(Cc2c1)=C\C1CCN(Cc2ccccc2)CC1 InChI=1S/C22H23NO2/c24-20-6-7-21-18(14-20)13-19(22(21)25)12-16-8-10-23(11-9-16)15-17-4-2-1-3-5-17/h1-7,12,14,16,24H,8-11,13,15H2/b19-12+ PIJDCHBRSITJLS-XDHOZWIPSA-N 50182443 CHEMBL3819646 Cholinesterase 8460 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182443 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182443&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050319 346550054 CHEMBL3819646 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502641 COc1cc2C\C(=C/C3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H27NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,12,14-15,17H,8-11,13,16H2,1-2H3/b20-12+ LPMOTUSFDTTWJL-UDWIEESQSA-N 50280646 2-[1-(1-Benzyl-piperidin-4-yl)-meth-(E)-ylidene]-5,6-dimethoxy-indan-1-one::CHEMBL168938 Cholinesterase 2440 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50280646 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50280646&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search DZ7 5NAP 10762160 104122350 CHEMBL168938 ZINC00597028 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502642 COc1ccc2C\C(=C/C3CCN(Cc4ccccc4)CC3)C(=O)c2c1 InChI=1S/C23H25NO2/c1-26-21-8-7-19-14-20(23(25)22(19)15-21)13-17-9-11-24(12-10-17)16-18-5-3-2-4-6-18/h2-8,13,15,17H,9-12,14,16H2,1H3/b20-13+ DPIFFAVGHCOCCC-DEDYPNTBSA-N 50182445 CHEMBL3819220 Cholinesterase 1140 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182445 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182445&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10807621 346550056 CHEMBL3819220 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502643 COc1cccc2C\C(=C/C3CCN(Cc4ccccc4)CC3)C(=O)c12 InChI=1S/C23H25NO2/c1-26-21-9-5-8-19-15-20(23(25)22(19)21)14-17-10-12-24(13-11-17)16-18-6-3-2-4-7-18/h2-9,14,17H,10-13,15-16H2,1H3/b20-14+ PBMKYXADBLYWBA-XSFVSMFZSA-N 50182446 CHEMBL3818167 Cholinesterase 3099 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182446 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182446&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127049058 346550057 CHEMBL3818167 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50506902 C[N+]1(CCNC(=O)c2cnc3C(=O)c4ccccc4-c4cccc2c34)CCCCC1 InChI=1S/C25H25N3O2/c1-28(13-5-2-6-14-28)15-12-26-25(30)21-16-27-23-22-18(10-7-11-19(21)22)17-8-3-4-9-20(17)24(23)29/h3-4,7-11,16H,2,5-6,12-15H2,1H3/p+1 RTOJQRGHWSPUAO-UHFFFAOYSA-O 50293440 1-methyl-1-(2-(7-oxo-7H-dibenzo[de,g]quinoline-4-carboxamido)ethyl)piperidinium iodide::CHEMBL541019 Cholinesterase 6760 ChEMBL 10.1016/j.ejmech.2009.01.021 10.7270/Q2Z89CFV 19243862 Tang, H; Wei, YB; Zhang, C; Ning, FX; Qiao, W; Huang, SL; Ma, L; Huang, ZS; Gu, LQ Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50293440 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50293440&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44126595 104134991 CHEMBL541019 ZINC43121797 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50501559 OC1=C(CCC\C1=C/c1ccc(O)c(O)c1)C(=O)c1ccccc1 InChI=1S/C20H18O4/c21-17-10-9-13(12-18(17)22)11-15-7-4-8-16(20(15)24)19(23)14-5-2-1-3-6-14/h1-3,5-6,9-12,21-22,24H,4,7-8H2/b15-11+ WXBRROMIYZANBF-RVDMUPIBSA-N 50180624 CHEMBL3601736 Cholinesterase 6500 ChEMBL 10.1016/j.bmc.2016.06.016 10.7270/Q208677P 27328658 Leong, SW; Abas, F; Lam, KW; Shaari, K; Lajis, NH Universiti Putra Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50180624 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50180624&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122185117 346549710 CHEMBL3601736 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50501560 OC1=C(CCC\C1=C/c1ccc(O)c(Cl)c1)C(=O)c1ccccc1 InChI=1S/C20H17ClO3/c21-17-12-13(9-10-18(17)22)11-15-7-4-8-16(20(15)24)19(23)14-5-2-1-3-6-14/h1-3,5-6,9-12,22,24H,4,7-8H2/b15-11+ VRIXFLRTHIYHRG-RVDMUPIBSA-N 50180625 CHEMBL3601744 Cholinesterase 10600 ChEMBL 10.1016/j.bmc.2016.06.016 10.7270/Q208677P 27328658 Leong, SW; Abas, F; Lam, KW; Shaari, K; Lajis, NH Universiti Putra Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50180625 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50180625&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122185125 346549711 CHEMBL3601744 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50501561 OC1=C(CCC\C1=C/c1ccc(O)c(Br)c1)C(=O)c1ccccc1 InChI=1S/C20H17BrO3/c21-17-12-13(9-10-18(17)22)11-15-7-4-8-16(20(15)24)19(23)14-5-2-1-3-6-14/h1-3,5-6,9-12,22,24H,4,7-8H2/b15-11+ PHSJIPVTQZIVCH-RVDMUPIBSA-N 50180626 CHEMBL3601745 Cholinesterase 4700 ChEMBL 10.1016/j.bmc.2016.06.016 10.7270/Q208677P 27328658 Leong, SW; Abas, F; Lam, KW; Shaari, K; Lajis, NH Universiti Putra Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50180626 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50180626&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122185126 346549712 CHEMBL3601745 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50501562 OC1=C(CCC\C1=C/c1cccc(OCCN2CCCCC2)c1)C(=O)c1ccccc1 InChI=1S/C27H31NO3/c29-26(22-10-3-1-4-11-22)25-14-8-12-23(27(25)30)19-21-9-7-13-24(20-21)31-18-17-28-15-5-2-6-16-28/h1,3-4,7,9-11,13,19-20,30H,2,5-6,8,12,14-18H2/b23-19+ SPJJRELPSVANFD-FCDQGJHFSA-N 50180620 CHEMBL3814587 Cholinesterase 1400 ChEMBL 10.1016/j.bmc.2016.06.016 10.7270/Q208677P 27328658 Leong, SW; Abas, F; Lam, KW; Shaari, K; Lajis, NH Universiti Putra Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50180620 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50180620&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127050289 346549706 CHEMBL3814587 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50501563 OC1=C(CCC\C1=C/c1ccc(OCCN2CCCCC2)cc1)C(=O)c1ccccc1 InChI=1S/C27H31NO3/c29-26(22-8-3-1-4-9-22)25-11-7-10-23(27(25)30)20-21-12-14-24(15-13-21)31-19-18-28-16-5-2-6-17-28/h1,3-4,8-9,12-15,20,30H,2,5-7,10-11,16-19H2/b23-20+ BNZNGMWBSOSQAB-BSYVCWPDSA-N 50180621 CHEMBL3814621 Cholinesterase 2700 ChEMBL 10.1016/j.bmc.2016.06.016 10.7270/Q208677P 27328658 Leong, SW; Abas, F; Lam, KW; Shaari, K; Lajis, NH Universiti Putra Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50180621 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50180621&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127048696 346549707 CHEMBL3814621 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50501564 OC1=C(CCC\C1=C/c1cccc(OCCN2CCCC2)c1)C(=O)c1ccccc1 InChI=1S/C26H29NO3/c28-25(21-9-2-1-3-10-21)24-13-7-11-22(26(24)29)18-20-8-6-12-23(19-20)30-17-16-27-14-4-5-15-27/h1-3,6,8-10,12,18-19,29H,4-5,7,11,13-17H2/b22-18+ JKJDJUCPGVEQHN-RELWKKBWSA-N 50180622 CHEMBL3814519 Cholinesterase 600 ChEMBL 10.1016/j.bmc.2016.06.016 10.7270/Q208677P 27328658 Leong, SW; Abas, F; Lam, KW; Shaari, K; Lajis, NH Universiti Putra Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50180622 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50180622&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127048697 346549708 CHEMBL3814519 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50501565 OC1=C(CCC\C1=C/c1ccc(OCCN2CCCC2)cc1)C(=O)c1ccccc1 InChI=1S/C26H29NO3/c28-25(21-7-2-1-3-8-21)24-10-6-9-22(26(24)29)19-20-11-13-23(14-12-20)30-18-17-27-15-4-5-16-27/h1-3,7-8,11-14,19,29H,4-6,9-10,15-18H2/b22-19+ HZXYLDXMKHKPDI-ZBJSNUHESA-N 50180623 CHEMBL3814100 Cholinesterase 2300 ChEMBL 10.1016/j.bmc.2016.06.016 10.7270/Q208677P 27328658 Leong, SW; Abas, F; Lam, KW; Shaari, K; Lajis, NH Universiti Putra Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50180623 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50180623&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127048698 346549709 CHEMBL3814100 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50501566 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 10.0 ChEMBL 10.1016/j.bmc.2016.06.016 10.7270/Q208677P 27328658 Leong, SW; Abas, F; Lam, KW; Shaari, K; Lajis, NH Universiti Putra Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50501568 OC1=C(CCC\C1=C/c1cccc(OCCN2CCCC2)c1)C(=O)c1ccccc1 InChI=1S/C26H29NO3/c28-25(21-9-2-1-3-10-21)24-13-7-11-22(26(24)29)18-20-8-6-12-23(19-20)30-17-16-27-14-4-5-15-27/h1-3,6,8-10,12,18-19,29H,4-5,7,11,13-17H2/b22-18+ JKJDJUCPGVEQHN-RELWKKBWSA-N 50180622 CHEMBL3814519 Cholinesterase 200 ChEMBL 10.1016/j.bmc.2016.06.016 10.7270/Q208677P 27328658 Leong, SW; Abas, F; Lam, KW; Shaari, K; Lajis, NH Universiti Putra Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50180622 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50180622&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127048697 346549708 CHEMBL3814519 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502644 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 2140 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502645 COc1cc2C\C(=C/C3CCN(Cc4ccccc4)CC3)C(=O)c2cc1O InChI=1S/C23H25NO3/c1-27-22-13-18-12-19(23(26)20(18)14-21(22)25)11-16-7-9-24(10-8-16)15-17-5-3-2-4-6-17/h2-6,11,13-14,16,25H,7-10,12,15H2,1H3/b19-11+ LQKGQMXOOLGDAM-YBFXNURJSA-N 50182444 CHEMBL3818415 Cholinesterase 10611 ChEMBL 10.1021/acsmedchemlett.5b00483 10.7270/Q2PN97JV 27190595 Costanzo, P; Cariati, L; Desiderio, D; Sgammato, R; Lamberti, A; Arcone, R; Salerno, R; Nardi, M; Masullo, M; Oliverio, M Universit£ degli Studi della Magna Gr£cia Viale Europa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182444 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182444&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14553576 346550055 CHEMBL3818415 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502662 Oc1ccc(CCCCCCCCC(c2ccc(O)c(C(=O)CCCCCCCCc3ccc(O)c(O)c3)c2O)c2c(O)cccc2O)cc1O InChI=1S/C42H52O9/c43-32-23-20-28(26-38(32)49)14-9-5-1-3-7-11-16-30(40-34(45)18-13-19-35(40)46)31-22-25-37(48)41(42(31)51)36(47)17-12-8-4-2-6-10-15-29-21-24-33(44)39(50)27-29/h13,18-27,30,43-46,48-51H,1-12,14-17H2 WZPJUCRWKNGODO-UHFFFAOYSA-N 50182489 CHEMBL3818374 Cholinesterase 10510 ChEMBL 10.1016/j.bmcl.2016.05.046 10.7270/Q2F47R34 27236720 Abdul Wahab, SM; Sivasothy, Y; Liew, SY; Litaudon, M; Mohamad, J; Awang, K University of Malaya http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182489 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182489&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10439720 104067171 CHEMBL3818374 ZINC28568419 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502663 Oc1ccc(CCCCCCCCC(c2ccc(O)c(C(=O)CCCCCCCCc3ccc(O)c(O)c3)c2O)c2c(O)cccc2O)cc1 InChI=1S/C42H52O8/c43-31-23-20-29(21-24-31)14-9-5-1-3-7-11-16-32(40-35(45)18-13-19-36(40)46)33-25-27-38(48)41(42(33)50)37(47)17-12-8-4-2-6-10-15-30-22-26-34(44)39(49)28-30/h13,18-28,32,43-46,48-50H,1-12,14-17H2 XJDOZXYIHKNRKO-UHFFFAOYSA-N 50182490 CHEMBL3819024 Cholinesterase 12520 ChEMBL 10.1016/j.bmcl.2016.05.046 10.7270/Q2F47R34 27236720 Abdul Wahab, SM; Sivasothy, Y; Liew, SY; Litaudon, M; Mohamad, J; Awang, K University of Malaya http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182490 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182490&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127048439 104067172 CHEMBL3819024 ZINC28568516 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502664 CNC(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1 InChI=1S/C15H21N3O2/c1-15-7-8-17(3)13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2/h5-6,9,13H,7-8H2,1-4H3,(H,16,19)/t13-,15+/m1/s1 PIJVFDBKTWXHHD-HIFRSBDPSA-N 50004000 (3aS,8aR)-1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol-5-yl methylcarbamate::Antilirium::CHEMBL94::Eserine::Physostol::physostigmine Cholinesterase 220 ChEMBL 10.1016/j.bmcl.2016.05.046 10.7270/Q2F47R34 27236720 Abdul Wahab, SM; Sivasothy, Y; Liew, SY; Litaudon, M; Mohamad, J; Awang, K University of Malaya http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50004000 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50004000&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5983 103917788 27953 CHEMBL94 DB00981 6598 C06535 ZINC33971762 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502667 Oc1ccc(CCCCCCCCC(=O)c2c(O)cccc2O)cc1 InChI=1S/C21H26O4/c22-17-14-12-16(13-15-17)8-5-3-1-2-4-6-9-18(23)21-19(24)10-7-11-20(21)25/h7,10-15,22,24-25H,1-6,8-9H2 KOAPDMKKECXPHX-UHFFFAOYSA-N 50182486 MALABARICONE B Cholinesterase 560 ChEMBL 10.1016/j.bmcl.2016.05.046 10.7270/Q2F47R34 27236720 Abdul Wahab, SM; Sivasothy, Y; Liew, SY; Litaudon, M; Mohamad, J; Awang, K University of Malaya http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182486 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182486&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 163001 104067168 ZINC37865558 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502668 Oc1ccc(CCCCCCCCC(=O)c2c(O)cccc2O)cc1O InChI=1S/C21H26O5/c22-16-13-12-15(14-20(16)26)8-5-3-1-2-4-6-9-17(23)21-18(24)10-7-11-19(21)25/h7,10-14,22,24-26H,1-6,8-9H2 HCOZRFYGIFMIEX-UHFFFAOYSA-N 50182491 CHEBI:69015::Malabaricone C Cholinesterase 11460 ChEMBL 10.1016/j.bmcl.2016.05.046 10.7270/Q2F47R34 27236720 Abdul Wahab, SM; Sivasothy, Y; Liew, SY; Litaudon, M; Mohamad, J; Awang, K University of Malaya http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182491 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182491&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 100313 104067173 ZINC28568641 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502669 Oc1cccc(O)c1C(=O)CCCCCCCCc1ccccc1 InChI=1S/C21H26O3/c22-18(21-19(23)15-10-16-20(21)24)14-9-4-2-1-3-6-11-17-12-7-5-8-13-17/h5,7-8,10,12-13,15-16,23-24H,1-4,6,9,11,14H2 IAXIHKJASWPASP-UHFFFAOYSA-N 50182487 Malabaricone A Cholinesterase 39210 ChEMBL 10.1016/j.bmcl.2016.05.046 10.7270/Q2F47R34 27236720 Abdul Wahab, SM; Sivasothy, Y; Liew, SY; Litaudon, M; Mohamad, J; Awang, K University of Malaya http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182487 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182487&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 324062 104067169 ZINC37865561 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502670 Oc1ccc(CCCCCCCCC(=O)c2c(O)cccc2O)cc1 InChI=1S/C21H26O4/c22-17-14-12-16(13-15-17)8-5-3-1-2-4-6-9-18(23)21-19(24)10-7-11-20(21)25/h7,10-15,22,24-25H,1-6,8-9H2 KOAPDMKKECXPHX-UHFFFAOYSA-N 50182486 MALABARICONE B Cholinesterase 1760 ChEMBL 10.1016/j.bmcl.2016.05.046 10.7270/Q2F47R34 27236720 Abdul Wahab, SM; Sivasothy, Y; Liew, SY; Litaudon, M; Mohamad, J; Awang, K University of Malaya http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182486 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182486&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 163001 104067168 ZINC37865558 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502671 Oc1ccc(CCCCCCCCC(=O)c2c(O)cccc2O)cc1O InChI=1S/C21H26O5/c22-16-13-12-15(14-20(16)26)8-5-3-1-2-4-6-9-17(23)21-18(24)10-7-11-19(21)25/h7,10-14,22,24-26H,1-6,8-9H2 HCOZRFYGIFMIEX-UHFFFAOYSA-N 50182491 CHEBI:69015::Malabaricone C Cholinesterase 2800 ChEMBL 10.1016/j.bmcl.2016.05.046 10.7270/Q2F47R34 27236720 Abdul Wahab, SM; Sivasothy, Y; Liew, SY; Litaudon, M; Mohamad, J; Awang, K University of Malaya http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182491 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182491&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 100313 104067173 ZINC28568641 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50502672 Oc1ccc(CCCCCCCCC(=O)c2c(O)cc(O)cc2O)cc1 InChI=1S/C21H26O5/c22-16-11-9-15(10-12-16)7-5-3-1-2-4-6-8-18(24)21-19(25)13-17(23)14-20(21)26/h9-14,22-23,25-26H,1-8H2 XNMKFKNNXSUXRV-UHFFFAOYSA-N 50182488 CHEMBL3819036 Cholinesterase 6650 ChEMBL 10.1016/j.bmcl.2016.05.046 10.7270/Q2F47R34 27236720 Abdul Wahab, SM; Sivasothy, Y; Liew, SY; Litaudon, M; Mohamad, J; Awang, K University of Malaya http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50182488 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50182488&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127048438 104067170 CHEMBL3819036 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50506903 C[N+]1(CCCNC(=O)c2cnc3C(=O)c4ccccc4-c4cccc2c34)CCOCC1 InChI=1S/C25H25N3O3/c1-28(12-14-31-15-13-28)11-5-10-26-25(30)21-16-27-23-22-18(8-4-9-19(21)22)17-6-2-3-7-20(17)24(23)29/h2-4,6-9,16H,5,10-15H2,1H3/p+1 XGJSXQCQULMBCN-UHFFFAOYSA-O 50293441 4-methyl-4-(3-(7-oxo-7H-dibenzo[de,g]quinoline-4-carboxamido)propyl)morpholin-4-ium iodide::CHEMBL549666 Cholinesterase 4750 ChEMBL 10.1016/j.ejmech.2009.01.021 10.7270/Q2Z89CFV 19243862 Tang, H; Wei, YB; Zhang, C; Ning, FX; Qiao, W; Huang, SL; Ma, L; Huang, ZS; Gu, LQ Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50293441 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50293441&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44126593 104134992 CHEMBL549666 ZINC43020000 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50506904 C[N+]1(CCNC(=O)c2cnc3C(=O)c4ccccc4-c4cccc2c34)CCOCC1 InChI=1S/C24H23N3O3/c1-27(11-13-30-14-12-27)10-9-25-24(29)20-15-26-22-21-17(7-4-8-18(20)21)16-5-2-3-6-19(16)23(22)28/h2-8,15H,9-14H2,1H3/p+1 YIFIAWPDMQZCDS-UHFFFAOYSA-O 50293442 4-methyl-4-(2-(7-oxo-7H-dibenzo[de,g]quinoline-4-carboxamido)ethyl)morpholin-4-ium iodide::CHEMBL559822 Cholinesterase 11690 ChEMBL 10.1016/j.ejmech.2009.01.021 10.7270/Q2Z89CFV 19243862 Tang, H; Wei, YB; Zhang, C; Ning, FX; Qiao, W; Huang, SL; Ma, L; Huang, ZS; Gu, LQ Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50293442 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50293442&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44126702 104134993 CHEMBL559822 ZINC43074884 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50506905 Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 InChI=1S/C16H10N2O/c17-10-4-5-11-13(8-10)16(19)12-3-1-2-9-6-7-18-15(11)14(9)12/h1-8H,17H2 SWTAISDIUOZWOE-UHFFFAOYSA-N 50211247 9-Amino-1-azabenzanthrone::9-amino-1-aza-benzo[de]anthracen-7-one::9-amino-7H-dibenzo[de,h]quinolin-7-one::CHEMBL246681 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2009.01.021 10.7270/Q2Z89CFV 19243862 Tang, H; Wei, YB; Zhang, C; Ning, FX; Qiao, W; Huang, SL; Ma, L; Huang, ZS; Gu, LQ Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211247 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211247&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44440937 104087482 CHEMBL246681 ZINC28902586 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50506906 O=C1c2ccccc2-c2cccc3ccnc1c23 InChI=1S/C16H9NO/c18-16-13-6-2-1-5-11(13)12-7-3-4-10-8-9-17-15(16)14(10)12/h1-9H GHWKWAMIXPOYPG-UHFFFAOYSA-N 50293443 7-Oxo-7H-dibenzo[de,g]quinoline::CHEMBL559502 Cholinesterase 4010 ChEMBL 10.1016/j.ejmech.2009.01.021 10.7270/Q2Z89CFV 19243862 Tang, H; Wei, YB; Zhang, C; Ning, FX; Qiao, W; Huang, SL; Ma, L; Huang, ZS; Gu, LQ Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50293443 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50293443&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 326183 104134994 CHEMBL559502 ZINC02024486 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50506920 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 14400 ChEMBL 10.1016/j.ejmech.2009.01.021 10.7270/Q2Z89CFV 19243862 Tang, H; Wei, YB; Zhang, C; Ning, FX; Qiao, W; Huang, SL; Ma, L; Huang, ZS; Gu, LQ Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50506921 OCCCNC(=O)c1cnc2C(=O)c3ccccc3-c3cccc1c23 InChI=1S/C20H16N2O3/c23-10-4-9-21-20(25)16-11-22-18-17-13(7-3-8-14(16)17)12-5-1-2-6-15(12)19(18)24/h1-3,5-8,11,23H,4,9-10H2,(H,21,25) BMXUDXXKXQWPNZ-UHFFFAOYSA-N 50293444 CHEMBL549936::N-(3-hydroxypropyl)-7-oxo-7H-benzo[de]anthracene-4-carboxamide Cholinesterase 53250 ChEMBL 10.1016/j.ejmech.2009.01.021 10.7270/Q2Z89CFV 19243862 Tang, H; Wei, YB; Zhang, C; Ning, FX; Qiao, W; Huang, SL; Ma, L; Huang, ZS; Gu, LQ Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50293444 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50293444&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44128207 104134995 CHEMBL549936 ZINC43015982 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50506922 OCCNC(=O)c1cnc2C(=O)c3ccccc3-c3cccc1c23 InChI=1S/C19H14N2O3/c22-9-8-20-19(24)15-10-21-17-16-12(6-3-7-13(15)16)11-4-1-2-5-14(11)18(17)23/h1-7,10,22H,8-9H2,(H,20,24) ITWZICWKEKUPLH-UHFFFAOYSA-N 50293445 CHEMBL551430::N-(2-hydroxyethyl)-7-oxo-7H-benzo[de]anthracene-4-carboxamide Cholinesterase 68730 ChEMBL 10.1016/j.ejmech.2009.01.021 10.7270/Q2Z89CFV 19243862 Tang, H; Wei, YB; Zhang, C; Ning, FX; Qiao, W; Huang, SL; Ma, L; Huang, ZS; Gu, LQ Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50293445 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50293445&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44128206 104134996 CHEMBL551430 C04080 ZINC43060434 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50506923 CC[N+](C)(CC)CCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 InChI=1S/C24H25N3O2/c1-4-27(3,5-2)14-12-21(28)26-17-9-10-18-20(15-17)24(29)19-8-6-7-16-11-13-25-23(18)22(16)19/h6-11,13,15H,4-5,12,14H2,1-3H3/p+1 XOSNXEFQFPGDCV-UHFFFAOYSA-O 50293446 CHEMBL556249::Diethyl-methyl-[2-(7-oxo-7H-1-aza-benzo[de]anthracen-9-ylcarbamoyl)-ethyl]-ammonium methiodide Cholinesterase 5190 ChEMBL 10.1016/j.ejmech.2009.01.021 10.7270/Q2Z89CFV 19243862 Tang, H; Wei, YB; Zhang, C; Ning, FX; Qiao, W; Huang, SL; Ma, L; Huang, ZS; Gu, LQ Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50293446 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50293446&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44219687 104134997 CHEMBL556249 ZINC43062316 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50506924 CC[N+](C)(CC)CCCNC(=O)c1cnc2C(=O)c3ccccc3-c3cccc1c23 InChI=1S/C25H27N3O2/c1-4-28(3,5-2)15-9-14-26-25(30)21-16-27-23-22-18(12-8-13-19(21)22)17-10-6-7-11-20(17)24(23)29/h6-8,10-13,16H,4-5,9,14-15H2,1-3H3/p+1 PMGNTUDELMPHHT-UHFFFAOYSA-O 50293447 CHEMBL549935::N,N-diethyl-N-methyl-3-(7-oxo-7H-dibenzo[de,g]quinoline-4-carboxamido)propan-1-aminium iodide Cholinesterase 9720 ChEMBL 10.1016/j.ejmech.2009.01.021 10.7270/Q2Z89CFV 19243862 Tang, H; Wei, YB; Zhang, C; Ning, FX; Qiao, W; Huang, SL; Ma, L; Huang, ZS; Gu, LQ Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50293447 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50293447&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44126704 104134998 CHEMBL549935 ZINC43015979 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50506925 CC[N+](C)(CC)CCNC(=O)c1cnc2C(=O)c3ccccc3-c3cccc1c23 InChI=1S/C24H25N3O2/c1-4-27(3,5-2)14-13-25-24(29)20-15-26-22-21-17(11-8-12-18(20)21)16-9-6-7-10-19(16)23(22)28/h6-12,15H,4-5,13-14H2,1-3H3/p+1 CTEYYHJFQJOQND-UHFFFAOYSA-O 50293448 CHEMBL550076::N,N-diethyl-N-methyl-2-(7-oxo-7H-dibenzo[de,g]quinoline-4-carboxamido)ethanaminium iodide Cholinesterase 8140 ChEMBL 10.1016/j.ejmech.2009.01.021 10.7270/Q2Z89CFV 19243862 Tang, H; Wei, YB; Zhang, C; Ning, FX; Qiao, W; Huang, SL; Ma, L; Huang, ZS; Gu, LQ Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50293448 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50293448&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44126603 104134999 CHEMBL550076 ZINC43017244 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50506926 C[N+](C)(C)CCC(=O)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 InChI=1S/C22H21N3O2/c1-25(2,3)12-10-19(26)24-15-7-8-16-18(13-15)22(27)17-6-4-5-14-9-11-23-21(16)20(14)17/h4-9,11,13H,10,12H2,1-3H3/p+1 ZOBLVFXUVZGOLQ-UHFFFAOYSA-O 50211244 CHEMBL395926::Trimethyl-[2-(7-oxo-7H-1-aza-benzo[de]anthracen-9-ylcarbamoyl)-ethyl]-ammonium methiodide::trimethyl-[2-(7-oxo-7H-1-aza-benzo[de]anthracen-9-ylcarbamoyl)-ethyl]-ammonium Cholinesterase 2820 ChEMBL 10.1016/j.ejmech.2009.01.021 10.7270/Q2Z89CFV 19243862 Tang, H; Wei, YB; Zhang, C; Ning, FX; Qiao, W; Huang, SL; Ma, L; Huang, ZS; Gu, LQ Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211244 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211244&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44440941 104087479 CHEMBL395926 ZINC28902719 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50506927 C[N+](C)(C)CCCNC(=O)c1cnc2C(=O)c3ccccc3-c3cccc1c23 InChI=1S/C23H23N3O2/c1-26(2,3)13-7-12-24-23(28)19-14-25-21-20-16(10-6-11-17(19)20)15-8-4-5-9-18(15)22(21)27/h4-6,8-11,14H,7,12-13H2,1-3H3/p+1 HNEVEAQGBVTLKM-UHFFFAOYSA-O 50293449 CHEMBL559266::N,N,N-trimethyl-3-(7-oxo-7H-dibenzo[de,g]quinoline-4-carboxamido)propan-1-aminium iodide Cholinesterase 2710 ChEMBL 10.1016/j.ejmech.2009.01.021 10.7270/Q2Z89CFV 19243862 Tang, H; Wei, YB; Zhang, C; Ning, FX; Qiao, W; Huang, SL; Ma, L; Huang, ZS; Gu, LQ Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50293449 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50293449&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44126601 104135000 CHEMBL559266 ZINC43012234 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50506928 C[N+](C)(C)CCNC(=O)c1cnc2C(=O)c3ccccc3-c3cccc1c23 InChI=1S/C22H21N3O2/c1-25(2,3)12-11-23-22(27)18-13-24-20-19-15(9-6-10-16(18)19)14-7-4-5-8-17(14)21(20)26/h4-10,13H,11-12H2,1-3H3/p+1 ZKVICSMIPCVKAD-UHFFFAOYSA-O 50293450 CHEMBL551226::N,N,N-trimethyl-2-(7-oxo-7H-dibenzo[de,g]quinoline-4-carboxamido)ethanaminium iodide Cholinesterase 5030 ChEMBL 10.1016/j.ejmech.2009.01.021 10.7270/Q2Z89CFV 19243862 Tang, H; Wei, YB; Zhang, C; Ning, FX; Qiao, W; Huang, SL; Ma, L; Huang, ZS; Gu, LQ Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50293450 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50293450&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44126599 104135001 CHEMBL551226 ZINC43062837 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50506929 C[N+]1(CCC(=O)Nc2ccc-3c(c2)C(=O)c2cccc4ccnc-3c24)CCCCC1 InChI=1S/C25H25N3O2/c1-28(13-3-2-4-14-28)15-11-22(29)27-18-8-9-19-21(16-18)25(30)20-7-5-6-17-10-12-26-24(19)23(17)20/h5-10,12,16H,2-4,11,13-15H2,1H3/p+1 APEFGTAGDTUVAK-UHFFFAOYSA-O 50293451 1-Methyl-1-[2-(7-oxo-7H-1-aza-benzo[de]anthracen-9-ylcarbamoyl)-ethyl]-piperidinium methiode::CHEMBL550075 Cholinesterase 600 ChEMBL 10.1016/j.ejmech.2009.01.021 10.7270/Q2Z89CFV 19243862 Tang, H; Wei, YB; Zhang, C; Ning, FX; Qiao, W; Huang, SL; Ma, L; Huang, ZS; Gu, LQ Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50293451 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50293451&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44128086 104135002 CHEMBL550075 ZINC43009798 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50506930 C[N+]1(CCCNC(=O)c2cnc3C(=O)c4ccccc4-c4cccc2c34)CCCCC1 InChI=1S/C26H27N3O2/c1-29(14-5-2-6-15-29)16-8-13-27-26(31)22-17-28-24-23-19(11-7-12-20(22)23)18-9-3-4-10-21(18)25(24)30/h3-4,7,9-12,17H,2,5-6,8,13-16H2,1H3/p+1 PLXASKOPCYOAAZ-UHFFFAOYSA-O 50293452 1-methyl-1-(3-(7-oxo-7H-dibenzo[de,g]quinoline-4-carboxamido)propyl)piperidinium iodide::CHEMBL563713 Cholinesterase 6240 ChEMBL 10.1016/j.ejmech.2009.01.021 10.7270/Q2Z89CFV 19243862 Tang, H; Wei, YB; Zhang, C; Ning, FX; Qiao, W; Huang, SL; Ma, L; Huang, ZS; Gu, LQ Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50293452 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50293452&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44126597 104135003 CHEMBL563713 ZINC43010806 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50549029 CC(C)c1ccc(cc1)C(=O)CC(N1CCCCC1)C(=O)Nc1ccccc1 InChI=1S/C24H30N2O2/c1-18(2)19-11-13-20(14-12-19)23(27)17-22(26-15-7-4-8-16-26)24(28)25-21-9-5-3-6-10-21/h3,5-6,9-14,18,22H,4,7-8,15-17H2,1-2H3,(H,25,28) KVEZBEAKKFKUTJ-UHFFFAOYSA-N 50306342 4-(4-Isopropylphenyl)-4-oxo-N-phenyl-2-(R,S)-(1-piperidinyl)butyramide::CHEMBL598525 Cholinesterase 7060 ChEMBL 10.1016/j.bmc.2009.12.042 10.7270/Q2ZW1M1J 20061157 Vitorovic-Todorovic, MD; Juranic, IO; Mandic, LM; Drakulic, BJ Institute http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50306342 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50306342&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46231916 104160703 CHEMBL598525 ZINC45355432 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50549030 COc1ccc(cc1)C(=O)CC(N1CCCCC1)C(=O)Nc1ccccc1 InChI=1S/C22H26N2O3/c1-27-19-12-10-17(11-13-19)21(25)16-20(24-14-6-3-7-15-24)22(26)23-18-8-4-2-5-9-18/h2,4-5,8-13,20H,3,6-7,14-16H2,1H3,(H,23,26) WAVWZXOIGCOVHU-UHFFFAOYSA-N 50306343 4-(4-Metoxyphenyl)-4-oxo-N-phenyl-2-(R,S)-(1-piperidinyl)butyramide::CHEMBL605631 Cholinesterase >40000 ChEMBL 10.1016/j.bmc.2009.12.042 10.7270/Q2ZW1M1J 20061157 Vitorovic-Todorovic, MD; Juranic, IO; Mandic, LM; Drakulic, BJ Institute http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50306343 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50306343&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46231915 104160704 CHEMBL605631 ZINC45386048 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50549032 CC(C)c1ccc(C(=O)CC(N2CCOCC2)C(=O)Nc2ccccc2)c(c1)C(C)C InChI=1S/C26H34N2O3/c1-18(2)20-10-11-22(23(16-20)19(3)4)25(29)17-24(28-12-14-31-15-13-28)26(30)27-21-8-6-5-7-9-21/h5-11,16,18-19,24H,12-15,17H2,1-4H3,(H,27,30) FYQINMHHASKUOX-UHFFFAOYSA-N 50306339 4-(2,4-Diisopropylphenyl)-4-oxo-N-phenyl-2-(R,S)-(4-morpholinyl)butyramide::CHEMBL599529 Cholinesterase 3180 ChEMBL 10.1016/j.bmc.2009.12.042 10.7270/Q2ZW1M1J 20061157 Vitorovic-Todorovic, MD; Juranic, IO; Mandic, LM; Drakulic, BJ Institute http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50306339 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50306339&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46232056 104160700 CHEMBL599529 ZINC45373314 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50549050 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 6.95 ChEMBL 10.1016/j.bmc.2009.12.042 10.7270/Q2ZW1M1J 20061157 Vitorovic-Todorovic, MD; Juranic, IO; Mandic, LM; Drakulic, BJ Institute http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50552399 Clc1cccc(Cl)c1CO\N=C\c1cc[n+](CCC[n+]2ccc(\C=N\OCc3c(Cl)cccc3Cl)cc2)cc1 InChI=1S/C29H26Cl4N4O2/c30-26-4-1-5-27(31)24(26)20-38-34-18-22-8-14-36(15-9-22)12-3-13-37-16-10-23(11-17-37)19-35-39-21-25-28(32)6-2-7-29(25)33/h1-2,4-11,14-19H,3,12-13,20-21H2/q+2/b34-18+,35-19+ RAHLDBGBLYIYDN-WKCPDWHCSA-N 50307921 (E,E)-1,3-bis[4-[[(2,6-dichlorobenzyloxyl)imino]methyl]pyridinium]propane. dibromide::1,1'-(propane-1,3-diyl)bis(4-((2,6-dichlorobenzyloxyimino)methyl)pyridinium)bromide::CHEMBL590603 Cholinesterase 1830 ChEMBL 10.1016/j.bmc.2010.01.002 10.7270/Q2GH9J3H 20149667 Alptuzun, V; Prinz, M; Horr, V; Scheiber, J; Radacki, K; Fallarero, A; Vuorela, P; Engels, B; Braunschweig, H; Erciyas, E; Holzgrabe, U Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50307921 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50307921&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10101670 104162282 CHEMBL590603 ZINC29224150 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50552400 Clc1cccc(Cl)c1CO\N=C\c1cc[n+](CCCc2ccccc2)cc1 InChI=1S/C22H21Cl2N2O/c23-21-9-4-10-22(24)20(21)17-27-25-16-19-11-14-26(15-12-19)13-5-8-18-6-2-1-3-7-18/h1-4,6-7,9-12,14-16H,5,8,13,17H2/q+1/b25-16+ QLRUDVGUKJOCFW-PCLIKHOPSA-N 50041517 4-[(2,6-dichloro-benzyloxyimino)-methyl]-1-(3-phenyl-propyl)-pyridinium::CHEMBL32329::CHEMBL610796 Cholinesterase 2780 ChEMBL 10.1016/j.bmc.2010.01.002 10.7270/Q2GH9J3H 20149667 Alptuzun, V; Prinz, M; Horr, V; Scheiber, J; Radacki, K; Fallarero, A; Vuorela, P; Engels, B; Braunschweig, H; Erciyas, E; Holzgrabe, U Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50041517 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50041517&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10050814 103973258 CHEMBL610796CHEMBL32329 ZINC13601058 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50552401 Clc1cccc(Cl)c1CON=C1CCN(CCCc2ccccc2)CC1 InChI=1S/C21H24Cl2N2O/c22-20-9-4-10-21(23)19(20)16-26-24-18-11-14-25(15-12-18)13-5-8-17-6-2-1-3-7-17/h1-4,6-7,9-10H,5,8,11-16H2 ZZLQXIOXUISDRP-UHFFFAOYSA-N 50231232 1-(2-phenylpropyl)-4-oxopiperidine O-(2,6-Dichlorobenzyl)oxime::1-(3-phenylpropyl)piperidin-4-one O-2,6-dichlorobenzyl oxime::CHEMBL399528 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2010.01.002 10.7270/Q2GH9J3H 20149667 Alptuzun, V; Prinz, M; Horr, V; Scheiber, J; Radacki, K; Fallarero, A; Vuorela, P; Engels, B; Braunschweig, H; Erciyas, E; Holzgrabe, U Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50231232 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50231232&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 24773636 104055054 CHEMBL399528 ZINC28971387 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50552402 Cn1ccc(cc1)=N\N=C\c1c(Cl)cccc1Cl InChI=1S/C13H11Cl2N3/c1-18-7-5-10(6-8-18)17-16-9-11-12(14)3-2-4-13(11)15/h2-9H,1H3/b16-9+ XAWUKMAWBQCRIH-CXUHLZMHSA-N 50307924 4-((2,6-dichlorobenzylidene)hydrazono)-1-methyl-1,4-dihydropyridine::CHEMBL598649 Cholinesterase 11000 ChEMBL 10.1016/j.bmc.2010.01.002 10.7270/Q2GH9J3H 20149667 Alptuzun, V; Prinz, M; Horr, V; Scheiber, J; Radacki, K; Fallarero, A; Vuorela, P; Engels, B; Braunschweig, H; Erciyas, E; Holzgrabe, U Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50307924 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50307924&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46228699 104162285 CHEMBL598649 ZINC45357990 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50552403 Clc1cccc(Cl)c1\C=N\N=c1ccn(Cc2ccccc2)cc1 InChI=1S/C19H15Cl2N3/c20-18-7-4-8-19(21)17(18)13-22-23-16-9-11-24(12-10-16)14-15-5-2-1-3-6-15/h1-13H,14H2/b22-13+ RQIDOLDMXBTOIO-LPYMAVHISA-N 50307925 1-benzyl-4-((2,6-dichlorobenzylidene)hydrazono)-1,4-dihydropyridine::CHEMBL598650 Cholinesterase 8000 ChEMBL 10.1016/j.bmc.2010.01.002 10.7270/Q2GH9J3H 20149667 Alptuzun, V; Prinz, M; Horr, V; Scheiber, J; Radacki, K; Fallarero, A; Vuorela, P; Engels, B; Braunschweig, H; Erciyas, E; Holzgrabe, U Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50307925 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50307925&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46228700 104162286 CHEMBL598650 ZINC45357993 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50552404 Clc1cccc(Cl)c1\C=N\N=c1ccn(CCc2ccccc2)cc1 InChI=1S/C20H17Cl2N3/c21-19-7-4-8-20(22)18(19)15-23-24-17-10-13-25(14-11-17)12-9-16-5-2-1-3-6-16/h1-8,10-11,13-15H,9,12H2/b23-15+ YISROAXJSWMRDM-HZHRSRAPSA-N 50307926 4-((2,6-dichlorobenzylidene)hydrazono)-1-phenethyl-1,4-dihydropyridine::CHEMBL610507 Cholinesterase 9000 ChEMBL 10.1016/j.bmc.2010.01.002 10.7270/Q2GH9J3H 20149667 Alptuzun, V; Prinz, M; Horr, V; Scheiber, J; Radacki, K; Fallarero, A; Vuorela, P; Engels, B; Braunschweig, H; Erciyas, E; Holzgrabe, U Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50307926 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50307926&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46228701 104162287 CHEMBL610507 ZINC45393091 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50552405 Clc1cccc(Cl)c1\C=N\N=c1ccn(CCCc2ccccc2)cc1 InChI=1S/C21H19Cl2N3/c22-20-9-4-10-21(23)19(20)16-24-25-18-11-14-26(15-12-18)13-5-8-17-6-2-1-3-7-17/h1-4,6-7,9-12,14-16H,5,8,13H2/b24-16+ IYOPZGMBVAUCQP-LFVJCYFKSA-N 50307927 4-((2,6-dichlorobenzylidene)hydrazono)-1-(3-phenylpropyl)-1,4-dihydropyridine::CHEMBL597993 Cholinesterase 10000 ChEMBL 10.1016/j.bmc.2010.01.002 10.7270/Q2GH9J3H 20149667 Alptuzun, V; Prinz, M; Horr, V; Scheiber, J; Radacki, K; Fallarero, A; Vuorela, P; Engels, B; Braunschweig, H; Erciyas, E; Holzgrabe, U Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50307927 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50307927&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 24894142 104162288 CHEMBL597993 ZINC45355264 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50549023 Cc1ccc(C)c(c1)C(=O)CC(N1CCCCC1)C(=O)Nc1ccccc1 InChI=1S/C23H28N2O2/c1-17-11-12-18(2)20(15-17)22(26)16-21(25-13-7-4-8-14-25)23(27)24-19-9-5-3-6-10-19/h3,5-6,9-12,15,21H,4,7-8,13-14,16H2,1-2H3,(H,24,27) NAWUHQDFWMTDKF-UHFFFAOYSA-N 50306336 4-(2,5-Dimethylphenyl)-4-oxo-N-phenyl-2-(R,S)-(1-piperidinyl)butyramide::CHEMBL596896 Cholinesterase 17180 ChEMBL 10.1016/j.bmc.2009.12.042 10.7270/Q2ZW1M1J 20061157 Vitorovic-Todorovic, MD; Juranic, IO; Mandic, LM; Drakulic, BJ Institute http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50306336 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50306336&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46231913 104160697 CHEMBL596896 ZINC45355129 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50549024 CC(C)c1ccc(C(=O)CC(C(=O)Nc2ccccc2)n2ccnc2)c(c1)C(C)C InChI=1S/C25H29N3O2/c1-17(2)19-10-11-21(22(14-19)18(3)4)24(29)15-23(28-13-12-26-16-28)25(30)27-20-8-6-5-7-9-20/h5-14,16-18,23H,15H2,1-4H3,(H,27,30) OVCKKPHWMFYONV-UHFFFAOYSA-N 50306337 4-(2,4-Diisopropylphenyl)-4-oxo-N-phenyl-2-(R,S)-(1-imidazolyl)butyramide::CHEMBL598313 Cholinesterase >20000 ChEMBL 10.1016/j.bmc.2009.12.042 10.7270/Q2ZW1M1J 20061157 Vitorovic-Todorovic, MD; Juranic, IO; Mandic, LM; Drakulic, BJ Institute http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50306337 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50306337&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46232121 104160698 CHEMBL598313 ZINC45364023 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50549025 COc1ccc(cc1)C(=O)CC(C(=O)Nc1ccccc1)n1ccnc1 InChI=1S/C20H19N3O3/c1-26-17-9-7-15(8-10-17)19(24)13-18(23-12-11-21-14-23)20(25)22-16-5-3-2-4-6-16/h2-12,14,18H,13H2,1H3,(H,22,25) UXJLQUSISAYCQQ-UHFFFAOYSA-N 50306338 4-(4-Metoxyphenyl)-4-oxo-N-phenyl-2-(R,S)-(1-imidazolyl)butyramide::CHEMBL598110 Cholinesterase 30410 ChEMBL 10.1016/j.bmc.2009.12.042 10.7270/Q2ZW1M1J 20061157 Vitorovic-Todorovic, MD; Juranic, IO; Mandic, LM; Drakulic, BJ Institute http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50306338 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50306338&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46232119 104160699 CHEMBL598110 ZINC45358645 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50549026 CC(C)c1ccc(C(=O)CC(N2CCOCC2)C(=O)Nc2ccccc2)c(c1)C(C)C InChI=1S/C26H34N2O3/c1-18(2)20-10-11-22(23(16-20)19(3)4)25(29)17-24(28-12-14-31-15-13-28)26(30)27-21-8-6-5-7-9-21/h5-11,16,18-19,24H,12-15,17H2,1-4H3,(H,27,30) FYQINMHHASKUOX-UHFFFAOYSA-N 50306339 4-(2,4-Diisopropylphenyl)-4-oxo-N-phenyl-2-(R,S)-(4-morpholinyl)butyramide::CHEMBL599529 Cholinesterase 2480 ChEMBL 10.1016/j.bmc.2009.12.042 10.7270/Q2ZW1M1J 20061157 Vitorovic-Todorovic, MD; Juranic, IO; Mandic, LM; Drakulic, BJ Institute http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50306339 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50306339&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46232056 104160700 CHEMBL599529 ZINC45373314 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50549027 COc1ccc(cc1)C(=O)CC(N1CCOCC1)C(=O)Nc1ccccc1 InChI=1S/C21H24N2O4/c1-26-18-9-7-16(8-10-18)20(24)15-19(23-11-13-27-14-12-23)21(25)22-17-5-3-2-4-6-17/h2-10,19H,11-15H2,1H3,(H,22,25) AQLBVBLFAUFECH-UHFFFAOYSA-N 50306340 4-(4-Metoxyphenyl)-4-oxo-N-phenyl-2-(R,S)-(4-morpholinyl)butyramide::CHEMBL599136 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2009.12.042 10.7270/Q2ZW1M1J 20061157 Vitorovic-Todorovic, MD; Juranic, IO; Mandic, LM; Drakulic, BJ Institute http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50306340 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50306340&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46232054 104160701 CHEMBL599136 ZINC45356085 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50549028 Cc1ccc(C)c(c1)C(=O)CC(N1CCOCC1)C(=O)Nc1ccccc1 InChI=1S/C22H26N2O3/c1-16-8-9-17(2)19(14-16)21(25)15-20(24-10-12-27-13-11-24)22(26)23-18-6-4-3-5-7-18/h3-9,14,20H,10-13,15H2,1-2H3,(H,23,26) QCBSFOLIKYKHBE-UHFFFAOYSA-N 50306341 4-(2,5-Dimethylphenyl)-4-oxo-N-phenyl-2-(R,S)-(4-morpholinyl)butyramide::CHEMBL598936 Cholinesterase 34120 ChEMBL 10.1016/j.bmc.2009.12.042 10.7270/Q2ZW1M1J 20061157 Vitorovic-Todorovic, MD; Juranic, IO; Mandic, LM; Drakulic, BJ Institute http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50306341 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50306341&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46231985 104160702 CHEMBL598936 ZINC45365233 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574284 C[n+]1ccc2c(c1)n(CCCCCCCCCCCCn1c3ccccc3c3cc[n+](C)cc13)c1ccccc21 InChI=1S/C36H44N4/c1-37-25-21-31-29-17-11-13-19-33(29)39(35(31)27-37)23-15-9-7-5-3-4-6-8-10-16-24-40-34-20-14-12-18-30(34)32-22-26-38(2)28-36(32)40/h11-14,17-22,25-28H,3-10,15-16,23-24H2,1-2H3/q+2 PCEOSWRRLHSSOC-UHFFFAOYSA-N 50317178 2-Methyl-9-[12-(2-methyl-beta-carboline-9-yl)dodecyl]-beta-carboline-2-ium iodide::CHEMBL1096994 Cholinesterase 4 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317178 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317178&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46223340 104151539 CHEMBL1096994 ZINC49088427 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574285 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 5 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574286 C[n+]1ccc2c(c1)n(CCCCCCCCCn1c3ccccc3c3cc[n+](C)cc13)c1ccccc21 InChI=1S/C33H38N4/c1-34-22-18-28-26-14-8-10-16-30(26)36(32(28)24-34)20-12-6-4-3-5-7-13-21-37-31-17-11-9-15-27(31)29-19-23-35(2)25-33(29)37/h8-11,14-19,22-25H,3-7,12-13,20-21H2,1-2H3/q+2 XBLBEGLFURYCBO-UHFFFAOYSA-N 50317179 2-Methyl-9-[9-(2-methyl-beta-carboline-9-yl)nonyl]-beta-carboline-2-ium diiodide::CHEMBL1087458 Cholinesterase 0.507000 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317179 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317179&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46223338 104151540 CHEMBL1087458 ZINC49050890 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574287 C(CCCCC[n+]1ccc2c(c1)[nH]c1ccccc21)CCCCC[n+]1ccc2c(c1)[nH]c1ccccc21 InChI=1S/C33H36N4/c1(2-4-6-12-20-36-22-18-28-26-14-8-10-16-30(26)34-32(28)24-36)3-5-7-13-21-37-23-19-29-27-15-9-11-17-31(27)35-33(29)25-37/h8-11,14-19,22-25H,1-7,12-13,20-21H2/p+2 UYHDNAKZDXNCHU-UHFFFAOYSA-P 50317183 2-[11-(beta-Carboline-2-ium-2-yl)undecyl]-beta-carboline-2-ium dibromide::CHEMBL1087968 Cholinesterase 18 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317183 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317183&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46222892 104151544 CHEMBL1087968 ZINC49050557 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574288 C[n+]1ccc2c(c1)n(CCCCCn1c3ccccc3c3cc[n+](C)cc13)c1ccccc21 InChI=1S/C29H30N4/c1-30-18-14-24-22-10-4-6-12-26(22)32(28(24)20-30)16-8-3-9-17-33-27-13-7-5-11-23(27)25-15-19-31(2)21-29(25)33/h4-7,10-15,18-21H,3,8-9,16-17H2,1-2H3/q+2 KHJKHJVAFURGFJ-UHFFFAOYSA-N 50317192 2-Methyl-9-[5-(2-methyl-beta-carboline-9-yl)pentyl]-beta-carboline-2-ium diiodide::CHEMBL1095784 Cholinesterase 19 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317192 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317192&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46223336 104151553 CHEMBL1095784 ZINC49784866 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574289 C(CCCCCC[n+]1ccc2c(c1)[nH]c1ccccc21)CCCCC[n+]1ccc2c(c1)[nH]c1ccccc21 InChI=1S/C34H38N4/c1(3-5-7-13-21-37-23-19-29-27-15-9-11-17-31(27)35-33(29)25-37)2-4-6-8-14-22-38-24-20-30-28-16-10-12-18-32(28)36-34(30)26-38/h9-12,15-20,23-26H,1-8,13-14,21-22H2/p+2 VCJGRMVHAYBWRI-UHFFFAOYSA-P 50317182 2-[12-(beta-Carboline-2-ium-2-yl)dodecyl]-beta-carboline-2-ium dibromide::CHEMBL1088377 Cholinesterase 22 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317182 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317182&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46222894 104151543 CHEMBL1088377 ZINC49068276 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574291 CN1CCc2c(C1)n(CCCCCCCCCn1c3CN(C)CCc3c3ccccc13)c1ccccc21 InChI=1S/C33H44N4/c1-34-22-18-28-26-14-8-10-16-30(26)36(32(28)24-34)20-12-6-4-3-5-7-13-21-37-31-17-11-9-15-27(31)29-19-23-35(2)25-33(29)37/h8-11,14-17H,3-7,12-13,18-25H2,1-2H3 JADBPNYNHZGHDV-UHFFFAOYSA-N 50317193 2-Methyl-9-[9-(2-methyl-1,2,3,4-tetrahydro-beta-carboline-9-yl)nonyl]-1,2,3,4-tetrahydro-beta-carboline::CHEMBL1087459 Cholinesterase 38 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317193 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317193&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46222450 104151554 CHEMBL1087459 ZINC49109807 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574292 C(CCCC[n+]1ccc2c(c1)[nH]c1ccccc21)CCCC[n+]1ccc2c(c1)[nH]c1ccccc21 InChI=1S/C31H32N4/c1(2-4-10-18-34-20-16-26-24-12-6-8-14-28(24)32-30(26)22-34)3-5-11-19-35-21-17-27-25-13-7-9-15-29(25)33-31(27)23-35/h6-9,12-17,20-23H,1-5,10-11,18-19H2/p+2 OBGGTWXFOZQOKR-UHFFFAOYSA-P 50317188 2-[9-(beta-Carboline-2-ium-2-yl)nonyl]-beta-carboline-2-ium dibromide::CHEMBL1088655 Cholinesterase 41 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317188 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317188&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46222888 104151549 CHEMBL1088655 ZINC49066771 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574294 C(CC[n+]1ccc2c(c1)[nH]c1ccccc21)CC[n+]1ccc2c(c1)[nH]c1ccccc21 InChI=1S/C27H24N4/c1(6-14-30-16-12-22-20-8-2-4-10-24(20)28-26(22)18-30)7-15-31-17-13-23-21-9-3-5-11-25(21)29-27(23)19-31/h2-5,8-13,16-19H,1,6-7,14-15H2/p+2 SSYCWZNSAIARNS-UHFFFAOYSA-P 50317186 2-[5-(beta-Carboline-2-ium-2-yl)pentyl]-beta-carboline-2-ium dibromide::CHEMBL1088354 Cholinesterase 49 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317186 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317186&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46222679 104151547 CHEMBL1088354 ZINC49067651 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574295 C(CCCCC[n+]1ccc2c(c1)[nH]c1ccccc21)CCCC[n+]1ccc2c(c1)[nH]c1ccccc21 InChI=1S/C32H34N4/c1(3-5-11-19-35-21-17-27-25-13-7-9-15-29(25)33-31(27)23-35)2-4-6-12-20-36-22-18-28-26-14-8-10-16-30(26)34-32(28)24-36/h7-10,13-18,21-24H,1-6,11-12,19-20H2/p+2 NCYIKOJQXYAHBQ-UHFFFAOYSA-P 50317184 2-[10-(beta-Carboline-2-ium-2-yl)decyl]-beta-carboline-2-ium dibromide::CHEMBL1088656 Cholinesterase 49 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317184 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317184&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46222890 104151545 CHEMBL1088656 ZINC49066773 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574297 C(CCC[n+]1ccc2c(c1)[nH]c1ccccc21)CCC[n+]1ccc2c(c1)[nH]c1ccccc21 InChI=1S/C29H28N4/c1(2-8-16-32-18-14-24-22-10-4-6-12-26(22)30-28(24)20-32)3-9-17-33-19-15-25-23-11-5-7-13-27(23)31-29(25)21-33/h4-7,10-15,18-21H,1-3,8-9,16-17H2/p+2 SDPXNKGYSRXIBE-UHFFFAOYSA-P 50317185 2-[7-(beta-Carboline-2-ium-2-yl)heptyl]-beta-carboline-2-ium dibromide::CHEMBL1088722 Cholinesterase 65 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317185 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317185&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46222683 104151546 CHEMBL1088722 ZINC49066634 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574298 C(CCCC[n+]1ccc2c(c1)[nH]c1ccccc21)CCC[n+]1ccc2c(c1)[nH]c1ccccc21 InChI=1S/C30H30N4/c1(3-9-17-33-19-15-25-23-11-5-7-13-27(23)31-29(25)21-33)2-4-10-18-34-20-16-26-24-12-6-8-14-28(24)32-30(26)22-34/h5-8,11-16,19-22H,1-4,9-10,17-18H2/p+2 OBSHKXBSFJPWFE-UHFFFAOYSA-P 50317181 2-[8-(beta-Carboline-2-ium-2-yl)octyl]-beta-carboline-2-ium dibromide::CHEMBL1088654 Cholinesterase 76 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317181 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317181&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46223105 104151542 CHEMBL1088654 ZINC49112332 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579258 CCN(CC)Cc1ccc(OCCN2CCCCC2)cc1 InChI=1S/C18H30N2O/c1-3-19(4-2)16-17-8-10-18(11-9-17)21-15-14-20-12-6-5-7-13-20/h8-11H,3-7,12-16H2,1-2H3 YSGYMENPRIAWFW-UHFFFAOYSA-N 50319390 CHEMBL1086464::N-ethyl-N-(4-(2-(piperidin-1-yl)ethoxy)benzyl)ethanamine Cholinesterase 10100 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319390 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319390&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890555 104153751 CHEMBL1086464 ZINC49049712 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579259 CCN(CC)Cc1ccc(OCCN2CCN(C)CC2)cc1 InChI=1S/C18H31N3O/c1-4-20(5-2)16-17-6-8-18(9-7-17)22-15-14-21-12-10-19(3)11-13-21/h6-9H,4-5,10-16H2,1-3H3 HJHNSFAIVNLLMB-UHFFFAOYSA-N 50319391 CHEMBL1084563::N-ethyl-N-(4-(2-(4-methylpiperazin-1-yl)ethoxy)benzyl)ethanamine Cholinesterase 20270 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319391 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319391&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890554 104153752 CHEMBL1084563 ZINC49047481 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579260 CCN(CC)Cc1ccc(OCCCCN2CCCC2)cc1 InChI=1S/C19H32N2O/c1-3-20(4-2)17-18-9-11-19(12-10-18)22-16-8-7-15-21-13-5-6-14-21/h9-12H,3-8,13-17H2,1-2H3 YQCTUETUMMKYGA-UHFFFAOYSA-N 50319392 CHEMBL1082782::N-ethyl-N-(4-(4-(pyrrolidin-1-yl)butoxy)benzyl)ethanamine Cholinesterase 1400 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319392 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319392&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890593 104153753 CHEMBL1082782 ZINC49036375 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579261 CCN(CC)Cc1ccc(OCCCCN2CCCCC2)cc1 InChI=1S/C20H34N2O/c1-3-21(4-2)18-19-10-12-20(13-11-19)23-17-9-8-16-22-14-6-5-7-15-22/h10-13H,3-9,14-18H2,1-2H3 ZTSAIYAJCFOIDJ-UHFFFAOYSA-N 50319393 CHEMBL1083710::N-ethyl-N-(4-(4-(piperidin-1-yl)butoxy)benzyl)ethanamine Cholinesterase 710 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319393 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319393&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890556 104153754 CHEMBL1083710 ZINC49034663 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579262 CCN(CC)Cc1ccc(OCCCCN2CCN(C)CC2)cc1 InChI=1S/C20H35N3O/c1-4-22(5-2)18-19-8-10-20(11-9-19)24-17-7-6-12-23-15-13-21(3)14-16-23/h8-11H,4-7,12-18H2,1-3H3 AXHPPPQCABHOLG-UHFFFAOYSA-N 50319394 CHEMBL1083711::N-ethyl-N-(4-(4-(4-methylpiperazin-1-yl)butoxy)benzyl)ethanamine Cholinesterase 9730 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319394 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319394&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890557 104153755 CHEMBL1083711 ZINC49035271 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579263 CCN(CC)CCCCOc1ccc(CN(CC)CC)cc1 InChI=1S/C19H34N2O/c1-5-20(6-2)15-9-10-16-22-19-13-11-18(12-14-19)17-21(7-3)8-4/h11-14H,5-10,15-17H2,1-4H3 LKWSLXYXCKNLKD-UHFFFAOYSA-N 50319395 4-(4-((diethylamino)methyl)phenoxy)-N,N-diethylbutan-1-amine::CHEMBL1082783 Cholinesterase 2740 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319395 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319395&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890594 104153756 CHEMBL1082783 ZINC49034245 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579264 CCCN(CCC)CCCCOc1ccc(CN(CC)CC)cc1 InChI=1S/C21H38N2O/c1-5-15-23(16-6-2)17-9-10-18-24-21-13-11-20(12-14-21)19-22(7-3)8-4/h11-14H,5-10,15-19H2,1-4H3 JXDHMYKXSASXPJ-UHFFFAOYSA-N 50319396 4-(4-((diethylamino)methyl)phenoxy)-N,N-dipropylbutan-1-amine::CHEMBL1082784 Cholinesterase 11690 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319396 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319396&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890595 104153757 CHEMBL1082784 ZINC49036714 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579265 CCCCN(CCCC)CCCCOc1ccc(CN(CC)CC)cc1 InChI=1S/C23H42N2O/c1-5-9-17-25(18-10-6-2)19-11-12-20-26-23-15-13-22(14-16-23)21-24(7-3)8-4/h13-16H,5-12,17-21H2,1-4H3 HMZXNZBXXGPQEG-UHFFFAOYSA-N 50319397 CHEMBL1082785::N,N-dibutyl-4-(4-((diethylamino)methyl)phenoxy)butan-1-amine Cholinesterase 2520 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319397 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319397&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890596 104153758 CHEMBL1082785 ZINC49036716 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579266 CCN(CC)Cc1ccc(OCCCCCN2CCCC2)cc1 InChI=1S/C20H34N2O/c1-3-21(4-2)18-19-10-12-20(13-11-19)23-17-9-5-6-14-22-15-7-8-16-22/h10-13H,3-9,14-18H2,1-2H3 KKPXVGUQAVWREI-UHFFFAOYSA-N 50319398 CHEMBL1086036::N-ethyl-N-(4-(5-(pyrrolidin-1-yl)pentyloxy)benzyl)ethanamine Cholinesterase 1540 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319398 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319398&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890597 104153759 CHEMBL1086036 ZINC49048750 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579267 CCN(CC)Cc1ccc(OCCCCCN2CCCCC2)cc1 InChI=1S/C21H36N2O/c1-3-22(4-2)19-20-11-13-21(14-12-20)24-18-10-6-9-17-23-15-7-5-8-16-23/h11-14H,3-10,15-19H2,1-2H3 GOQLUTFOAOFDJZ-UHFFFAOYSA-N 50319399 CHEMBL1086037::N-ethyl-N-(4-(5-(piperidin-1-yl)pentyloxy)benzyl)ethanamine Cholinesterase 670 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319399 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319399&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890598 104153760 CHEMBL1086037 ZINC49048754 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579268 CCN(CC)Cc1ccc(OCCCCCN2CCN(C)CC2)cc1 InChI=1S/C21H37N3O/c1-4-23(5-2)19-20-9-11-21(12-10-20)25-18-8-6-7-13-24-16-14-22(3)15-17-24/h9-12H,4-8,13-19H2,1-3H3 SFDPMTGAVWLFTM-UHFFFAOYSA-N 50319400 CHEMBL1085573::N-ethyl-N-(4-(5-(4-methylpiperazin-1-yl)pentyloxy)benzyl)ethanamine Cholinesterase 9350 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319400 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319400&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890631 104153761 CHEMBL1085573 ZINC49046948 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579269 CCN(CC)Cc1ccc(OCCCCCN2CCN(CC)CC2)cc1 InChI=1S/C22H39N3O/c1-4-23(5-2)20-21-10-12-22(13-11-21)26-19-9-7-8-14-25-17-15-24(6-3)16-18-25/h10-13H,4-9,14-20H2,1-3H3 GNJQUDFEDYEQKH-UHFFFAOYSA-N 50319401 CHEMBL1085574::N-ethyl-N-(4-(5-(4-ethylpiperazin-1-yl)pentyloxy)benzyl)ethanamine Cholinesterase 3080 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319401 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319401&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890632 104153762 CHEMBL1085574 ZINC49109959 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579270 CCN(CC)CCCCCOc1ccc(CN(CC)CC)cc1 InChI=1S/C20H36N2O/c1-5-21(6-2)16-10-9-11-17-23-20-14-12-19(13-15-20)18-22(7-3)8-4/h12-15H,5-11,16-18H2,1-4H3 YYEPQRVDYRQJIH-UHFFFAOYSA-N 50319402 5-(4-((diethylamino)methyl)phenoxy)-N,N-diethylpentan-1-amine::CHEMBL1085575 Cholinesterase 4420 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319402 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319402&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890633 104153763 CHEMBL1085575 ZINC49046951 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579271 CCCN(CCC)CCCCCOc1ccc(CN(CC)CC)cc1 InChI=1S/C22H40N2O/c1-5-16-24(17-6-2)18-10-9-11-19-25-22-14-12-21(13-15-22)20-23(7-3)8-4/h12-15H,5-11,16-20H2,1-4H3 OWOMDRQZDXTUDA-UHFFFAOYSA-N 50319403 5-(4-((diethylamino)methyl)phenoxy)-N,N-dipropylpentan-1-amine::CHEMBL1085576 Cholinesterase 1780 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319403 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319403&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890634 104153764 CHEMBL1085576 ZINC49046955 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579272 CCCCN(CCCC)CCCCCOc1ccc(CN(CC)CC)cc1 InChI=1S/C24H44N2O/c1-5-9-18-26(19-10-6-2)20-12-11-13-21-27-24-16-14-23(15-17-24)22-25(7-3)8-4/h14-17H,5-13,18-22H2,1-4H3 HGBWOIVRBIPLJO-UHFFFAOYSA-N 50319404 CHEMBL1085801::N,N-dibutyl-5-(4-((diethylamino)methyl)phenoxy)pentan-1-amine Cholinesterase 1900 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890635 104153765 CHEMBL1085801 ZINC49050131 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579273 CCN(CC)Cc1ccc(OCCCCCCN2CCCC2)cc1 InChI=1S/C21H36N2O/c1-3-22(4-2)19-20-11-13-21(14-12-20)24-18-10-6-5-7-15-23-16-8-9-17-23/h11-14H,3-10,15-19H2,1-2H3 HOYGAXAMLMNITI-UHFFFAOYSA-N 50319405 CHEMBL1083273::N-ethyl-N-(4-(6-(pyrrolidin-1-yl)hexyloxy)benzyl)ethanamine Cholinesterase 1280 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319405 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319405&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890678 104153766 CHEMBL1083273 ZINC49050119 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579274 CCN(CC)Cc1ccc(OCCCCCCN2CCCCC2)cc1 InChI=1S/C22H38N2O/c1-3-23(4-2)20-21-12-14-22(15-13-21)25-19-11-6-5-8-16-24-17-9-7-10-18-24/h12-15H,3-11,16-20H2,1-2H3 SUYMMQMOZJGWJT-UHFFFAOYSA-N 50319406 CHEMBL1084831::N-ethyl-N-(4-(6-(piperidin-1-yl)hexyloxy)benzyl)ethanamine Cholinesterase 1370 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319406 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319406&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890679 104153767 CHEMBL1084831 ZINC49035347 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579275 CCN(CC)Cc1ccc(OCCCCCCN2CCN(C)CC2)cc1 InChI=1S/C22H39N3O/c1-4-24(5-2)20-21-10-12-22(13-11-21)26-19-9-7-6-8-14-25-17-15-23(3)16-18-25/h10-13H,4-9,14-20H2,1-3H3 DBQPVZOFHMFYNX-UHFFFAOYSA-N 50319407 CHEMBL1084832::N-ethyl-N-(4-(6-(4-methylpiperazin-1-yl)hexyloxy)benzyl)ethanamine Cholinesterase 3760 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319407 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319407&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890680 104153768 CHEMBL1084832 ZINC49035349 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579276 CCN(CC)Cc1ccc(OCCCCCCN2CCN(CC)CC2)cc1 InChI=1S/C23H41N3O/c1-4-24(5-2)21-22-11-13-23(14-12-22)27-20-10-8-7-9-15-26-18-16-25(6-3)17-19-26/h11-14H,4-10,15-21H2,1-3H3 XZPGIQUZCJGMEY-UHFFFAOYSA-N 50319408 CHEMBL1083431::N-ethyl-N-(4-(6-(4-ethylpiperazin-1-yl)hexyloxy)benzyl)ethanamine Cholinesterase 2200 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319408 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319408&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890681 104153769 CHEMBL1083431 ZINC49037397 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579277 CCN(CC)CCCCCCOc1ccc(CN(CC)CC)cc1 InChI=1S/C21H38N2O/c1-5-22(6-2)17-11-9-10-12-18-24-21-15-13-20(14-16-21)19-23(7-3)8-4/h13-16H,5-12,17-19H2,1-4H3 PNTWMBOXHYUHLX-UHFFFAOYSA-N 50319409 6-(4-((diethylamino)methyl)phenoxy)-N,N-diethylhexan-1-amine::CHEMBL1083432 Cholinesterase 1660 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319409 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319409&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890682 104153770 CHEMBL1083432 ZINC49037400 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574299 C(CC[n+]1ccc2c(c1)[nH]c1ccccc21)C[n+]1ccc2c(c1)[nH]c1ccccc21 InChI=1S/C26H22N4/c1-3-9-23-19(7-1)21-11-15-29(17-25(21)27-23)13-5-6-14-30-16-12-22-20-8-2-4-10-24(20)28-26(22)18-30/h1-4,7-12,15-18H,5-6,13-14H2/p+2 KYDMGUUGVFJGOH-UHFFFAOYSA-P 50317194 2-[4-(beta-Carboline-2-ium-2-yl)butyl]-beta-carboline-2-ium dibromide::CHEMBL1088353 Cholinesterase 78 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317194 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317194&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46222677 104151555 CHEMBL1088353 ZINC49110411 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574306 C(CCC[n+]1ccc2c(c1)[nH]c1ccccc21)CC[n+]1ccc2c(c1)[nH]c1ccccc21 InChI=1S/C28H26N4/c1(7-15-31-17-13-23-21-9-3-5-11-25(21)29-27(23)19-31)2-8-16-32-18-14-24-22-10-4-6-12-26(22)30-28(24)20-32/h3-6,9-14,17-20H,1-2,7-8,15-16H2/p+2 MSKHZKJIIIDYDG-UHFFFAOYSA-P 50317180 2-[6-(beta-Carboline-2-ium-2-yl)hexyl]-beta-carboline-2-ium dibromide::CHEMBL1088355 Cholinesterase 186 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317180 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317180&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46222681 104151541 CHEMBL1088355 ZINC49067653 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574307 C(COCC[n+]1ccc2c(c1)[nH]c1ccccc21)OCCOCC[n+]1ccc2c(c1)[nH]c1ccccc21 InChI=1S/C30H30N4O3/c1-3-7-27-23(5-1)25-9-11-33(21-29(25)31-27)13-15-35-17-19-37-20-18-36-16-14-34-12-10-26-24-6-2-4-8-28(24)32-30(26)22-34/h1-12,21-22H,13-20H2/p+2 BZSDSYSGDUHDMQ-UHFFFAOYSA-P 50317191 2-[2-(2-{2-[2-(beta-Carboline-2-ium-2-yl)ethoxy]ethoxy}ethoxy)ethyl]-beta-carboline-2-ium dibromide::CHEMBL1088378 Cholinesterase 195 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317191 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317191&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46222226 104151552 CHEMBL1088378 ZINC49068458 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574311 C(C[n+]1ccc2c(c1)[nH]c1ccccc21)[n+]1ccc2c(c1)[nH]c1ccccc21 InChI=1S/C24H18N4/c1-3-7-21-17(5-1)19-9-11-27(15-23(19)25-21)13-14-28-12-10-20-18-6-2-4-8-22(18)26-24(20)16-28/h1-12,15-16H,13-14H2/p+2 NRXOIERIBIBJQI-UHFFFAOYSA-P 50317196 2-[2-(beta-Carboline-2-ium-2-yl)ethyl]-beta-carboline-2-ium dibromide::CHEMBL1088352 Cholinesterase 319 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317196 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317196&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46222453 104151557 CHEMBL1088352 ZINC49067489 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574312 COc1ccc2[nH]c3c[n+](CCCCC[n+]4ccc5c(c4)[nH]c4ccc(OC)cc54)ccc3c2c1 InChI=1S/C29H28N4O2/c1-34-20-6-8-26-24(16-20)22-10-14-32(18-28(22)30-26)12-4-3-5-13-33-15-11-23-25-17-21(35-2)7-9-27(25)31-29(23)19-33/h6-11,14-19H,3-5,12-13H2,1-2H3/p+2 SKXHDGSZNSAVDC-UHFFFAOYSA-P 50317187 6-Methoxy-2-[5-(6-methoxy-beta-carboline-2-ium-2-yl)pentyl]-beta-carboline-2-ium dibromide::CHEMBL1094554 Cholinesterase 319 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317187 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317187&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46222675 104151548 CHEMBL1094554 ZINC49073521 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574314 C(c1ccc(C[n+]2ccc3c(c2)[nH]c2ccccc32)cc1)[n+]1ccc2c(c1)[nH]c1ccccc21 InChI=1S/C30H22N4/c1-3-7-27-23(5-1)25-13-15-33(19-29(25)31-27)17-21-9-11-22(12-10-21)18-34-16-14-26-24-6-2-4-8-28(24)32-30(26)20-34/h1-16,19-20H,17-18H2/p+2 FGVYROVTAMNWAF-UHFFFAOYSA-P 50317195 2-[4-(beta-Carboline-2-ium-2-ylmethyl)benzyl]-beta-carboline-2-ium dibromide::CHEMBL1094553 Cholinesterase 439 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317195 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317195&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46222228 104151556 CHEMBL1094553 ZINC49073519 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574315 C[n+]1ccc2c(c1)[nH]c1ccccc21 InChI=1S/C12H10N2/c1-14-7-6-10-9-4-2-3-5-11(9)13-12(10)8-14/h2-8H,1H3/p+1 UDHBHTHWWOQPBW-UHFFFAOYSA-O 50269614 2-Methyl-beta-carboline-2-ium iodide::2-methyl-2H-pyrido[3,4-b]indole hydroiodide::2-methylnorharmane iodide::CHEMBL455600 Cholinesterase 540 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50269614 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50269614&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3036890 104115231 CHEMBL455600 ZINC00394500 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574319 C(C[n+]1ccc2c(c1)[nH]c1ccccc21)C[n+]1ccc2c(c1)[nH]c1ccccc21 InChI=1S/C25H20N4/c1-3-8-22-18(6-1)20-10-14-28(16-24(20)26-22)12-5-13-29-15-11-21-19-7-2-4-9-23(19)27-25(21)17-29/h1-4,6-11,14-17H,5,12-13H2/p+2 UXACSAKKMWLIIJ-UHFFFAOYSA-P 50317189 2-[3-(beta-Carboline-2-ium-2-yl)propyl]-beta-carboline-2-ium dibromide::CHEMBL1088224 Cholinesterase 652 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317189 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317189&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46222455 104151550 CHEMBL1088224 ZINC49068439 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574321 Oc1ccc2[nH]c3c[n+](CCCCC[n+]4ccc5c(c4)[nH]c4ccc(O)cc54)ccc3c2c1 InChI=1S/C27H24N4O2/c32-18-4-6-24-22(14-18)20-8-12-30(16-26(20)28-24)10-2-1-3-11-31-13-9-21-23-15-19(33)5-7-25(23)29-27(21)17-31/h4-9,12-17,32-33H,1-3,10-11H2/p+2 QTLHQXUXMHHSTK-UHFFFAOYSA-P 50317190 6-Hydroxy-2-[5-(6-hydroxy-beta-carboline-2-ium-2-yl)pentyl]-beta-carboline-2-ium dibromide::CHEMBL1096868 Cholinesterase 1629 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317190 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317190&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46222446 104151551 CHEMBL1096868 ZINC49089606 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574322 CCn1c2ccccc2c2cc[n+](C)cc12 InChI=1S/C14H15N2/c1-3-16-13-7-5-4-6-11(13)12-8-9-15(2)10-14(12)16/h4-10H,3H2,1-2H3/q+1 UYPDJRFFVNWZQV-UHFFFAOYSA-N 50317199 9-Ethyl-2-methyl-beta-carboline-2-ium iodide::CHEMBL1097826 Cholinesterase 2019 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317199 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317199&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46223108 104151560 CHEMBL1097826 ZINC49784922 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574323 CCC[n+]1ccc2c(c1)[nH]c1ccccc21 InChI=1S/C14H14N2/c1-2-8-16-9-7-12-11-5-3-4-6-13(11)15-14(12)10-16/h3-7,9-10H,2,8H2,1H3/p+1 SFUAYJFEBSOZSQ-UHFFFAOYSA-O 50317198 2-Propyl-beta-carboline-2-ium iodide::CHEMBL1088723 Cholinesterase 2305 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317198 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317198&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46889203 104151559 CHEMBL1088723 ZINC19908979 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574325 C(CCCCCN1CCc2c(C1)[nH]c1ccccc21)CCCCN1CCc2c(C1)[nH]c1ccccc21 InChI=1S/C32H42N4/c1(3-5-11-19-35-21-17-27-25-13-7-9-15-29(25)33-31(27)23-35)2-4-6-12-20-36-22-18-28-26-14-8-10-16-30(26)34-32(28)24-36/h7-10,13-16,33-34H,1-6,11-12,17-24H2 MPNMJERUXOWHCO-UHFFFAOYSA-N 50317200 2-[10-(1,2,3,4-Tetrahydro-beta-carboline-2-yl)decyl]-1,2,3,4-tetrahydro-beta-carboline::CHEMBL1097508 Cholinesterase 2895 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317200 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317200&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46223107 104151561 CHEMBL1097508 ZINC49088933 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574328 C(CCC[n+]1ccc2c(c1)[nH]c1ccccc21)CC[n+]1ccccc1 InChI=1S/C22H24N3/c1(6-13-24-14-8-3-9-15-24)2-7-16-25-17-12-20-19-10-4-5-11-21(19)23-22(20)18-25/h3-5,8-12,14-15,17-18H,1-2,6-7,13,16H2/q+1/p+1 ITGJRHQRAUMBLB-UHFFFAOYSA-O 50317197 2-(6-Pyridinium-1-yl-hexyl)-beta-carboline-2-ium dibromide::CHEMBL1097509 Cholinesterase 6331 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317197 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317197&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46222448 104151558 CHEMBL1097509 ZINC49784443 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574330 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 8404 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574331 C(CCN1CCc2c(C1)[nH]c1ccccc21)CCN1CCc2c(C1)[nH]c1ccccc21 InChI=1S/C27H32N4/c1(6-14-30-16-12-22-20-8-2-4-10-24(20)28-26(22)18-30)7-15-31-17-13-23-21-9-3-5-11-25(21)29-27(23)19-31/h2-5,8-11,28-29H,1,6-7,12-19H2 CVHWKCBSOHTLIK-UHFFFAOYSA-N 50317201 2-[5-(1,2,3,4-Tetrahydro-beta-carboline-2-yl)pentyl]-1,2,3,4-tetrahydro-bweta-carboline::CHEMBL1096869 Cholinesterase >1000 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317201 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317201&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46222896 104151562 CHEMBL1096869 ZINC49089140 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574332 C(CCn1c2ccccc2c2ccncc12)CCn1c2ccccc2c2ccncc12 InChI=1S/C27H24N4/c1(6-16-30-24-10-4-2-8-20(24)22-12-14-28-18-26(22)30)7-17-31-25-11-5-3-9-21(25)23-13-15-29-19-27(23)31/h2-5,8-15,18-19H,1,6-7,16-17H2 MRZCXQWEBCLSNO-UHFFFAOYSA-N 50317202 9-[5-(beta-Carboline-9-yl)pentyl]-beta-carboline::CHEMBL1098470 Cholinesterase >1000 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317202 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317202&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46223112 104151563 CHEMBL1098470 ZINC49088077 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574333 C(CCCCn1c2ccccc2c2ccncc12)CCCCn1c2ccccc2c2ccncc12 InChI=1S/C31H32N4/c1(2-4-10-20-34-28-14-8-6-12-24(28)26-16-18-32-22-30(26)34)3-5-11-21-35-29-15-9-7-13-25(29)27-17-19-33-23-31(27)35/h6-9,12-19,22-23H,1-5,10-11,20-21H2 JJAATQLWMKLMJU-UHFFFAOYSA-N 50317203 9-[9-(beta-Carboline-9-yl)nonyl]-beta-carboline::CHEMBL1098471 Cholinesterase >1000 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317203 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317203&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46223113 104151564 CHEMBL1098471 ZINC49088209 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574345 C(CCC[n+]1ccccc1)CC[n+]1ccccc1 InChI=1S/C16H22N2/c1(5-11-17-13-7-3-8-14-17)2-6-12-18-15-9-4-10-16-18/h3-4,7-10,13-16H,1-2,5-6,11-12H2/q+2 WUAWIFPABARFIQ-UHFFFAOYSA-N 50119784 1-[6-(1lambda~5~-pyridin-1-yl)hexyl]-1lambda~5~-pyridine;diiodide::CHEMBL104381::CHEMBL389283 Cholinesterase >10000 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50119784 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50119784&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3041341 104012915 CHEMBL389283CHEMBL104381 ZINC05583130 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574346 CCn1c2ccccc2c2ccncc12 InChI=1S/C13H12N2/c1-2-15-12-6-4-3-5-10(12)11-7-8-14-9-13(11)15/h3-9H,2H2,1H3 BMGUCVPPDGYFRV-UHFFFAOYSA-N 50317204 9-Ethyl-beta-carboline::CHEMBL1097825 Cholinesterase >10000 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317204 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317204&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14221745 104151565 CHEMBL1097825 ZINC34252790 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574347 C(CCCCCCn1c2ccccc2c2ccncc12)CCCCCn1c2ccccc2c2ccncc12 InChI=1S/C34H38N4/c1(3-5-7-13-23-37-31-17-11-9-15-27(31)29-19-21-35-25-33(29)37)2-4-6-8-14-24-38-32-18-12-10-16-28(32)30-20-22-36-26-34(30)38/h9-12,15-22,25-26H,1-8,13-14,23-24H2 UZFJUZQFALEJDM-UHFFFAOYSA-N 50317205 9-[12beta-Carboline-9-yl)dodecyl]-beta-carboline::CHEMBL1097540 Cholinesterase >10000 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317205 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317205&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46223567 104151566 CHEMBL1097540 ZINC49089120 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574348 CC12CC3CC(C)(C1)CC(N)(C3)C2 InChI=1S/C12H21N/c1-10-3-9-4-11(2,6-10)8-12(13,5-9)7-10/h9H,3-8,13H2,1-2H3 BUGYDGFZZOZRHP-UHFFFAOYSA-N 50062599 3,5-Dimethyl-adamantan-1-ylamine::CHEMBL807::MEMANTINE::Namenda::US10214478, Compound memantine Cholinesterase >10000 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50062599 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50062599&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 377 7SAD,4TWD 4054 103958122 64312 CHEMBL807 DB01043 4253 C13736 ZINC12402582 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574349 CNC1(CCCCC1=O)c1ccccc1Cl InChI=1S/C13H16ClNO/c1-15-13(9-5-4-8-12(13)16)10-6-2-3-7-11(10)14/h2-3,6-7,15H,4-5,8-9H2,1H3 YQEZLKZALYSWHR-UHFFFAOYSA-N 50044140 2-(2-Chloro-phenyl)-2-methylamino-cyclohexanone::2-(2-Chloro-phenyl)-2-methylamino-cyclohexanone(Ketamine)::CHEMBL742::KETAMINE::Ketalar Cholinesterase >10000 ChEMBL 10.1021/jm1000024 10.7270/Q2SJ1KS0 20361801 Rook, Y; Schmidtke, KU; Gaube, F; Schepmann, D; Wunsch, B; Heilmann, J; Lehmann, J; Winckler, T Friedrich-Schiller-Universitat Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50044140 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50044140&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search RKE 7SAC,7EU8,7EU7 3821 103975488 6121 CHEMBL742 DB01221 4233 C07843 ZINC36294079 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50561688 CCCCCCOC(=O)[C@H](CCC(=O)NCCC1CCN(Cc2ccccc2)CC1)NC(=O)OC(C)(C)C InChI=1S/C30H49N3O5/c1-5-6-7-11-22-37-28(35)26(32-29(36)38-30(2,3)4)14-15-27(34)31-19-16-24-17-20-33(21-18-24)23-25-12-9-8-10-13-25/h8-10,12-13,24,26H,5-7,11,14-23H2,1-4H3,(H,31,34)(H,32,36)/t26-/m0/s1 MZBCWMLDVRAXQY-SANMLTNESA-N 50311994 (S)-hexyl 5-(2-(1-benzylpiperidin-4-yl)ethylamino)-2-(tert-butoxycarbonylamino)-5-oxopentanoate::CHEMBL1082081 Cholinesterase 3500 ChEMBL 10.1021/jm900628z 10.7270/Q2668DB1 19856923 Arce, MP; Rodriguez-Franco, MI; Gonzalez-Munoz, GC; Perez, C; Lopez, B; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S Instituto de Quimica Medica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50311994 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50311994&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44550606 104146355 CHEMBL1082081 ZINC43205434 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50561689 CCCCCCOC(=O)[C@H](CCC(=O)NCCC1CCN(Cc2ccccc2)CC1)NC(=O)OCc1ccccc1 InChI=1S/C33H47N3O5/c1-2-3-4-11-24-40-32(38)30(35-33(39)41-26-29-14-9-6-10-15-29)16-17-31(37)34-21-18-27-19-22-36(23-20-27)25-28-12-7-5-8-13-28/h5-10,12-15,27,30H,2-4,11,16-26H2,1H3,(H,34,37)(H,35,39)/t30-/m0/s1 MHODVJVESFLWQL-PMERELPUSA-N 50311995 (S)-hexyl 2-(benzyloxycarbonylamino)-5-(2-(1-benzylpiperidin-4-yl)ethylamino)-5-oxopentanoate::CHEMBL1082082 Cholinesterase 750 ChEMBL 10.1021/jm900628z 10.7270/Q2668DB1 19856923 Arce, MP; Rodriguez-Franco, MI; Gonzalez-Munoz, GC; Perez, C; Lopez, B; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S Instituto de Quimica Medica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50311995 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50311995&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44550607 104146356 CHEMBL1082082 ZINC49775725 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50561690 CCCCCCOC(=O)[C@H](CCC(=O)NCCC1CCN(Cc2ccccc2)CC1)NC(=O)Cc1cc2ccc(Cl)cc2s1 InChI=1S/C35H46ClN3O4S/c1-2-3-4-8-21-43-35(42)31(38-34(41)24-30-22-28-11-12-29(36)23-32(28)44-30)13-14-33(40)37-18-15-26-16-19-39(20-17-26)25-27-9-6-5-7-10-27/h5-7,9-12,22-23,26,31H,2-4,8,13-21,24-25H2,1H3,(H,37,40)(H,38,41)/t31-/m0/s1 IZQYFZRXSFVMFI-HKBQPEDESA-N 50311996 (S)-hexyl 5-(2-(1-benzylpiperidin-4-yl)ethylamino)-2-(2-(6-chlorobenzo[b]thiophen-2-yl)acetamido)-5-oxopentanoate::CHEMBL1076243 Cholinesterase 50 ChEMBL 10.1021/jm900628z 10.7270/Q2668DB1 19856923 Arce, MP; Rodriguez-Franco, MI; Gonzalez-Munoz, GC; Perez, C; Lopez, B; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S Instituto de Quimica Medica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50311996 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50311996&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44550608 104146357 CHEMBL1076243 ZINC49882002 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50561691 CCCCCCOC(=O)[C@H](CCC(=O)NCCC1CCN(Cc2ccccc2)CC1)NC(=O)c1ccccc1 InChI=1S/C32H45N3O4/c1-2-3-4-11-24-39-32(38)29(34-31(37)28-14-9-6-10-15-28)16-17-30(36)33-21-18-26-19-22-35(23-20-26)25-27-12-7-5-8-13-27/h5-10,12-15,26,29H,2-4,11,16-25H2,1H3,(H,33,36)(H,34,37)/t29-/m0/s1 XFEJPTLRXOZZDA-LJAQVGFWSA-N 50311997 (S)-hexyl 2-benzamido-5-(2-(1-benzylpiperidin-4-yl)ethylamino)-5-oxopentanoate::CHEMBL1080631 Cholinesterase 1500 ChEMBL 10.1021/jm900628z 10.7270/Q2668DB1 19856923 Arce, MP; Rodriguez-Franco, MI; Gonzalez-Munoz, GC; Perez, C; Lopez, B; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S Instituto de Quimica Medica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50311997 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50311997&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44550725 104146358 CHEMBL1080631 ZINC49033325 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50561692 CCCCCCOC(=O)[C@H](CCC(=O)NCCC1CCN(Cc2ccccc2)CC1)NC(=O)c1cccs1 InChI=1S/C30H43N3O4S/c1-2-3-4-8-21-37-30(36)26(32-29(35)27-12-9-22-38-27)13-14-28(34)31-18-15-24-16-19-33(20-17-24)23-25-10-6-5-7-11-25/h5-7,9-12,22,24,26H,2-4,8,13-21,23H2,1H3,(H,31,34)(H,32,35)/t26-/m0/s1 OCZMNYKUZZMGJF-SANMLTNESA-N 50311998 (S)-hexyl 5-(2-(1-benzylpiperidin-4-yl)ethylamino)-5-oxo-2-(thiophene-2-carboxamido)pentanoate::CHEMBL1080813 Cholinesterase 1000 ChEMBL 10.1021/jm900628z 10.7270/Q2668DB1 19856923 Arce, MP; Rodriguez-Franco, MI; Gonzalez-Munoz, GC; Perez, C; Lopez, B; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S Instituto de Quimica Medica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50311998 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50311998&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44550726 104146359 CHEMBL1080813 ZINC43205437 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50561693 CCCCCCOC(=O)[C@H](CCC(=O)NCCC1CCN(Cc2ccccc2)CC1)NC(=O)c1cc(Br)cs1 InChI=1S/C30H42BrN3O4S/c1-2-3-4-8-19-38-30(37)26(33-29(36)27-20-25(31)22-39-27)11-12-28(35)32-16-13-23-14-17-34(18-15-23)21-24-9-6-5-7-10-24/h5-7,9-10,20,22-23,26H,2-4,8,11-19,21H2,1H3,(H,32,35)(H,33,36)/t26-/m0/s1 RRISCGLVYBLGLP-SANMLTNESA-N 50311999 (S)-hexyl 5-(2-(1-benzylpiperidin-4-yl)ethylamino)-2-(4-bromothiophene-2-carboxamido)-5-oxopentanoate::CHEMBL1080814 Cholinesterase 750 ChEMBL 10.1021/jm900628z 10.7270/Q2668DB1 19856923 Arce, MP; Rodriguez-Franco, MI; Gonzalez-Munoz, GC; Perez, C; Lopez, B; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S Instituto de Quimica Medica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50311999 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50311999&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44550727 104146360 CHEMBL1080814 ZINC43205439 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50561694 CCCCCCOC(=O)[C@H](CCC(=O)NCCC1CCN(Cc2ccccc2)CC1)NC(=O)c1cc2ccccc2s1 InChI=1S/C34H45N3O4S/c1-2-3-4-10-23-41-34(40)29(36-33(39)31-24-28-13-8-9-14-30(28)42-31)15-16-32(38)35-20-17-26-18-21-37(22-19-26)25-27-11-6-5-7-12-27/h5-9,11-14,24,26,29H,2-4,10,15-23,25H2,1H3,(H,35,38)(H,36,39)/t29-/m0/s1 SDWSXUZGRDKRFJ-LJAQVGFWSA-N 50312000 (S)-hexyl 2-(benzo[b]thiophene-2-carboxamido)-5-(2-(1-benzylpiperidin-4-yl)ethylamino)-5-oxopentanoate::CHEMBL1076259 Cholinesterase 550 ChEMBL 10.1021/jm900628z 10.7270/Q2668DB1 19856923 Arce, MP; Rodriguez-Franco, MI; Gonzalez-Munoz, GC; Perez, C; Lopez, B; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S Instituto de Quimica Medica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50312000 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50312000&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44550728 104146361 CHEMBL1076259 ZINC49777924 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50561695 CCCCCCOC(=O)[C@H](CCC(=O)NCCC1CCN(Cc2ccccc2)CC1)NC(=O)c1cc2cccnc2s1 InChI=1S/C33H44N4O4S/c1-2-3-4-8-22-41-33(40)28(36-31(39)29-23-27-12-9-18-35-32(27)42-29)13-14-30(38)34-19-15-25-16-20-37(21-17-25)24-26-10-6-5-7-11-26/h5-7,9-12,18,23,25,28H,2-4,8,13-17,19-22,24H2,1H3,(H,34,38)(H,36,39)/t28-/m0/s1 QRZGIZWNQIUSQZ-NDEPHWFRSA-N 50312001 (S)-hexyl 5-(2-(1-benzylpiperidin-4-yl)ethylamino)-5-oxo-2-(thieno[2,3-b]pyridine-2-carboxamido)pentanoate::CHEMBL1076260 Cholinesterase 950 ChEMBL 10.1021/jm900628z 10.7270/Q2668DB1 19856923 Arce, MP; Rodriguez-Franco, MI; Gonzalez-Munoz, GC; Perez, C; Lopez, B; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S Instituto de Quimica Medica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50312001 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50312001&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44550729 104146362 CHEMBL1076260 ZINC43205432 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50561696 CCCCCCOC(=O)[C@H](CCC(=O)NCCC1CCN(Cc2ccccc2)CC1)NC(=O)c1cc2ccsc2s1 InChI=1S/C32H43N3O4S2/c1-2-3-4-8-20-39-31(38)27(34-30(37)28-22-26-16-21-40-32(26)41-28)11-12-29(36)33-17-13-24-14-18-35(19-15-24)23-25-9-6-5-7-10-25/h5-7,9-10,16,21-22,24,27H,2-4,8,11-15,17-20,23H2,1H3,(H,33,36)(H,34,37)/t27-/m0/s1 ONGQTEYIIKGJGV-MHZLTWQESA-N 50312002 (S)-hexyl 5-(2-(1-benzylpiperidin-4-yl)ethylamino)-5-oxo-2-(thieno[2,3-b]thiophene-2-carboxamido)pentanoate::CHEMBL1080274 Cholinesterase 700 ChEMBL 10.1021/jm900628z 10.7270/Q2668DB1 19856923 Arce, MP; Rodriguez-Franco, MI; Gonzalez-Munoz, GC; Perez, C; Lopez, B; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S Instituto de Quimica Medica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50312002 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50312002&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44550849 104146363 CHEMBL1080274 ZINC43205436 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50561697 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 10 ChEMBL 10.1021/jm900628z 10.7270/Q2668DB1 19856923 Arce, MP; Rodriguez-Franco, MI; Gonzalez-Munoz, GC; Perez, C; Lopez, B; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S Instituto de Quimica Medica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50557631 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCCOc1ccccc1 InChI=1S/C29H28NO5/c1-31-26-10-9-20-15-25-23-17-28-27(34-19-35-28)16-21(23)11-12-30(25)18-24(20)29(26)33-14-6-5-13-32-22-7-3-2-4-8-22/h2-4,7-10,15-18H,5-6,11-14,19H2,1H3/q+1 BKMOSBYJXKOCTP-UHFFFAOYSA-N 50310278 9-O-[4-(Phenylol-1-yloxy)butyl]berberine bromide::CHEMBL602861 Cholinesterase 4890 ChEMBL 10.1016/j.bmc.2009.12.035 10.7270/Q2D50N2T 20056426 Huang, L; Shi, A; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50310278 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50310278&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46232037 104144639 CHEMBL602861 ZINC45392440 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50557635 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCOc1ccccc1 InChI=1S/C27H24NO5/c1-29-24-8-7-18-13-23-21-15-26-25(32-17-33-26)14-19(21)9-10-28(23)16-22(18)27(24)31-12-11-30-20-5-3-2-4-6-20/h2-8,13-16H,9-12,17H2,1H3/q+1 BTWWJBNJLCMOGS-UHFFFAOYSA-N 50310282 9-O-[2-(Phenylol-1-yloxy)ethyl]berberine bromide::CHEMBL602662 Cholinesterase 3000 ChEMBL 10.1016/j.bmc.2009.12.035 10.7270/Q2D50N2T 20056426 Huang, L; Shi, A; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50310282 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50310282&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46232033 104144643 CHEMBL602662 ZINC45371334 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50557640 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCCCOn1nnc2ccccc12 InChI=1S/C30H29N4O5/c1-35-27-10-9-20-15-26-22-17-29-28(37-19-38-29)16-21(22)11-12-33(26)18-23(20)30(27)36-13-5-2-6-14-39-34-25-8-4-3-7-24(25)31-32-34/h3-4,7-10,15-18H,2,5-6,11-14,19H2,1H3/q+1 UMTBRMDRPUVBCN-UHFFFAOYSA-N 50310279 9-O-[5-(Benzotriazole-1-yloxy)pentyl]berberine bromide::CHEMBL600182 Cholinesterase 2490 ChEMBL 10.1016/j.bmc.2009.12.035 10.7270/Q2D50N2T 20056426 Huang, L; Shi, A; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50310279 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50310279&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46232029 104144640 CHEMBL600182 ZINC45370522 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50557641 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCCCCOn1nnc2ccccc12 InChI=1S/C31H31N4O5/c1-36-28-11-10-21-16-27-23-18-30-29(38-20-39-30)17-22(23)12-13-34(27)19-24(21)31(28)37-14-6-2-3-7-15-40-35-26-9-5-4-8-25(26)32-33-35/h4-5,8-11,16-19H,2-3,6-7,12-15,20H2,1H3/q+1 GSHNYYPZZXZVAM-UHFFFAOYSA-N 50310286 9-O-[6-(Benzotriazole-1-yloxy)hexyl]berberine bromide::CHEMBL592644 Cholinesterase 2830 ChEMBL 10.1016/j.bmc.2009.12.035 10.7270/Q2D50N2T 20056426 Huang, L; Shi, A; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50310286 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50310286&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46232031 104144647 CHEMBL592644 ZINC49757340 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50557642 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCCCCOc1ccccc1 InChI=1S/C31H32NO5/c1-33-28-12-11-22-17-27-25-19-30-29(36-21-37-30)18-23(25)13-14-32(27)20-26(22)31(28)35-16-8-3-2-7-15-34-24-9-5-4-6-10-24/h4-6,9-12,17-20H,2-3,7-8,13-16,21H2,1H3/q+1 LXNXNTQFJHYTEN-UHFFFAOYSA-N 50310283 9-O-[2-(Phenylol-1-yloxy)hexyl]berberine bromide::CHEMBL605344 Cholinesterase 4180 ChEMBL 10.1016/j.bmc.2009.12.035 10.7270/Q2D50N2T 20056426 Huang, L; Shi, A; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50310283 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50310283&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46232101 104144644 CHEMBL605344 ZINC45386567 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50557644 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCCCOc1ccccc1 InChI=1S/C30H30NO5/c1-32-27-11-10-21-16-26-24-18-29-28(35-20-36-29)17-22(24)12-13-31(26)19-25(21)30(27)34-15-7-3-6-14-33-23-8-4-2-5-9-23/h2,4-5,8-11,16-19H,3,6-7,12-15,20H2,1H3/q+1 DIJNAHNGFYBCMU-UHFFFAOYSA-N 50310288 9-O-[5-(Phenylol-1-yloxy)pentyl]berberine bromide::CHEMBL598528 Cholinesterase 2690 ChEMBL 10.1016/j.bmc.2009.12.035 10.7270/Q2D50N2T 20056426 Huang, L; Shi, A; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50310288 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50310288&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46232099 104144649 CHEMBL598528 ZINC45355990 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50557645 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCOc1ccccc1 InChI=1S/C28H26NO5/c1-30-25-9-8-19-14-24-22-16-27-26(33-18-34-27)15-20(22)10-11-29(24)17-23(19)28(25)32-13-5-12-31-21-6-3-2-4-7-21/h2-4,6-9,14-17H,5,10-13,18H2,1H3/q+1 GGIRCXOFADOIHD-UHFFFAOYSA-N 50310289 9-O-[3-(Phenylol-1-yloxy)propyl]berberine bromide::CHEMBL602663 Cholinesterase 2220 ChEMBL 10.1016/j.bmc.2009.12.035 10.7270/Q2D50N2T 20056426 Huang, L; Shi, A; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50310289 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50310289&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46232035 104144650 CHEMBL602663 ZINC45374090 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50557646 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCOn1nnc2ccccc12 InChI=1S/C27H23N4O5/c1-32-24-7-6-17-12-23-19-14-26-25(34-16-35-26)13-18(19)8-9-30(23)15-20(17)27(24)33-10-11-36-31-22-5-3-2-4-21(22)28-29-31/h2-7,12-15H,8-11,16H2,1H3/q+1 XBCYGEINQZRORJ-UHFFFAOYSA-N 50310290 9-O-[2-(Benzotriazole-1-yloxy)ethyl]berberine bromide::CHEMBL600586 Cholinesterase 2480 ChEMBL 10.1016/j.bmc.2009.12.035 10.7270/Q2D50N2T 20056426 Huang, L; Shi, A; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50310290 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50310290&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46231962 104144651 CHEMBL600586 ZINC45373441 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50557647 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCCOn1nnc2ccccc12 InChI=1S/C29H27N4O5/c1-34-26-9-8-19-14-25-21-16-28-27(36-18-37-28)15-20(21)10-11-32(25)17-22(19)29(26)35-12-4-5-13-38-33-24-7-3-2-6-23(24)30-31-33/h2-3,6-9,14-17H,4-5,10-13,18H2,1H3/q+1 MZZPMVBQGDJLAE-UHFFFAOYSA-N 50310291 9-O-[4-(Benzotriazole-1-yloxy)butyl]berberine bromide::CHEMBL600587 Cholinesterase 4170 ChEMBL 10.1016/j.bmc.2009.12.035 10.7270/Q2D50N2T 20056426 Huang, L; Shi, A; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50310291 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50310291&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46231966 104144652 CHEMBL600587 ZINC45373444 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50557648 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCOn1nnc2ccccc12 InChI=1S/C28H25N4O5/c1-33-25-8-7-18-13-24-20-15-27-26(35-17-36-27)14-19(20)9-10-31(24)16-21(18)28(25)34-11-4-12-37-32-23-6-3-2-5-22(23)29-30-32/h2-3,5-8,13-16H,4,9-12,17H2,1H3/q+1 PCTZSDXYRFTDPX-UHFFFAOYSA-N 50310277 9-O-[3-(Benzotriazole-1-yloxy)propyl]berberine bromide::CHEMBL606203 Cholinesterase 2890 ChEMBL 10.1016/j.bmc.2009.12.035 10.7270/Q2D50N2T 20056426 Huang, L; Shi, A; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50310277 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50310277&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46231964 104144638 CHEMBL606203 ZINC45388323 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50557649 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OC InChI=1S/C20H18NO4/c1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2/h3-4,7-10H,5-6,11H2,1-2H3/q+1 YBHILYKTIRIUTE-UHFFFAOYSA-N 50203126 3,4-dimethoxy-6,7-dihydro-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinolin-5-ylium::9,10-Dimethoxy-5,6-dihydro-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ylium::9,10-Dimethoxy-5,6-dihydro-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ylium chloride::9,10-dimethoxy-5,6-dihydro-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ylium; chloride::BERBERINE::Berberinechloride::CHEMBL12089::berberine dimer::cid_12456 Cholinesterase 18200 ChEMBL 10.1016/j.bmc.2009.12.035 10.7270/Q2D50N2T 20056426 Huang, L; Shi, A; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50203126 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50203126&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search BER 7A3Y,1JUM,6JWD,3R6R,3VW2,4DBK,3BTI,7MSV,7X8M,3NP6,3D6Y,7X32,5Y0V,2QVD,7C34,7N7D,7N7E 12456 104082463 16118 CHEMBL12089 DB04115 C00757 ZINC03779067 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50557650 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 15700 ChEMBL 10.1016/j.bmc.2009.12.035 10.7270/Q2D50N2T 20056426 Huang, L; Shi, A; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50557653 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OC InChI=1S/C20H18NO4/c1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2/h3-4,7-10H,5-6,11H2,1-2H3/q+1 YBHILYKTIRIUTE-UHFFFAOYSA-N 50203126 3,4-dimethoxy-6,7-dihydro-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinolin-5-ylium::9,10-Dimethoxy-5,6-dihydro-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ylium::9,10-Dimethoxy-5,6-dihydro-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ylium chloride::9,10-dimethoxy-5,6-dihydro-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ylium; chloride::BERBERINE::Berberinechloride::CHEMBL12089::berberine dimer::cid_12456 Cholinesterase 9200 ChEMBL 10.1016/j.bmc.2009.12.035 10.7270/Q2D50N2T 20056426 Huang, L; Shi, A; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50203126 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50203126&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search BER 7A3Y,1JUM,6JWD,3R6R,3VW2,4DBK,3BTI,7MSV,7X8M,3NP6,3D6Y,7X32,5Y0V,2QVD,7C34,7N7D,7N7E 12456 104082463 16118 CHEMBL12089 DB04115 C00757 ZINC03779067 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50557654 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCCOc1ccccc1 InChI=1S/C29H28NO5/c1-31-26-10-9-20-15-25-23-17-28-27(34-19-35-28)16-21(23)11-12-30(25)18-24(20)29(26)33-14-6-5-13-32-22-7-3-2-4-8-22/h2-4,7-10,15-18H,5-6,11-14,19H2,1H3/q+1 BKMOSBYJXKOCTP-UHFFFAOYSA-N 50310278 9-O-[4-(Phenylol-1-yloxy)butyl]berberine bromide::CHEMBL602861 Cholinesterase 1020 ChEMBL 10.1016/j.bmc.2009.12.035 10.7270/Q2D50N2T 20056426 Huang, L; Shi, A; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50310278 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50310278&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46232037 104144639 CHEMBL602861 ZINC45392440 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50557655 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCOc1cccc2[nH]c3ccccc3c12 InChI=1S/C33H27N2O5/c1-36-29-10-9-20-15-27-23-17-31-30(39-19-40-31)16-21(23)11-12-35(27)18-24(20)33(29)38-14-13-37-28-8-4-7-26-32(28)22-5-2-3-6-25(22)34-26/h2-10,15-18,34H,11-14,19H2,1H3/q+1 XUBMQQVWKGHPMH-UHFFFAOYSA-N 50310287 9-O-[2-(9H-Carbazole-4-yloxy)ethyl]berberine bromide::CHEMBL591975 Cholinesterase 29 ChEMBL 10.1016/j.bmc.2009.12.035 10.7270/Q2D50N2T 20056426 Huang, L; Shi, A; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50310287 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50310287&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46231887 104144648 CHEMBL591975 ZINC49757203 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50557657 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCCOc1cccc2[nH]c3ccccc3c12 InChI=1S/C35H31N2O5/c1-38-31-12-11-22-17-29-25-19-33-32(41-21-42-33)18-23(25)13-14-37(29)20-26(22)35(31)40-16-5-4-15-39-30-10-6-9-28-34(30)24-7-2-3-8-27(24)36-28/h2-3,6-12,17-20,36H,4-5,13-16,21H2,1H3/q+1 FNLORPOMDYXOFV-UHFFFAOYSA-N 50310284 9-O-[4-(9H-Carbazole-4-yloxy)butyl]berberine bromide::CHEMBL592015 Cholinesterase 99 ChEMBL 10.1016/j.bmc.2009.12.035 10.7270/Q2D50N2T 20056426 Huang, L; Shi, A; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50310284 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50310284&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46231891 104144645 CHEMBL592015 ZINC49756877 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50557658 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCCCCOc1cccc2[nH]c3ccccc3c12 InChI=1S/C37H35N2O5/c1-40-33-14-13-24-19-31-27-21-35-34(43-23-44-35)20-25(27)15-16-39(31)22-28(24)37(33)42-18-7-3-2-6-17-41-32-12-8-11-30-36(32)26-9-4-5-10-29(26)38-30/h4-5,8-14,19-22,38H,2-3,6-7,15-18,23H2,1H3/q+1 AJJNIDHLDAYZLU-UHFFFAOYSA-N 50310285 9-O-[6-(9H-Carbazole-4-yloxy)butyl]berberine bromide::CHEMBL592062 Cholinesterase 86 ChEMBL 10.1016/j.bmc.2009.12.035 10.7270/Q2D50N2T 20056426 Huang, L; Shi, A; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50310285 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50310285&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46231895 104144646 CHEMBL592062 ZINC49756767 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50557660 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCOc1cccc2[nH]c3ccccc3c12 InChI=1S/C34H29N2O5/c1-37-30-11-10-21-16-28-24-18-32-31(40-20-41-32)17-22(24)12-13-36(28)19-25(21)34(30)39-15-5-14-38-29-9-4-8-27-33(29)23-6-2-3-7-26(23)35-27/h2-4,6-11,16-19,35H,5,12-15,20H2,1H3/q+1 ODQXGYCKFSTMIR-UHFFFAOYSA-N 50310281 9-O-[3-(9H-Carbazole-4-yloxy)propyl]berberine bromide::CHEMBL591394 Cholinesterase 143 ChEMBL 10.1016/j.bmc.2009.12.035 10.7270/Q2D50N2T 20056426 Huang, L; Shi, A; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50310281 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50310281&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46231889 104144642 CHEMBL591394 ZINC49746322 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50557661 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCCCOc1cccc2[nH]c3ccccc3c12 InChI=1S/C36H33N2O5/c1-39-32-13-12-23-18-30-26-20-34-33(42-22-43-34)19-24(26)14-15-38(30)21-27(23)36(32)41-17-6-2-5-16-40-31-11-7-10-29-35(31)25-8-3-4-9-28(25)37-29/h3-4,7-13,18-21,37H,2,5-6,14-17,22H2,1H3/q+1 BCCXTLPULBTCHA-UHFFFAOYSA-N 50310280 9-O-[5-(9H-Carbazole-4-yloxy)butyl]berberine bromide::CHEMBL591724 Cholinesterase 107 ChEMBL 10.1016/j.bmc.2009.12.035 10.7270/Q2D50N2T 20056426 Huang, L; Shi, A; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50310280 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50310280&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46231893 104144641 CHEMBL591724 ZINC49756479 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50572310 O=c1n2CCc3c([nH]c4ccccc34)-c2nc2ccccc12 InChI=1S/C18H13N3O/c22-18-13-6-2-4-8-15(13)20-17-16-12(9-10-21(17)18)11-5-1-3-7-14(11)19-16/h1-8,19H,9-10H2 ACVGWSKVRYFWRP-UHFFFAOYSA-N 50131046 8,13-Dihydro-7H-indolo[2',3':3,4]pyrido[2,1-b]quinazolin-5-one::CHEMBL85139::cid_65752::rutaecarpine Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2009.12.044 10.7270/Q2CN742S 20079560 Wang, B; Mai, YC; Li, Y; Hou, JQ; Huang, SL; Ou, TM; Tan, JH; An, LK; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50131046 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50131046&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 65752 104022288 CHEMBL85139 C09238 ZINC00898237 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50572311 CCN(CC)CC(=O)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 InChI=1S/C24H25N5O2/c1-3-28(4-2)14-21(30)25-15-9-10-20-18(13-15)24(31)29-12-11-17-16-7-5-6-8-19(16)26-22(17)23(29)27-20/h5-10,13,26H,3-4,11-12,14H2,1-2H3,(H,25,30) IIFLCYXLKCVJJT-UHFFFAOYSA-N 50316361 3-(2-Diethylamino-acetamino)-rutaecarpine::CHEMBL1095603 Cholinesterase 17620 ChEMBL 10.1016/j.ejmech.2009.12.044 10.7270/Q2CN742S 20079560 Wang, B; Mai, YC; Li, Y; Hou, JQ; Huang, SL; Ou, TM; Tan, JH; An, LK; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50316361 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50316361&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44623996 104150722 CHEMBL1095603 ZINC49784694 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50572312 O=C(CN1CCCC1)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 InChI=1S/C24H23N5O2/c30-21(14-28-10-3-4-11-28)25-15-7-8-20-18(13-15)24(31)29-12-9-17-16-5-1-2-6-19(16)26-22(17)23(29)27-20/h1-2,5-8,13,26H,3-4,9-12,14H2,(H,25,30) WZTWUTJMQXWCQN-UHFFFAOYSA-N 50316362 3-(2-N-Pyrrolyl-acetamino)-rutaecarpine::CHEMBL1097951 Cholinesterase 696.1 ChEMBL 10.1016/j.ejmech.2009.12.044 10.7270/Q2CN742S 20079560 Wang, B; Mai, YC; Li, Y; Hou, JQ; Huang, SL; Ou, TM; Tan, JH; An, LK; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50316362 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50316362&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44624060 104150723 CHEMBL1097951 ZINC49116560 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50572313 O=C(CN1CCCCC1)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 InChI=1S/C25H25N5O2/c31-22(15-29-11-4-1-5-12-29)26-16-8-9-21-19(14-16)25(32)30-13-10-18-17-6-2-3-7-20(17)27-23(18)24(30)28-21/h2-3,6-9,14,27H,1,4-5,10-13,15H2,(H,26,31) QCNQXHWYZYJQDL-UHFFFAOYSA-N 50316363 3-(2-N-Piperidyl-acetamino)-rutaecarpine::CHEMBL1097952 Cholinesterase 33020 ChEMBL 10.1016/j.ejmech.2009.12.044 10.7270/Q2CN742S 20079560 Wang, B; Mai, YC; Li, Y; Hou, JQ; Huang, SL; Ou, TM; Tan, JH; An, LK; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50316363 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50316363&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44624061 104150724 CHEMBL1097952 ZINC49784461 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50572314 CCN(CC)CCC(=O)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 InChI=1S/C25H27N5O2/c1-3-29(4-2)13-12-22(31)26-16-9-10-21-19(15-16)25(32)30-14-11-18-17-7-5-6-8-20(17)27-23(18)24(30)28-21/h5-10,15,27H,3-4,11-14H2,1-2H3,(H,26,31) XTKDYIOBJOQMHV-UHFFFAOYSA-N 50316364 3-(2-Diethylamino-propionamino)-rutaecarpine::CHEMBL1098295 Cholinesterase 2848 ChEMBL 10.1016/j.ejmech.2009.12.044 10.7270/Q2CN742S 20079560 Wang, B; Mai, YC; Li, Y; Hou, JQ; Huang, SL; Ou, TM; Tan, JH; An, LK; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50316364 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50316364&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44624062 104150725 CHEMBL1098295 ZINC49088195 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50572315 O=C(CCN1CCCC1)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 InChI=1S/C25H25N5O2/c31-22(10-13-29-11-3-4-12-29)26-16-7-8-21-19(15-16)25(32)30-14-9-18-17-5-1-2-6-20(17)27-23(18)24(30)28-21/h1-2,5-8,15,27H,3-4,9-14H2,(H,26,31) QEZVUWPDYKSHCV-UHFFFAOYSA-N 50316365 3-(2-N-Pyrrolyl-propionamino)-rutaecarpine::CHEMBL1094633 Cholinesterase 844.5 ChEMBL 10.1016/j.ejmech.2009.12.044 10.7270/Q2CN742S 20079560 Wang, B; Mai, YC; Li, Y; Hou, JQ; Huang, SL; Ou, TM; Tan, JH; An, LK; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50316365 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50316365&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44624063 104150726 CHEMBL1094633 ZINC49087492 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50572316 O=C(CCN1CCCCC1)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 InChI=1S/C26H27N5O2/c32-23(11-14-30-12-4-1-5-13-30)27-17-8-9-22-20(16-17)26(33)31-15-10-19-18-6-2-3-7-21(18)28-24(19)25(31)29-22/h2-3,6-9,16,28H,1,4-5,10-15H2,(H,27,32) SJTYFVUMCWQRRK-UHFFFAOYSA-N 50316366 3-(2-N-Piperidyl-propionamino)-rutaecarpine::CHEMBL1096951 Cholinesterase 2112 ChEMBL 10.1016/j.ejmech.2009.12.044 10.7270/Q2CN742S 20079560 Wang, B; Mai, YC; Li, Y; Hou, JQ; Huang, SL; Ou, TM; Tan, JH; An, LK; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50316366 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50316366&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44624064 104150727 CHEMBL1096951 ZINC49783875 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50572317 CCN(CC)CC(=O)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1 InChI=1S/C24H23N5O2/c1-3-28(4-2)14-21(30)25-15-9-10-20-18(13-15)24(31)29-12-11-17-16-7-5-6-8-19(16)26-22(17)23(29)27-20/h5-13,26H,3-4,14H2,1-2H3,(H,25,30) OXBFBPQXYBLXFZ-UHFFFAOYSA-N 50316367 3-(2-Diethylamino-acetamino)-7,8-dehydrorutaecarpine::CHEMBL1096952 Cholinesterase 11360 ChEMBL 10.1016/j.ejmech.2009.12.044 10.7270/Q2CN742S 20079560 Wang, B; Mai, YC; Li, Y; Hou, JQ; Huang, SL; Ou, TM; Tan, JH; An, LK; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50316367 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50316367&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46192315 104150728 CHEMBL1096952 ZINC49114091 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50572318 O=C(CN1CCCC1)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1 InChI=1S/C24H21N5O2/c30-21(14-28-10-3-4-11-28)25-15-7-8-20-18(13-15)24(31)29-12-9-17-16-5-1-2-6-19(16)26-22(17)23(29)27-20/h1-2,5-9,12-13,26H,3-4,10-11,14H2,(H,25,30) YHMBQJOVILGZDZ-UHFFFAOYSA-N 50316368 3-(2-N-Pyrrolyl-acetamino)-7,8-dehydrorutaecarpine::CHEMBL1096953 Cholinesterase 428.2 ChEMBL 10.1016/j.ejmech.2009.12.044 10.7270/Q2CN742S 20079560 Wang, B; Mai, YC; Li, Y; Hou, JQ; Huang, SL; Ou, TM; Tan, JH; An, LK; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50316368 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50316368&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46192442 104150729 CHEMBL1096953 ZINC49783963 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50572319 O=C(CN1CCCCC1)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1 InChI=1S/C25H23N5O2/c31-22(15-29-11-4-1-5-12-29)26-16-8-9-21-19(14-16)25(32)30-13-10-18-17-6-2-3-7-20(17)27-23(18)24(30)28-21/h2-3,6-10,13-14,27H,1,4-5,11-12,15H2,(H,26,31) WLAAJJZNAFKAMK-UHFFFAOYSA-N 50316369 3-(2-N-Piperidyl-acetamino)-7,8-dehydrorutaecarpine::CHEMBL1098308 Cholinesterase 5429 ChEMBL 10.1016/j.ejmech.2009.12.044 10.7270/Q2CN742S 20079560 Wang, B; Mai, YC; Li, Y; Hou, JQ; Huang, SL; Ou, TM; Tan, JH; An, LK; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50316369 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50316369&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46192443 104150730 CHEMBL1098308 ZINC49784060 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50572320 CCN(CC)CC(=O)Nc1ccc2ncn(CCc3c[nH]c4ccccc34)c(=O)c2c1 InChI=1S/C24H27N5O2/c1-3-28(4-2)15-23(30)27-18-9-10-22-20(13-18)24(31)29(16-26-22)12-11-17-14-25-21-8-6-5-7-19(17)21/h5-10,13-14,16,25H,3-4,11-12,15H2,1-2H3,(H,27,30) PTYLWPUYSLRQAR-UHFFFAOYSA-N 50316370 6-(2-Diethylamino-acetamino)-3-[2-(3-indolyl)ethyl]-4(3a)-quinazolinon::CHEMBL1098309 Cholinesterase 41620 ChEMBL 10.1016/j.ejmech.2009.12.044 10.7270/Q2CN742S 20079560 Wang, B; Mai, YC; Li, Y; Hou, JQ; Huang, SL; Ou, TM; Tan, JH; An, LK; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50316370 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50316370&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46192444 104150731 CHEMBL1098309 ZINC49116206 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50572321 O=C(CN1CCCC1)Nc1ccc2ncn(CCc3c[nH]c4ccccc34)c(=O)c2c1 InChI=1S/C24H25N5O2/c30-23(15-28-10-3-4-11-28)27-18-7-8-22-20(13-18)24(31)29(16-26-22)12-9-17-14-25-21-6-2-1-5-19(17)21/h1-2,5-8,13-14,16,25H,3-4,9-12,15H2,(H,27,30) LFMLWCAFKPURDW-UHFFFAOYSA-N 50316371 6-(2-N-Pyrrolyl-acetamino)-3-[2-(3-Indolyl)ethyl]-4(3a)-quinazolinon::CHEMBL1094972 Cholinesterase 25860 ChEMBL 10.1016/j.ejmech.2009.12.044 10.7270/Q2CN742S 20079560 Wang, B; Mai, YC; Li, Y; Hou, JQ; Huang, SL; Ou, TM; Tan, JH; An, LK; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50316371 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50316371&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46192445 104150732 CHEMBL1094972 ZINC49125576 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50572322 O=C(CN1CCCCC1)Nc1ccc2ncn(CCc3c[nH]c4ccccc34)c(=O)c2c1 InChI=1S/C25H27N5O2/c31-24(16-29-11-4-1-5-12-29)28-19-8-9-23-21(14-19)25(32)30(17-27-23)13-10-18-15-26-22-7-3-2-6-20(18)22/h2-3,6-9,14-15,17,26H,1,4-5,10-13,16H2,(H,28,31) SKBHJCPFSQMNRC-UHFFFAOYSA-N 50316372 6-(2-N-Piperidyl-acetamino)-3-[2-(3-Indolyl)ethyl]-4(3a)-quinazolinon::CHEMBL1095291 Cholinesterase 12950 ChEMBL 10.1016/j.ejmech.2009.12.044 10.7270/Q2CN742S 20079560 Wang, B; Mai, YC; Li, Y; Hou, JQ; Huang, SL; Ou, TM; Tan, JH; An, LK; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50316372 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50316372&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46192446 104150733 CHEMBL1095291 ZINC49072582 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50572323 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 29.98 ChEMBL 10.1016/j.ejmech.2009.12.044 10.7270/Q2CN742S 20079560 Wang, B; Mai, YC; Li, Y; Hou, JQ; Huang, SL; Ou, TM; Tan, JH; An, LK; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574046 CCOC(=O)c1cc2c(N)c3CCCCc3nc2nc1C InChI=1S/C16H19N3O2/c1-3-21-16(20)11-8-12-14(17)10-6-4-5-7-13(10)19-15(12)18-9(11)2/h8H,3-7H2,1-2H3,(H2,17,18,19) XGQUEKANWWMGAJ-UHFFFAOYSA-N 50317074 CHEMBL1087194::ethyl 5-amino-2-methyl-6,7,8,9-tetrahydrobenzo[b][1,8]naphthyridine-3-carboxylate Cholinesterase 12000 ChEMBL 10.1016/j.bmcl.2010.03.010 10.7270/Q2TH8MVX 20350807 Soriano, E; Samadi, A; Chioua, M; de los Rios, C; Marco-Contelles, J Laboratorio de Radicales Libres y Química Computacional (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317074 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317074&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46861819 104151435 CHEMBL1087194 ZINC49053372 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50574049 CCOC(=O)c1c(C)nc2nc3CCCCc3c(N)c2c1-c1ccccc1 InChI=1S/C22H23N3O2/c1-3-27-22(26)17-13(2)24-21-19(18(17)14-9-5-4-6-10-14)20(23)15-11-7-8-12-16(15)25-21/h4-6,9-10H,3,7-8,11-12H2,1-2H3,(H2,23,24,25) UNCWLZOGXZCOJG-UHFFFAOYSA-N 50241350 5-Amino-2-methyl-4-phenyl-6,7,8,9-tetrahydro-benzo[b][1,8]naphthyridine-3-carboxylic acid ethyl ester::CHEMBL253386::ethyl 5-amino-2-methyl-4-phenyl-6,7,8,9-tetrahydrobenzo[b][1,8]naphthyridine-3-carboxylate Cholinesterase 5030 ChEMBL 10.1016/j.bmcl.2010.03.010 10.7270/Q2TH8MVX 20350807 Soriano, E; Samadi, A; Chioua, M; de los Rios, C; Marco-Contelles, J Laboratorio de Radicales Libres y Química Computacional (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50241350 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50241350&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 6918662 104098734 CHEMBL253386 ZINC28968810 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579301 CCCN(CCC)CCCCCCOc1ccc(CN(CC)CC)cc1 InChI=1S/C23H42N2O/c1-5-17-25(18-6-2)19-11-9-10-12-20-26-23-15-13-22(14-16-23)21-24(7-3)8-4/h13-16H,5-12,17-21H2,1-4H3 PDXYPTRGBRONQF-UHFFFAOYSA-N 50319410 6-(4-((diethylamino)methyl)phenoxy)-N,N-dipropylhexan-1-amine::CHEMBL1082605 Cholinesterase 1340 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319410 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319410&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890023 104153771 CHEMBL1082605 ZINC49034878 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579302 CCCCN(CCCC)CCCCCCOc1ccc(CN(CC)CC)cc1 InChI=1S/C25H46N2O/c1-5-9-19-27(20-10-6-2)21-13-11-12-14-22-28-25-17-15-24(16-18-25)23-26(7-3)8-4/h15-18H,5-14,19-23H2,1-4H3 HMNRPTISBJPMEH-UHFFFAOYSA-N 50319411 CHEMBL1084080::N,N-dibutyl-6-(4-((diethylamino)methyl)phenoxy)hexan-1-amine Cholinesterase 230 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319411 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319411&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890024 104153772 CHEMBL1084080 ZINC49034698 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579303 CCN(CC)Cc1ccc(OCCCCCCCCN2CCCC2)cc1 InChI=1S/C23H40N2O/c1-3-24(4-2)21-22-13-15-23(16-14-22)26-20-12-8-6-5-7-9-17-25-18-10-11-19-25/h13-16H,3-12,17-21H2,1-2H3 ZAAFUWUASIUWDU-UHFFFAOYSA-N 50319412 CHEMBL1082845::N-ethyl-N-(4-(8-(pyrrolidin-1-yl)octyloxy)benzyl)ethanamine Cholinesterase 15 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319412 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319412&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890025 104153773 CHEMBL1082845 ZINC49036090 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579304 CCN(CC)Cc1ccc(OCCCCCCCCN2CCCCC2)cc1 InChI=1S/C24H42N2O/c1-3-25(4-2)22-23-14-16-24(17-15-23)27-21-13-8-6-5-7-10-18-26-19-11-9-12-20-26/h14-17H,3-13,18-22H2,1-2H3 QJYZZKHUOILRJJ-UHFFFAOYSA-N 50319377 CHEMBL1082846::N-ethyl-N-(4-(8-(piperidin-1-yl)octyloxy)benzyl)ethanamine Cholinesterase 7.3 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319377 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319377&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890026 104153738 CHEMBL1082846 ZINC49036092 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579305 CCN(CC)Cc1ccc(OCCCCCCCCN2CCN(C)CC2)cc1 InChI=1S/C24H43N3O/c1-4-26(5-2)22-23-12-14-24(15-13-23)28-21-11-9-7-6-8-10-16-27-19-17-25(3)18-20-27/h12-15H,4-11,16-22H2,1-3H3 XYJIEMYMKUBKEQ-UHFFFAOYSA-N 50319378 CHEMBL1082847::N-ethyl-N-(4-(8-(4-methylpiperazin-1-yl)octyloxy)benzyl)ethanamine Cholinesterase 11 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319378 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319378&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890027 104153739 CHEMBL1082847 ZINC49036094 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579306 CCN(CC)Cc1ccc(OCCCCCCCCN2CCN(CC)CC2)cc1 InChI=1S/C25H45N3O/c1-4-26(5-2)23-24-13-15-25(16-14-24)29-22-12-10-8-7-9-11-17-28-20-18-27(6-3)19-21-28/h13-16H,4-12,17-23H2,1-3H3 SDCCOIUHZNWQIS-UHFFFAOYSA-N 50319379 CHEMBL1082849::N-ethyl-N-(4-(8-(4-ethylpiperazin-1-yl)octyloxy)benzyl)ethanamine Cholinesterase 14 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319379 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319379&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890081 104153740 CHEMBL1082849 ZINC49036377 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579307 CCN(CC)CCCCCCCCOc1ccc(CN(CC)CC)cc1 InChI=1S/C23H42N2O/c1-5-24(6-2)19-13-11-9-10-12-14-20-26-23-17-15-22(16-18-23)21-25(7-3)8-4/h15-18H,5-14,19-21H2,1-4H3 GYCQGSQJICZJAE-UHFFFAOYSA-N 50319380 8-(4-((diethylamino)methyl)phenoxy)-N,N-diethyloctan-1-amine::CHEMBL1082850 Cholinesterase 48 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319380 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319380&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890082 104153741 CHEMBL1082850 ZINC49036379 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579308 CCCN(CCC)CCCCCCCCOc1ccc(CN(CC)CC)cc1 InChI=1S/C25H46N2O/c1-5-19-27(20-6-2)21-13-11-9-10-12-14-22-28-25-17-15-24(16-18-25)23-26(7-3)8-4/h15-18H,5-14,19-23H2,1-4H3 FVHPNAPOIIIEBJ-UHFFFAOYSA-N 50319381 8-(4-((diethylamino)methyl)phenoxy)-N,N-dipropyloctan-1-amine::CHEMBL1086100 Cholinesterase 9.1 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319381 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319381&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890083 104153742 CHEMBL1086100 ZINC49048232 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579309 CCCCN(CCCC)CCCCCCCCOc1ccc(CN(CC)CC)cc1 InChI=1S/C27H50N2O/c1-5-9-21-29(22-10-6-2)23-15-13-11-12-14-16-24-30-27-19-17-26(18-20-27)25-28(7-3)8-4/h17-20H,5-16,21-25H2,1-4H3 GQSQPANAQOTVRE-UHFFFAOYSA-N 50319382 CHEMBL1086101::N,N-dibutyl-8-(4-((diethylamino)methyl)phenoxy)octan-1-amine Cholinesterase 17 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319382 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319382&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890084 104153743 CHEMBL1086101 ZINC49048237 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579310 CCN(CC)Cc1ccc(OCCCCCCCCCCN2CCCC2)cc1 InChI=1S/C25H44N2O/c1-3-26(4-2)23-24-15-17-25(18-16-24)28-22-14-10-8-6-5-7-9-11-19-27-20-12-13-21-27/h15-18H,3-14,19-23H2,1-2H3 OBKYZNYIGNZWNB-UHFFFAOYSA-N 50319383 CHEMBL1086102::N-ethyl-N-(4-(10-(pyrrolidin-1-yl)decyloxy)benzyl)ethanamine Cholinesterase 68 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319383 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319383&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890085 104153744 CHEMBL1086102 ZINC49048241 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579311 CCN(CC)Cc1ccc(OCCCCCCCCCCN2CCCCC2)cc1 InChI=1S/C26H46N2O/c1-3-27(4-2)24-25-16-18-26(19-17-25)29-23-15-10-8-6-5-7-9-12-20-28-21-13-11-14-22-28/h16-19H,3-15,20-24H2,1-2H3 OXKBGZCDDUVTDC-UHFFFAOYSA-N 50319384 CHEMBL1085869::N-ethyl-N-(4-(10-(piperidin-1-yl)decyloxy)benzyl)ethanamine Cholinesterase 78 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319384 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319384&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890129 104153745 CHEMBL1085869 ZINC49050141 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579312 CCN(CC)Cc1ccc(OCCCCCCCCCCN2CCN(C)CC2)cc1 InChI=1S/C26H47N3O/c1-4-28(5-2)24-25-14-16-26(17-15-25)30-23-13-11-9-7-6-8-10-12-18-29-21-19-27(3)20-22-29/h14-17H,4-13,18-24H2,1-3H3 LGAHRJBXSBZWLC-UHFFFAOYSA-N 50319385 CHEMBL1085870::N-ethyl-N-(4-(10-(4-methylpiperazin-1-yl)decyloxy)benzyl)ethanamine Cholinesterase 33 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319385 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319385&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890130 104153746 CHEMBL1085870 ZINC49050145 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579313 CCN(CC)Cc1ccc(OCCCCCCCCCCN2CCN(CC)CC2)cc1 InChI=1S/C27H49N3O/c1-4-28(5-2)25-26-15-17-27(18-16-26)31-24-14-12-10-8-7-9-11-13-19-30-22-20-29(6-3)21-23-30/h15-18H,4-14,19-25H2,1-3H3 NYTYPVOAZPIHJY-UHFFFAOYSA-N 50319386 CHEMBL1085871::N-ethyl-N-(4-(10-(4-ethylpiperazin-1-yl)decyloxy)benzyl)ethanamine Cholinesterase 190 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319386 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319386&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890131 104153747 CHEMBL1085871 ZINC49050149 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579314 CCN(CC)CCCCCCCCCCOc1ccc(CN(CC)CC)cc1 InChI=1S/C25H46N2O/c1-5-26(6-2)21-15-13-11-9-10-12-14-16-22-28-25-19-17-24(18-20-25)23-27(7-3)8-4/h17-20H,5-16,21-23H2,1-4H3 HKENAXNPMKZQAD-UHFFFAOYSA-N 50319387 10-(4-((diethylamino)methyl)phenoxy)-N,N-diethyldecan-1-amine::CHEMBL1085642 Cholinesterase 27 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319387 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319387&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890132 104153748 CHEMBL1085642 ZINC49035696 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579315 CCCN(CCC)CCCCCCCCCCOc1ccc(CN(CC)CC)cc1 InChI=1S/C27H50N2O/c1-5-21-29(22-6-2)23-15-13-11-9-10-12-14-16-24-30-27-19-17-26(18-20-27)25-28(7-3)8-4/h17-20H,5-16,21-25H2,1-4H3 FRNZJQLGEIVHOA-UHFFFAOYSA-N 50319388 10-(4-((diethylamino)methyl)phenoxy)-N,N-dipropyldecan-1-amine::CHEMBL1085643 Cholinesterase 26 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319388 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319388&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890133 104153749 CHEMBL1085643 ZINC49035698 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579316 CCCCN(CCCC)CCCCCCCCCCOc1ccc(CN(CC)CC)cc1 InChI=1S/C29H54N2O/c1-5-9-23-31(24-10-6-2)25-17-15-13-11-12-14-16-18-26-32-29-21-19-28(20-22-29)27-30(7-3)8-4/h19-22H,5-18,23-27H2,1-4H3 QYZYQXKFXIZEMC-UHFFFAOYSA-N 50319389 CHEMBL1084650::N,N-dibutyl-10-(4-((diethylamino)methyl)phenoxy)decan-1-amine Cholinesterase 15 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319389 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319389&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46890174 104153750 CHEMBL1084650 ZINC49035619 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50579317 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 1520 ChEMBL 10.1016/j.bmcl.2010.04.059 10.7270/Q2QC03P4 20452769 Yu, L; Cao, R; Yi, W; Yan, Q; Chen, Z; Ma, L; Peng, W; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50580830 C(Nc1ccnc(n1)N1CCCC1)c1ccccc1 InChI=1S/C15H18N4/c1-2-6-13(7-3-1)12-17-14-8-9-16-15(18-14)19-10-4-5-11-19/h1-3,6-9H,4-5,10-12H2,(H,16,17,18) PGBNXXDXGXQQRQ-UHFFFAOYSA-N 50319968 CHEMBL1085780::N-benzyl-2-(pyrrolidin-1-yl)pyrimidin-4-amine Cholinesterase 26400 ChEMBL 10.1016/j.bmcl.2010.04.108 10.7270/Q2GM87GC 20472431 Mohamed, T; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319968 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319968&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46891014 104154329 CHEMBL1085780 ZINC49048188 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50580831 C(Nc1ccnc(n1)N1CCOCC1)c1ccccc1 InChI=1S/C15H18N4O/c1-2-4-13(5-3-1)12-17-14-6-7-16-15(18-14)19-8-10-20-11-9-19/h1-7H,8-12H2,(H,16,17,18) PKTXFNWLILBNOJ-UHFFFAOYSA-N 50319969 CHEMBL1085781::N-benzyl-2-morpholinopyrimidin-4-amine Cholinesterase 68300 ChEMBL 10.1016/j.bmcl.2010.04.108 10.7270/Q2GM87GC 20472431 Mohamed, T; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319969 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319969&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46891015 104154330 CHEMBL1085781 ZINC49055147 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50580832 C(Nc1ccnc(n1)N1CCSCC1)c1ccccc1 InChI=1S/C15H18N4S/c1-2-4-13(5-3-1)12-17-14-6-7-16-15(18-14)19-8-10-20-11-9-19/h1-7H,8-12H2,(H,16,17,18) SPJWTUJGKPIRMF-UHFFFAOYSA-N 50319970 CHEMBL1086014::N-benzyl-2-thiomorpholinopyrimidin-4-amine Cholinesterase 2300 ChEMBL 10.1016/j.bmcl.2010.04.108 10.7270/Q2GM87GC 20472431 Mohamed, T; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319970 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319970&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46871648 104154331 CHEMBL1086014 ZINC49053922 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50580833 CN1CCN(CC1)c1nccc(NCc2ccccc2)n1 InChI=1S/C16H21N5/c1-20-9-11-21(12-10-20)16-17-8-7-15(19-16)18-13-14-5-3-2-4-6-14/h2-8H,9-13H2,1H3,(H,17,18,19) RIUXJXNHHCERLO-UHFFFAOYSA-N 50319971 CHEMBL1084808::N-benzyl-2-(4-methylpiperazin-1-yl)pyrimidin-4-amine Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2010.04.108 10.7270/Q2GM87GC 20472431 Mohamed, T; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319971 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319971&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46891016 104154332 CHEMBL1084808 ZINC49046864 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50580834 CC1CCN(CC1)c1nccc(NCc2ccccc2)n1 InChI=1S/C17H22N4/c1-14-8-11-21(12-9-14)17-18-10-7-16(20-17)19-13-15-5-3-2-4-6-15/h2-7,10,14H,8-9,11-13H2,1H3,(H,18,19,20) VAPRIZYIVOPQLU-UHFFFAOYSA-N 50319972 CHEMBL1082977::N-benzyl-2-(4-methylpiperidin-1-yl)pyrimidin-4-amine Cholinesterase 2900 ChEMBL 10.1016/j.bmcl.2010.04.108 10.7270/Q2GM87GC 20472431 Mohamed, T; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319972 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319972&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46891058 104154333 CHEMBL1082977 ZINC49037354 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50580835 C(Cc1ccccc1)Nc1ccnc(n1)N1CCCC1 InChI=1S/C16H20N4/c1-2-6-14(7-3-1)8-10-17-15-9-11-18-16(19-15)20-12-4-5-13-20/h1-3,6-7,9,11H,4-5,8,10,12-13H2,(H,17,18,19) MIALFBONYMMUFB-UHFFFAOYSA-N 50319973 CHEMBL1082978::N-phenethyl-2-(pyrrolidin-1-yl)pyrimidin-4-amine Cholinesterase 13800 ChEMBL 10.1016/j.bmcl.2010.04.108 10.7270/Q2GM87GC 20472431 Mohamed, T; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319973 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319973&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46891059 104154334 CHEMBL1082978 ZINC49037356 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50580836 C(Cc1ccccc1)Nc1ccnc(n1)N1CCOCC1 InChI=1S/C16H20N4O/c1-2-4-14(5-3-1)6-8-17-15-7-9-18-16(19-15)20-10-12-21-13-11-20/h1-5,7,9H,6,8,10-13H2,(H,17,18,19) QCZVHPUPIBZBLH-UHFFFAOYSA-N 50319974 2-morpholino-N-phenethylpyrimidin-4-amine::CHEMBL1085505 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2010.04.108 10.7270/Q2GM87GC 20472431 Mohamed, T; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319974 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319974&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46891060 104154335 CHEMBL1085505 ZINC49113207 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50580837 C(Cc1ccccc1)Nc1ccnc(n1)N1CCSCC1 InChI=1S/C16H20N4S/c1-2-4-14(5-3-1)6-8-17-15-7-9-18-16(19-15)20-10-12-21-13-11-20/h1-5,7,9H,6,8,10-13H2,(H,17,18,19) LNJWYRWYXZPMBQ-UHFFFAOYSA-N 50319975 CHEMBL1082979::N-phenethyl-2-thiomorpholinopyrimidin-4-amine Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2010.04.108 10.7270/Q2GM87GC 20472431 Mohamed, T; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319975 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319975&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46891061 104154336 CHEMBL1082979 ZINC49037358 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50580838 CN1CCN(CC1)c1nccc(NCCc2ccccc2)n1 InChI=1S/C17H23N5/c1-21-11-13-22(14-12-21)17-19-10-8-16(20-17)18-9-7-15-5-3-2-4-6-15/h2-6,8,10H,7,9,11-14H2,1H3,(H,18,19,20) WUFOFZBXUSTQCN-UHFFFAOYSA-N 50319976 2-(4-methylpiperazin-1-yl)-N-phenethylpyrimidin-4-amine::CHEMBL1082980 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2010.04.108 10.7270/Q2GM87GC 20472431 Mohamed, T; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319976 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319976&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46891062 104154337 CHEMBL1082980 ZINC49033200 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50580839 CC1CCN(CC1)c1nccc(NCCc2ccccc2)n1 InChI=1S/C18H24N4/c1-15-9-13-22(14-10-15)18-20-12-8-17(21-18)19-11-7-16-5-3-2-4-6-16/h2-6,8,12,15H,7,9-11,13-14H2,1H3,(H,19,20,21) JAXXPQUWOTTXGC-UHFFFAOYSA-N 50319977 2-(4-methylpiperidin-1-yl)-N-phenethylpyrimidin-4-amine::CHEMBL1082981 Cholinesterase 17700 ChEMBL 10.1016/j.bmcl.2010.04.108 10.7270/Q2GM87GC 20472431 Mohamed, T; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319977 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319977&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46891063 104154338 CHEMBL1082981 ZINC49037360 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50580840 C(Nc1ccnc(n1)N1CCCC1)c1cccc2ccccc12 InChI=1S/C19H20N4/c1-2-9-17-15(6-1)7-5-8-16(17)14-21-18-10-11-20-19(22-18)23-12-3-4-13-23/h1-2,5-11H,3-4,12-14H2,(H,20,21,22) NAYIVRUMIMUOGQ-UHFFFAOYSA-N 50319978 CHEMBL1084210::N-(naphthalen-1-ylmethyl)-2-(pyrrolidin-1-yl)pyrimidin-4-amine Cholinesterase 8900 ChEMBL 10.1016/j.bmcl.2010.04.108 10.7270/Q2GM87GC 20472431 Mohamed, T; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319978 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319978&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46891117 104154339 CHEMBL1084210 ZINC49089348 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50580841 C(Nc1ccnc(n1)N1CCOCC1)c1cccc2ccccc12 InChI=1S/C19H20N4O/c1-2-7-17-15(4-1)5-3-6-16(17)14-21-18-8-9-20-19(22-18)23-10-12-24-13-11-23/h1-9H,10-14H2,(H,20,21,22) IWVKLFVNDFNPIF-UHFFFAOYSA-N 50319979 2-morpholino-N-(naphthalen-1-ylmethyl)pyrimidin-4-amine::CHEMBL1084211 Cholinesterase 28000 ChEMBL 10.1016/j.bmcl.2010.04.108 10.7270/Q2GM87GC 20472431 Mohamed, T; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319979 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319979&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46891118 104154340 CHEMBL1084211 ZINC49045629 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50580842 C(Nc1ccnc(n1)N1CCSCC1)c1cccc2ccccc12 InChI=1S/C19H20N4S/c1-2-7-17-15(4-1)5-3-6-16(17)14-21-18-8-9-20-19(22-18)23-10-12-24-13-11-23/h1-9H,10-14H2,(H,20,21,22) KYTJYEBPIKSQIT-UHFFFAOYSA-N 50319980 CHEMBL1084212::N-(naphthalen-1-ylmethyl)-2-thiomorpholinopyrimidin-4-amine Cholinesterase 34700 ChEMBL 10.1016/j.bmcl.2010.04.108 10.7270/Q2GM87GC 20472431 Mohamed, T; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319980 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319980&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46891119 104154341 CHEMBL1084212 ZINC49046153 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50580843 CN1CCN(CC1)c1nccc(NCc2cccc3ccccc23)n1 InChI=1S/C20H23N5/c1-24-11-13-25(14-12-24)20-21-10-9-19(23-20)22-15-17-7-4-6-16-5-2-3-8-18(16)17/h2-10H,11-15H2,1H3,(H,21,22,23) NFCOLVLKQFZNOB-UHFFFAOYSA-N 50319981 2-(4-methylpiperazin-1-yl)-N-(naphthalen-1-ylmethyl)pyrimidin-4-amine::CHEMBL1084213 Cholinesterase 2600 ChEMBL 10.1016/j.bmcl.2010.04.108 10.7270/Q2GM87GC 20472431 Mohamed, T; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319981 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319981&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46891120 104154342 CHEMBL1084213 ZINC49046157 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50580844 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 19 ChEMBL 10.1016/j.bmcl.2010.04.108 10.7270/Q2GM87GC 20472431 Mohamed, T; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50580845 C(CCCNc1c2CCCCc2nc2ccccc12)CCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C33H40N4/c1(2-12-22-34-32-24-14-4-8-18-28(24)36-29-19-9-5-15-25(29)32)3-13-23-35-33-26-16-6-10-20-30(26)37-31-21-11-7-17-27(31)33/h4,6,8,10,14,16,18,20H,1-3,5,7,9,11-13,15,17,19,21-23H2,(H,34,36)(H,35,37) ITZOKHKOFJOBFS-UHFFFAOYSA-N 8963 CHEMBL32823::Homodimeric Tacrine Analog 3b::N-[7-(1,2,3,4-tetrahydroacridin-9-ylamino)heptyl]-1,2,3,4-tetrahydroacridin-9-amine::Tacrine Dimer 3b::Tacrine-Based Inhibitor 2f::tacrine homobivalent compound 3a Cholinesterase 10.5 ChEMBL 10.1016/j.bmcl.2010.04.108 10.7270/Q2GM87GC 20472431 Mohamed, T; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8963 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8963&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search AA7 2CKM,5EI5 9549196 46509739 CHEMBL32823 ZINC01893945 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025404 COc1ccc2C(=O)C(Cc3cc[n+](Cc4ccccc4C)cc3C(F)(F)F)CCc2c1 InChI=1S/C26H25F3NO2/c1-17-5-3-4-6-21(17)15-30-12-11-19(24(16-30)26(27,28)29)13-20-8-7-18-14-22(32-2)9-10-23(18)25(20)31/h3-6,9-12,14,16,20H,7-8,13,15H2,1-2H3/q+1 AXIZSOSOOLEFSM-UHFFFAOYSA-N 50291606 CHEMBL4164981 Cholinesterase 2239 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291606 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291606&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44387093 104133158 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025405 [Br-].CNC(=O)c1c[n+](Cc2ccccc2C)ccc1CC1CCc2cc(OC)ccc2C1=O InChI=1S/C27H28N2O3.BrH/c1-18-6-4-5-7-22(18)16-29-13-12-20(25(17-29)27(31)28-2)14-21-9-8-19-15-23(32-3)10-11-24(19)26(21)30;/h4-7,10-13,15,17,21H,8-9,14,16H2,1-3H3;1H BIDFFGGIQIADGO-UHFFFAOYSA-N 50291608 CHEMBL4170530 Cholinesterase 2505 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291608 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291608&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44385439 104133160 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025406 [Br-].COc1ccc(cc1OC)C(=O)CCc1cc[n+](Cc2cccc(Cl)c2)cc1C#N InChI=1S/C24H22ClN2O3/c1-29-23-9-7-19(13-24(23)30-2)22(28)8-6-18-10-11-27(16-20(18)14-26)15-17-4-3-5-21(25)12-17/h3-5,7,9-13,16H,6,8,15H2,1-2H3/q+1 WOVKOTAVAGGWDJ-UHFFFAOYSA-N 50291610 CHEMBL4159880 Cholinesterase 4242 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291610 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291610&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44386197 104133162 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025407 [Br-].COc1ccc(cc1OC)C(=O)CCc1cc[n+](Cc2ccc(Cl)cc2)cc1C#N InChI=1S/C24H22ClN2O3/c1-29-23-10-6-19(13-24(23)30-2)22(28)9-5-18-11-12-27(16-20(18)14-26)15-17-3-7-21(25)8-4-17/h3-4,6-8,10-13,16H,5,9,15H2,1-2H3/q+1 BTGYEBRPOKQGJZ-UHFFFAOYSA-N 50291611 CHEMBL4167127 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291611 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291611&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 22097148 104133163 ZINC00018003 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025408 [Br-].COc1ccc(cc1OC)C(=O)CCc1cc[n+](Cc2cccc(F)c2)cc1C#N InChI=1S/C24H22FN2O3/c1-29-23-9-7-19(13-24(23)30-2)22(28)8-6-18-10-11-27(16-20(18)14-26)15-17-4-3-5-21(25)12-17/h3-5,7,9-13,16H,6,8,15H2,1-2H3/q+1 LVOCVOINJLTJBN-UHFFFAOYSA-N 50291612 CHEMBL4163678 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291612 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291612&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 22097194 104133164 ZINC36338525 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025409 [Br-].COC(=O)c1c[n+](Cc2cccc(Cl)c2)ccc1CCC(=O)c1ccc(OC)c(OC)c1 InChI=1S/C25H25ClNO5/c1-30-23-10-8-19(14-24(23)31-2)22(28)9-7-18-11-12-27(16-21(18)25(29)32-3)15-17-5-4-6-20(26)13-17/h4-6,8,10-14,16H,7,9,15H2,1-3H3/q+1 XQGGLAABIKOXNO-UHFFFAOYSA-N 50291616 CHEMBL4171568 Cholinesterase 2035 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291616 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291616&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 22100072 104133168 ZINC36338526 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025410 COc1ccc(cc1OC)C(=O)CCC1C=CN(Cc2cccc(Cl)c2)C=C1C#N InChI=1S/C24H23ClN2O3/c1-29-23-9-7-19(13-24(23)30-2)22(28)8-6-18-10-11-27(16-20(18)14-26)15-17-4-3-5-21(25)12-17/h3-5,7,9-13,16,18H,6,8,15H2,1-2H3 BOPFNLKYSPIFLY-UHFFFAOYSA-N 50291617 CHEMBL4160310 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291617 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291617&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 22097158 104133169 ZINC00018004 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025411 COC(=O)C1=CN(Cc2cccc(Cl)c2)C=CC1CCC(=O)c1ccc(OC)c(OC)c1 InChI=1S/C25H26ClNO5/c1-30-23-10-8-19(14-24(23)31-2)22(28)9-7-18-11-12-27(16-21(18)25(29)32-3)15-17-5-4-6-20(26)13-17/h4-6,8,10-14,16,18H,7,9,15H2,1-3H3 AUUDYYKNSHAOJT-UHFFFAOYSA-N 50291618 CHEMBL4168225 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291618 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291618&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44268242 104133170 ZINC36338524 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025412 COc1ccc(cc1OC)C(=O)CCC1C=CN(Cc2cccc(Cl)c2)C=C1C(C)=O InChI=1S/C25H26ClNO4/c1-17(28)22-16-27(15-18-5-4-6-21(26)13-18)12-11-19(22)7-9-23(29)20-8-10-24(30-2)25(14-20)31-3/h4-6,8,10-14,16,19H,7,9,15H2,1-3H3 OYPCNXLINUJIIK-UHFFFAOYSA-N 50291621 CHEMBL4165631 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291621 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291621&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44268209 104133173 ZINC36338512 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025413 COc1ccc(cc1OC)C(=O)CCC1C=CN(Cc2cccc(Cl)c2)C=C1C(N)=O InChI=1S/C24H25ClN2O4/c1-30-22-9-7-18(13-23(22)31-2)21(28)8-6-17-10-11-27(15-20(17)24(26)29)14-16-4-3-5-19(25)12-16/h3-5,7,9-13,15,17H,6,8,14H2,1-2H3,(H2,26,29) JVHQPCGYNVTJER-UHFFFAOYSA-N 50291622 CHEMBL4173562 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291622 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291622&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44268369 104133174 ZINC40632138 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025414 CC(=O)C1=CN(Cc2cccc(Cl)c2)C=CC1CC1Cc2cc(F)ccc2C1=O InChI=1S/C24H21ClFNO2/c1-15(28)23-14-27(13-16-3-2-4-20(25)9-16)8-7-17(23)10-19-11-18-12-21(26)5-6-22(18)24(19)29/h2-9,12,14,17,19H,10-11,13H2,1H3 JHCQBTJLDRVOEU-UHFFFAOYSA-N 50291623 CHEMBL4174452 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291623 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291623&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 22100104 104133175 ZINC36338523 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025415 COc1cc2CCC(CC3C=CN(Cc4ccccc4)C=C3C(C)=O)C(=O)c2cc1OC InChI=1S/C27H29NO4/c1-18(29)24-17-28(16-19-7-5-4-6-8-19)12-11-21(24)13-22-10-9-20-14-25(31-2)26(32-3)15-23(20)27(22)30/h4-8,11-12,14-15,17,21-22H,9-10,13,16H2,1-3H3 HMFPNGCVUHYYTQ-UHFFFAOYSA-N 50291584 CHEMBL4160696 Cholinesterase 3970 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291584 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291584&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44384848 104133136 ZINC28013643 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025418 COc1ccc2C(=O)C(CC3C=CN(Cc4ccccc4F)C=C3C(C)=O)CCc2c1 InChI=1S/C26H26FNO3/c1-17(29)24-16-28(15-21-5-3-4-6-25(21)27)12-11-19(24)13-20-8-7-18-14-22(31-2)9-10-23(18)26(20)30/h3-6,9-12,14,16,19-20H,7-8,13,15H2,1-2H3 CNAHKYGTLNXQEV-UHFFFAOYSA-N 50291625 CHEMBL4166141 Cholinesterase 6010 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291625 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291625&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 22097151 104133177 ZINC36338522 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025282 COc1cc2CC(Cc3cc[n+](Cc4cccc(Cl)c4)cc3C(C)=O)C(=O)c2cc1O InChI=1S/C25H22ClNO4/c1-15(28)22-14-27(13-16-4-3-5-20(26)8-16)7-6-17(22)9-19-10-18-11-24(31-2)23(29)12-21(18)25(19)30/h3-8,11-12,14,19H,9-10,13H2,1-2H3/p+1 CZZJEWJXUQCNIT-UHFFFAOYSA-O 50291432 CHEMBL4159705 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291432 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291432&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44381841 104132984 ZINC27982980 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025346 [Br-].CC(=O)c1c[n+](Cc2cccc(Cl)c2)ccc1CC1Cc2cc(O)ccc2C1=O InChI=1S/C24H20ClNO3.BrH/c1-15(27)23-14-26(13-16-3-2-4-20(25)9-16)8-7-17(23)10-19-11-18-12-21(28)5-6-22(18)24(19)29;/h2-9,12,14,19H,10-11,13H2,1H3;1H AEIHXZPOGLDVDH-UHFFFAOYSA-N 50291433 CHEMBL4170331 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291433 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291433&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10505980 104132985 ZINC13834324 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025347 [Br-].COc1ccc2C(=O)C(Cc3cc[n+](Cc4cccc(Cl)c4)cc3C(C)=O)CCc2c1 InChI=1S/C26H25ClNO3.BrH/c1-17(29)25-16-28(15-18-4-3-5-22(27)12-18)11-10-20(25)13-21-7-6-19-14-23(31-2)8-9-24(19)26(21)30;/h3-5,8-12,14,16,21H,6-7,13,15H2,1-2H3;1H/q+1;/p-1 DGNIQIXSZBANIU-UHFFFAOYSA-M 50291434 CHEMBL4166513 Cholinesterase 496 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291434 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291434&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44382240 104132986 ZINC27995932 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025348 [Br-].COc1ccc2C(=O)C(Cc3cc[n+](Cc4ccccc4Cl)cc3C(C)=O)CCc2c1 InChI=1S/C26H25ClNO3.BrH/c1-17(29)24-16-28(15-21-5-3-4-6-25(21)27)12-11-19(24)13-20-8-7-18-14-22(31-2)9-10-23(18)26(20)30;/h3-6,9-12,14,16,20H,7-8,13,15H2,1-2H3;1H/q+1;/p-1 VLSYSTPQPOMCEG-UHFFFAOYSA-M 50291435 CHEMBL4177133 Cholinesterase 256 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291435 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291435&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44382177 104132987 ZINC27994298 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025349 [Br-].COc1ccc2C(=O)C(Cc3cc[n+](Cc4ccccc4F)cc3C(C)=O)CCc2c1 InChI=1S/C26H25FNO3.BrH/c1-17(29)24-16-28(15-21-5-3-4-6-25(21)27)12-11-19(24)13-20-8-7-18-14-22(31-2)9-10-23(18)26(20)30;/h3-6,9-12,14,16,20H,7-8,13,15H2,1-2H3;1H/q+1;/p-1 DMQXLFGOMHWVNS-UHFFFAOYSA-M 50291436 CHEMBL4168037 Cholinesterase 489 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291436 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291436&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10791955 104132988 ZINC04391839 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025350 [Br-].COc1ccc2C(=O)C(Cc3cc[n+](Cc4cccc(F)c4)cc3C(C)=O)CCc2c1 InChI=1S/C26H25FNO3.BrH/c1-17(29)25-16-28(15-18-4-3-5-22(27)12-18)11-10-20(25)13-21-7-6-19-14-23(31-2)8-9-24(19)26(21)30;/h3-5,8-12,14,16,21H,6-7,13,15H2,1-2H3;1H/q+1;/p-1 WHEWDFDDGJOOQU-UHFFFAOYSA-M 50291437 CHEMBL4160115 Cholinesterase 412 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291437 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291437&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 15871378 104132989 ZINC04391841 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025351 [Br-].COc1ccc2C(=O)C(Cc3cc[n+](Cc4ccccc4C)cc3C(C)=O)CCc2c1 InChI=1S/C27H28NO3.BrH/c1-18-6-4-5-7-23(18)16-28-13-12-21(26(17-28)19(2)29)14-22-9-8-20-15-24(31-3)10-11-25(20)27(22)30;/h4-7,10-13,15,17,22H,8-9,14,16H2,1-3H3;1H/q+1;/p-1 QKFKNUNYXQVNHL-UHFFFAOYSA-M 50291438 CHEMBL4161065 Cholinesterase 433 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291438 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291438&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 15871377 104132990 ZINC04391840 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025352 [Br-].COc1ccc2C(=O)C(Cc3cc[n+](Cc4cccc(C)c4)cc3C(C)=O)CCc2c1 InChI=1S/C27H28NO3.BrH/c1-18-5-4-6-20(13-18)16-28-12-11-22(26(17-28)19(2)29)14-23-8-7-21-15-24(31-3)9-10-25(21)27(23)30;/h4-6,9-13,15,17,23H,7-8,14,16H2,1-3H3;1H/q+1;/p-1 COEOOEKWISUIBD-UHFFFAOYSA-M 50291439 CHEMBL4168987 Cholinesterase 596 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291439 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291439&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 9982727 104132991 ZINC27986460 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025353 [Br-].COc1ccc2C(=O)C(Cc3cc[n+](Cc4cccc(c4)C(F)(F)F)cc3C(C)=O)CCc2c1 InChI=1S/C27H25F3NO3.BrH/c1-17(32)25-16-31(15-18-4-3-5-22(12-18)27(28,29)30)11-10-20(25)13-21-7-6-19-14-23(34-2)8-9-24(19)26(21)33;/h3-5,8-12,14,16,21H,6-7,13,15H2,1-2H3;1H/q+1;/p-1 WRRCVQIBIBJLKL-UHFFFAOYSA-M 50291440 CHEMBL4173405 Cholinesterase 2170 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291440 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291440&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44382236 104132992 ZINC27995903 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025354 [Br-].COc1ccc2C(=O)C(Cc3cc[n+](Cc4ccc(Cl)cc4)cc3C(C)=O)CCc2c1 InChI=1S/C26H25ClNO3.BrH/c1-17(29)25-16-28(15-18-3-7-22(27)8-4-18)12-11-20(25)13-21-6-5-19-14-23(31-2)9-10-24(19)26(21)30;/h3-4,7-12,14,16,21H,5-6,13,15H2,1-2H3;1H/q+1;/p-1 NWLPPPGDCFIINB-UHFFFAOYSA-M 50291504 CHEMBL4172353 Cholinesterase 6090 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291504 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291504&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44384076 104133056 ZINC28008890 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025355 [Br-].COc1ccc2C(=O)C(Cc3cc[n+](Cc4ccc(C)cc4)cc3C(C)=O)CCc2c1 InChI=1S/C27H28NO3.BrH/c1-18-4-6-20(7-5-18)16-28-13-12-22(26(17-28)19(2)29)14-23-9-8-21-15-24(31-3)10-11-25(21)27(23)30;/h4-7,10-13,15,17,23H,8-9,14,16H2,1-3H3;1H/q+1;/p-1 QWHMKJCQMUVDEW-UHFFFAOYSA-M 50291505 CHEMBL4172797 Cholinesterase 4140 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291505 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291505&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1904 104133057 ZINC03871255 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025356 [I-].CCC[n+]1ccc(CC2CCc3cc(OC)ccc3C2=O)c(c1)C(C)=O InChI=1S/C22H26NO3.HI/c1-4-10-23-11-9-17(21(14-23)15(2)24)12-18-6-5-16-13-19(26-3)7-8-20(16)22(18)25;/h7-9,11,13-14,18H,4-6,10,12H2,1-3H3;1H/q+1;/p-1 MGVWOUPGMSMZOC-UHFFFAOYSA-M 50291506 CHEMBL4162121 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291506 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291506&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44383846 104133058 ZINC28009048 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025357 [I-].COc1ccc2C(=O)C(Cc3cc[n+](CC4CCCCC4)cc3C(C)=O)CCc2c1 InChI=1S/C26H32NO3.HI/c1-18(28)25-17-27(16-19-6-4-3-5-7-19)13-12-21(25)14-22-9-8-20-15-23(30-2)10-11-24(20)26(22)29;/h10-13,15,17,19,22H,3-9,14,16H2,1-2H3;1H/q+1;/p-1 OGBZZEHCRVYAPW-UHFFFAOYSA-M 50291568 CHEMBL4176179 Cholinesterase 341 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291568 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291568&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44385049 104133120 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025358 [Br-].COc1ccc(cc1OC)C(=O)CCc1cc[n+](Cc2cccc(Cl)c2)cc1C(C)=O InChI=1S/C25H25ClNO4/c1-17(28)22-16-27(15-18-5-4-6-21(26)13-18)12-11-19(22)7-9-23(29)20-8-10-24(30-2)25(14-20)31-3/h4-6,8,10-14,16H,7,9,15H2,1-3H3/q+1 DHBVPDNLRAIJMT-UHFFFAOYSA-N 50291575 CHEMBL4165562 Cholinesterase 3198 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291575 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291575&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10400616 104133127 ZINC28086937 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025359 [Br-].COc1cc2CC(Cc3cc[n+](Cc4cccc(Cl)c4)cc3C(O)=O)C(=O)c2cc1OC InChI=1S/C25H22ClNO5.BrH/c1-31-22-11-17-10-18(24(28)20(17)12-23(22)32-2)9-16-6-7-27(14-21(16)25(29)30)13-15-4-3-5-19(26)8-15;/h3-8,11-12,14,18H,9-10,13H2,1-2H3;1H JRIRAJJTBLFVQF-UHFFFAOYSA-N 50291576 CHEMBL4173902 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291576 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291576&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44384847 104133128 ZINC28013638 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025360 [Br-].COC(=O)c1ccccc1C[n+]1ccc(CC2Cc3cc(OC)c(OC)cc3C2=O)c(c1)C(=O)Oc1c(Cl)cc(Cl)cc1Cl InChI=1S/C33H27Cl3NO7.BrH/c1-41-28-12-20-11-21(30(38)24(20)15-29(28)42-2)10-18-8-9-37(16-19-6-4-5-7-23(19)32(39)43-3)17-25(18)33(40)44-31-26(35)13-22(34)14-27(31)36;/h4-9,12-15,17,21H,10-11,16H2,1-3H3;1H/q+1;/p-1 AZKLKDTVZOFMDJ-UHFFFAOYSA-M 50291577 CHEMBL4159243 Cholinesterase 373 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291577 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291577&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10016216 104133129 ZINC01586995 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025361 [Br-].COc1cc2CC(Cc3cc[n+](Cc4ccc(cc4)S(N)(=O)=O)cc3C(N)=O)C(=O)c2cc1OC InChI=1S/C25H25N3O6S.BrH/c1-33-22-11-17-10-18(24(29)20(17)12-23(22)34-2)9-16-7-8-28(14-21(16)25(26)30)13-15-3-5-19(6-4-15)35(27,31)32;/h3-8,11-12,14,18H,9-10,13H2,1-2H3,(H3-,26,27,30,31,32);1H DHDPANJSNBBYDS-UHFFFAOYSA-N 50291578 CHEMBL4162617 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291578 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291578&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44384844 104133130 ZINC28016969 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025362 [Br-].COc1cc2CC(Cc3cc[n+](CCc4ccccc4)cc3C(N)=O)C(=O)c2cc1OC InChI=1S/C26H26N2O4.BrH/c1-31-23-14-19-13-20(25(29)21(19)15-24(23)32-2)12-18-9-11-28(16-22(18)26(27)30)10-8-17-6-4-3-5-7-17;/h3-7,9,11,14-16,20H,8,10,12-13H2,1-2H3,(H-,27,30);1H BAYNHPKOOCTZQJ-UHFFFAOYSA-N 50291579 CHEMBL4173313 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291579 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291579&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 21363972 104133131 ZINC20427227 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025363 [Br-].COc1cc2CC(Cc3cc[n+](Cc4cccc(C)n4)cc3C(N)=O)C(=O)c2cc1OC InChI=1S/C25H25N3O4.BrH/c1-15-5-4-6-19(27-15)13-28-8-7-16(21(14-28)25(26)30)9-18-10-17-11-22(31-2)23(32-3)12-20(17)24(18)29;/h4-8,11-12,14,18H,9-10,13H2,1-3H3,(H-,26,30);1H CYPUOEMJUDFMRB-UHFFFAOYSA-N 50291580 CHEMBL4170940 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291580 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291580&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 386898 104133132 ZINC01647618 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025364 COc1ccc2C(=O)C(CC3C=CN(Cc4ccc(Cl)cc4)C=C3C(C)=O)CCc2c1 InChI=1S/C26H26ClNO3/c1-17(29)25-16-28(15-18-3-7-22(27)8-4-18)12-11-20(25)13-21-6-5-19-14-23(31-2)9-10-24(19)26(21)30/h3-4,7-12,14,16,20-21H,5-6,13,15H2,1-2H3 CEKKZIPGBWGHEP-UHFFFAOYSA-N 50291581 CHEMBL4162281 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291581 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291581&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 21363970 104133133 ZINC28015732 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025365 COc1ccc2C(=O)C(CC3C=CN(Cc4ccc(C)cc4)C=C3C(C)=O)CCc2c1 InChI=1S/C27H29NO3/c1-18-4-6-20(7-5-18)16-28-13-12-22(26(17-28)19(2)29)14-23-9-8-21-15-24(31-3)10-11-25(21)27(23)30/h4-7,10-13,15,17,22-23H,8-9,14,16H2,1-3H3 JVYHNLLWXDLDGO-UHFFFAOYSA-N 50291582 CHEMBL4175814 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291582 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291582&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 386894 104133134 ZINC01647617 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025366 COc1ccc2C(=O)C(CC3C=CN(Cc4ccccc4C)C=C3C(N)=O)CCc2c1 InChI=1S/C26H28N2O3/c1-17-5-3-4-6-21(17)15-28-12-11-19(24(16-28)26(27)30)13-20-8-7-18-14-22(31-2)9-10-23(18)25(20)29/h3-6,9-12,14,16,19-20H,7-8,13,15H2,1-2H3,(H2,27,30) TUALDOHFKJXKNG-UHFFFAOYSA-N 50291583 CHEMBL4167954 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291583 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291583&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 386892 104133135 ZINC01647616 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025367 COc1cc2CCC(CC3C=CN(Cc4ccccc4)C=C3C(C)=O)C(=O)c2cc1OC InChI=1S/C27H29NO4/c1-18(29)24-17-28(16-19-7-5-4-6-8-19)12-11-21(24)13-22-10-9-20-14-25(31-2)26(32-3)15-23(20)27(22)30/h4-8,11-12,14-15,17,21-22H,9-10,13,16H2,1-3H3 HMFPNGCVUHYYTQ-UHFFFAOYSA-N 50291584 CHEMBL4160696 Cholinesterase 3970 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291584 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291584&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44384848 104133136 ZINC28013643 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025368 COc1cc2CCC(CC3C=CN(Cc4ccccc4)C=C3C(C)=O)C(=O)c2cc1OC InChI=1S/C27H29NO4/c1-18(29)24-17-28(16-19-7-5-4-6-8-19)12-11-21(24)13-22-10-9-20-14-25(31-2)26(32-3)15-23(20)27(22)30/h4-8,11-12,14-15,17,21-22H,9-10,13,16H2,1-3H3 HMFPNGCVUHYYTQ-UHFFFAOYSA-N 50291584 CHEMBL4160696 Cholinesterase 3970 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291584 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291584&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44384848 104133136 ZINC28013643 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025369 COc1cc2CCC(CC3C=CN(Cc4ccccc4)C=C3C(C)=O)C(=O)c2cc1OC InChI=1S/C27H29NO4/c1-18(29)24-17-28(16-19-7-5-4-6-8-19)12-11-21(24)13-22-10-9-20-14-25(31-2)26(32-3)15-23(20)27(22)30/h4-8,11-12,14-15,17,21-22H,9-10,13,16H2,1-3H3 HMFPNGCVUHYYTQ-UHFFFAOYSA-N 50291584 CHEMBL4160696 Cholinesterase 1670 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291584 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291584&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44384848 104133136 ZINC28013643 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025370 COc1cc2CC(CC3C=CN(Cc4cccc(Cl)c4)C=C3C(N)=O)C(=O)c2cc1OC InChI=1S/C25H25ClN2O4/c1-31-22-11-17-10-18(24(29)20(17)12-23(22)32-2)9-16-6-7-28(14-21(16)25(27)30)13-15-4-3-5-19(26)8-15/h3-8,11-12,14,16,18H,9-10,13H2,1-2H3,(H2,27,30) JEGKSGQGZBQTIZ-UHFFFAOYSA-N 50238234 CHEMBL4101303 Cholinesterase 14295 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50238234 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50238234&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137659864 385454137 CHEMBL4101303 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025371 COc1cc2CC(CC3C=CN(Cc4cccc(Cl)c4)C=C3C(N)=O)C(=O)c2cc1OC InChI=1S/C25H25ClN2O4/c1-31-22-11-17-10-18(24(29)20(17)12-23(22)32-2)9-16-6-7-28(14-21(16)25(27)30)13-15-4-3-5-19(26)8-15/h3-8,11-12,14,16,18H,9-10,13H2,1-2H3,(H2,27,30) JEGKSGQGZBQTIZ-UHFFFAOYSA-N 50238234 CHEMBL4101303 Cholinesterase 14200 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50238234 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50238234&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137659864 385454137 CHEMBL4101303 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025372 [Br-].COc1ccc(cc1OC)C(=O)CCCCc1cc[n+](Cc2cccc(Cl)c2)cc1C(N)=O InChI=1S/C26H27ClN2O4/c1-32-24-11-10-20(15-25(24)33-2)23(30)9-4-3-7-19-12-13-29(17-22(19)26(28)31)16-18-6-5-8-21(27)14-18/h5-6,8,10-15,17H,3-4,7,9,16H2,1-2H3,(H-,28,31)/p+1 YAXCJBQLATTZPW-UHFFFAOYSA-O 50291585 CHEMBL4170921 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291585 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291585&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10106943 104133137 ZINC28018271 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025373 [Br-].COc1cc2CC(CCCc3cc[n+](Cc4cccc(Cl)c4)cc3C(N)=O)C(=O)c2cc1OC InChI=1S/C27H27ClN2O4.BrH/c1-33-24-13-20-12-19(26(31)22(20)14-25(24)34-2)7-4-6-18-9-10-30(16-23(18)27(29)32)15-17-5-3-8-21(28)11-17;/h3,5,8-11,13-14,16,19H,4,6-7,12,15H2,1-2H3,(H-,29,32);1H RRZXBSYZUQTYCY-UHFFFAOYSA-N 50291586 CHEMBL4162993 Cholinesterase 3264 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291586 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291586&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11776085 104133138 ZINC01586996 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025374 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 3365 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025375 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 3.2 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025376 [Br-].COc1ccc2C(=O)C(Cc3cc[n+](Cc4ccccc4C)cc3C(N)=O)CCc2c1 InChI=1S/C26H26N2O3.BrH/c1-17-5-3-4-6-21(17)15-28-12-11-19(24(16-28)26(27)30)13-20-8-7-18-14-22(31-2)9-10-23(18)25(20)29;/h3-6,9-12,14,16,20H,7-8,13,15H2,1-2H3,(H-,27,30);1H FIVSKNCUFNZLBJ-UHFFFAOYSA-N 50291587 CHEMBL4174372 Cholinesterase 9115 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291587 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291587&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44384968 104133139 ZINC11535872 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025402 [Br-].COc1ccc2C(=O)C(Cc3cc[n+](Cc4ccccc4Cl)cc3C(N)=O)CCc2c1 InChI=1S/C25H23ClN2O3.BrH/c1-31-20-8-9-21-16(13-20)6-7-18(24(21)29)12-17-10-11-28(15-22(17)25(27)30)14-19-4-2-3-5-23(19)26;/h2-5,8-11,13,15,18H,6-7,12,14H2,1H3,(H-,27,30);1H LNHXCMJVQTWDPD-UHFFFAOYSA-N 50291588 CHEMBL4166464 Cholinesterase 2637 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291588 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291588&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 9991478 104133140 ZINC01586995 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025403 [Br-].COc1ccc(cc1OC)C(=O)CCc1cc[n+](Cc2cccc(Cl)c2)cc1C(N)=O InChI=1S/C24H23ClN2O4/c1-30-22-9-7-18(13-23(22)31-2)21(28)8-6-17-10-11-27(15-20(17)24(26)29)14-16-4-3-5-19(25)12-16/h3-5,7,9-13,15H,6,8,14H2,1-2H3,(H-,26,29)/p+1 WHLYPCOWHNPVQS-UHFFFAOYSA-O 50291589 CHEMBL4172883 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291589 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291589&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10423554 104133141 ZINC01586996 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50586405 Oc1c(CNCCCCCCCNc2c3CCCCc3nc3ccccc23)ccc2cccnc12 InChI=1S/C30H36N4O/c35-30-23(17-16-22-11-10-20-32-28(22)30)21-31-18-8-2-1-3-9-19-33-29-24-12-4-6-14-26(24)34-27-15-7-5-13-25(27)29/h4,6,10-12,14,16-17,20,31,35H,1-3,5,7-9,13,15,18-19,21H2,(H,33,34) UNCVWUOMIWFTQP-UHFFFAOYSA-N 50322770 7-{[7-(1,2,3,4-Tetrahydroacridin-9-ylamino)heptylamino]methyl}-quinolin-8-ol Dihydrochloride::CHEMBL1173761 Cholinesterase 150 ChEMBL 10.1021/jm100329q 10.7270/Q22Z15QR 20545360 Fernandez-Bachiller, MI; Perez, C; Gonzalez-Munoz, GC; Conde, S; Lopez, MG; Villarroya, M; Garcia, AG; Rodriguez-Franco, MI Instituto de Quimica Medica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50322770 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50322770&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46854585 104144299 CHEMBL1173761 ZINC53230007 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50586406 Oc1c(CNCCCCCCCCNc2c3CCCCc3nc3ccccc23)ccc2cccnc12 InChI=1S/C31H38N4O/c36-31-24(18-17-23-12-11-21-33-29(23)31)22-32-19-9-3-1-2-4-10-20-34-30-25-13-5-7-15-27(25)35-28-16-8-6-14-26(28)30/h5,7,11-13,15,17-18,21,32,36H,1-4,6,8-10,14,16,19-20,22H2,(H,34,35) NGLMDAPCUOIPCG-UHFFFAOYSA-N 50322771 7-{[8-(1,2,3,4-Tetrahydroacridin-9-ylamino)octylamino]methyl}-quinolin-8-ol Dihydrochloride::CHEMBL1172817 Cholinesterase 30 ChEMBL 10.1021/jm100329q 10.7270/Q22Z15QR 20545360 Fernandez-Bachiller, MI; Perez, C; Gonzalez-Munoz, GC; Conde, S; Lopez, MG; Villarroya, M; Garcia, AG; Rodriguez-Franco, MI Instituto de Quimica Medica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50322771 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50322771&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46854586 104144300 CHEMBL1172817 ZINC53246951 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50586407 Oc1c(CNCCCCCCCCCNc2c3CCCCc3nc3ccccc23)ccc2cccnc12 InChI=1S/C32H40N4O/c37-32-25(19-18-24-13-12-22-34-30(24)32)23-33-20-10-4-2-1-3-5-11-21-35-31-26-14-6-8-16-28(26)36-29-17-9-7-15-27(29)31/h6,8,12-14,16,18-19,22,33,37H,1-5,7,9-11,15,17,20-21,23H2,(H,35,36) YZEBCQMSYNIRDF-UHFFFAOYSA-N 50322766 7-{[9-(1,2,3,4-Tetrahydroacridin-9-ylamino)nonylamino]methyl}-quinolin-8-ol Dihydrochloride::CHEMBL1173662 Cholinesterase 5 ChEMBL 10.1021/jm100329q 10.7270/Q22Z15QR 20545360 Fernandez-Bachiller, MI; Perez, C; Gonzalez-Munoz, GC; Conde, S; Lopez, MG; Villarroya, M; Garcia, AG; Rodriguez-Franco, MI Instituto de Quimica Medica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50322766 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50322766&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46854587 104144295 CHEMBL1173662 ZINC53243881 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50586408 Oc1c(CNCCCCCCCCCCNc2c3CCCCc3nc3ccccc23)ccc2cccnc12 InChI=1S/C33H42N4O/c38-33-26(20-19-25-14-13-23-35-31(25)33)24-34-21-11-5-3-1-2-4-6-12-22-36-32-27-15-7-9-17-29(27)37-30-18-10-8-16-28(30)32/h7,9,13-15,17,19-20,23,34,38H,1-6,8,10-12,16,18,21-22,24H2,(H,36,37) ZVZBTSRMSDMCLW-UHFFFAOYSA-N 50322772 7-{[10-(1,2,3,4-Tetrahydroacridin-9-ylamino)decylamino]methyl}-quinolin-8-ol Dihydrochloride::CHEMBL1173663 Cholinesterase 65 ChEMBL 10.1021/jm100329q 10.7270/Q22Z15QR 20545360 Fernandez-Bachiller, MI; Perez, C; Gonzalez-Munoz, GC; Conde, S; Lopez, MG; Villarroya, M; Garcia, AG; Rodriguez-Franco, MI Instituto de Quimica Medica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50322772 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50322772&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46854883 104144301 CHEMBL1173663 ZINC53243887 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50586409 CN(CCCNCc1ccc2cccnc2c1O)CCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C30H37N5O/c1-35(19-7-16-31-21-23-15-14-22-9-6-17-32-28(22)30(23)36)20-8-18-33-29-24-10-2-4-12-26(24)34-27-13-5-3-11-25(27)29/h2,4,6,9-10,12,14-15,17,31,36H,3,5,7-8,11,13,16,18-21H2,1H3,(H,33,34) MYMSIBNBHHKOSO-UHFFFAOYSA-N 50322774 7-{{3-{Methyl[3-(1,2,3,4-tetrahydroacridin-9-ylamino)propyl)-amino]propylamino}methyl}quinolin-8-ol Dihydrochloride::CHEMBL1173042 Cholinesterase 50 ChEMBL 10.1021/jm100329q 10.7270/Q22Z15QR 20545360 Fernandez-Bachiller, MI; Perez, C; Gonzalez-Munoz, GC; Conde, S; Lopez, MG; Villarroya, M; Garcia, AG; Rodriguez-Franco, MI Instituto de Quimica Medica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50322774 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50322774&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46855032 104144303 CHEMBL1173042 ZINC53243593 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50586410 Cc1ccc2ccc(CNCCCCCCCCNc3c4CCCCc4nc4ccccc34)c(O)c2n1 InChI=1S/C32H40N4O/c1-23-16-17-24-18-19-25(32(37)30(24)35-23)22-33-20-10-4-2-3-5-11-21-34-31-26-12-6-8-14-28(26)36-29-15-9-7-13-27(29)31/h6,8,12,14,16-19,33,37H,2-5,7,9-11,13,15,20-22H2,1H3,(H,34,36) KDCDKEGHPMCTKJ-UHFFFAOYSA-N 50322767 2-Methyl-7-{[8-(1,2,3,4-tetrahydroacridin-9-ylamino)octylamino]methyl}quinolin-8-ol Dihydrochloride::CHEMBL1172618 Cholinesterase 2 ChEMBL 10.1021/jm100329q 10.7270/Q22Z15QR 20545360 Fernandez-Bachiller, MI; Perez, C; Gonzalez-Munoz, GC; Conde, S; Lopez, MG; Villarroya, M; Garcia, AG; Rodriguez-Franco, MI Instituto de Quimica Medica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50322767 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50322767&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46854734 104144296 CHEMBL1172618 ZINC53230203 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50586411 Cc1ccc2ccc(CNCCCCCCCCCCNc3c4CCCCc4nc4ccccc34)c(O)c2n1 InChI=1S/C34H44N4O/c1-25-18-19-26-20-21-27(34(39)32(26)37-25)24-35-22-12-6-4-2-3-5-7-13-23-36-33-28-14-8-10-16-30(28)38-31-17-11-9-15-29(31)33/h8,10,14,16,18-21,35,39H,2-7,9,11-13,15,17,22-24H2,1H3,(H,36,38) MRVWXRPDQGSSNS-UHFFFAOYSA-N 50322777 2-Methyl-7-{[10-(1,2,3,4-tetrahydroacridin-9-ylamino)decylamino]methyl}quinolin-8-ol Dihydrochloride::CHEMBL1173521 Cholinesterase 7 ChEMBL 10.1021/jm100329q 10.7270/Q22Z15QR 20545360 Fernandez-Bachiller, MI; Perez, C; Gonzalez-Munoz, GC; Conde, S; Lopez, MG; Villarroya, M; Garcia, AG; Rodriguez-Franco, MI Instituto de Quimica Medica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50322777 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50322777&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46854736 104144306 CHEMBL1173521 ZINC53226585 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50586412 Oc1c(CNCCCCCCCCCNc2c3CCCCc3nc3ccccc23)cc(Cl)c2cccnc12 InChI=1S/C32H39ClN4O/c33-27-21-23(32(38)31-24(27)15-12-20-36-31)22-34-18-10-4-2-1-3-5-11-19-35-30-25-13-6-8-16-28(25)37-29-17-9-7-14-26(29)30/h6,8,12-13,15-16,20-21,34,38H,1-5,7,9-11,14,17-19,22H2,(H,35,37) WBQRDKIQMPMEDD-UHFFFAOYSA-N 50322768 5-Chloro-7-{[9-(1,2,3,4-tetrahydroacridin-9-ylamino)nonylamino]methyl}quinolin-8-ol Dihydrochloride::CHEMBL1172762 Cholinesterase 6.5 ChEMBL 10.1021/jm100329q 10.7270/Q22Z15QR 20545360 Fernandez-Bachiller, MI; Perez, C; Gonzalez-Munoz, GC; Conde, S; Lopez, MG; Villarroya, M; Garcia, AG; Rodriguez-Franco, MI Instituto de Quimica Medica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50322768 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50322768&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46855186 104144297 CHEMBL1172762 ZINC53246942 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50586413 CN(CCCNCc1cc(Cl)c2cccnc2c1O)CCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C30H36ClN5O/c1-36(17-7-14-32-20-21-19-25(31)22-11-6-15-34-29(22)30(21)37)18-8-16-33-28-23-9-2-4-12-26(23)35-27-13-5-3-10-24(27)28/h2,4,6,9,11-12,15,19,32,37H,3,5,7-8,10,13-14,16-18,20H2,1H3,(H,33,35) PAIAUVBTMGLHFA-UHFFFAOYSA-N 50322782 5-Chloro-7-{{3-{methyl[3-(1,2,3,4-tetrahydroacridin-9-ylamino)propyl]amino}propylamino}methyl}quinolin-8-ol Dihydrochloride::CHEMBL1173052 Cholinesterase 30 ChEMBL 10.1021/jm100329q 10.7270/Q22Z15QR 20545360 Fernandez-Bachiller, MI; Perez, C; Gonzalez-Munoz, GC; Conde, S; Lopez, MG; Villarroya, M; Garcia, AG; Rodriguez-Franco, MI Instituto de Quimica Medica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50322782 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50322782&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46855351 104144311 CHEMBL1173052 ZINC53243664 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50586414 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 10 ChEMBL 10.1021/jm100329q 10.7270/Q22Z15QR 20545360 Fernandez-Bachiller, MI; Perez, C; Gonzalez-Munoz, GC; Conde, S; Lopez, MG; Villarroya, M; Garcia, AG; Rodriguez-Franco, MI Instituto de Quimica Medica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582901 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OC InChI=1S/C20H18NO4/c1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2/h3-4,7-10H,5-6,11H2,1-2H3/q+1 YBHILYKTIRIUTE-UHFFFAOYSA-N 50203126 3,4-dimethoxy-6,7-dihydro-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinolin-5-ylium::9,10-Dimethoxy-5,6-dihydro-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ylium::9,10-Dimethoxy-5,6-dihydro-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ylium chloride::9,10-dimethoxy-5,6-dihydro-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ylium; chloride::BERBERINE::Berberinechloride::CHEMBL12089::berberine dimer::cid_12456 Cholinesterase 18200 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50203126 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50203126&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search BER 7A3Y,1JUM,6JWD,3R6R,3VW2,4DBK,3BTI,7MSV,7X8M,3NP6,3D6Y,7X32,5Y0V,2QVD,7C34,7N7D,7N7E 12456 104082463 16118 CHEMBL12089 DB04115 C00757 ZINC03779067 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582902 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCOc1ccc(C)cc1 InChI=1S/C29H28NO5/c1-19-4-7-22(8-5-19)32-12-3-13-33-29-24-17-30-11-10-21-15-27-28(35-18-34-27)16-23(21)25(30)14-20(24)6-9-26(29)31-2/h4-9,14-17H,3,10-13,18H2,1-2H3/q+1 WCXIBCLILZKUIS-UHFFFAOYSA-N 50320888 9-O-[3-(4-Methyl-phenoxyl)propyl]-berberine bromide::CHEMBL1165188 Cholinesterase 1810 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320888 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320888&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46907255 104142417 CHEMBL1165188 ZINC49803880 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582903 COc1ccc(OCCCOc2c(OC)ccc3cc4-c5cc6OCOc6cc5CC[n+]4cc23)cc1 InChI=1S/C29H28NO6/c1-31-21-5-7-22(8-6-21)33-12-3-13-34-29-24-17-30-11-10-20-15-27-28(36-18-35-27)16-23(20)25(30)14-19(24)4-9-26(29)32-2/h4-9,14-17H,3,10-13,18H2,1-2H3/q+1 UDMALYSREHNBLR-UHFFFAOYSA-N 50320889 9-O-[3-(4-Methoxy-phenoxyl)-propyl]-berberine bromide::CHEMBL1165190 Cholinesterase 2860 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320889 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320889&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46907291 104142418 CHEMBL1165190 ZINC49803882 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582904 COc1ccc(OCCCCOc2c(OC)ccc3cc4-c5cc6OCOc6cc5CC[n+]4cc23)cc1 InChI=1S/C30H30NO6/c1-32-22-6-8-23(9-7-22)34-13-3-4-14-35-30-25-18-31-12-11-21-16-28-29(37-19-36-28)17-24(21)26(31)15-20(25)5-10-27(30)33-2/h5-10,15-18H,3-4,11-14,19H2,1-2H3/q+1 WVZAQPXTJMNNLJ-UHFFFAOYSA-N 50320890 9-O-[3-(4-Methoxy-phenoxyl)butyl]-berberine bromide::CHEMBL1165272 Cholinesterase 2290 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320890 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320890&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46907293 104142419 CHEMBL1165272 ZINC49803773 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582905 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCOc1ccc(Cl)cc1 InChI=1S/C28H25ClNO5/c1-31-25-8-3-18-13-24-22-15-27-26(34-17-35-27)14-19(22)9-10-30(24)16-23(18)28(25)33-12-2-11-32-21-6-4-20(29)5-7-21/h3-8,13-16H,2,9-12,17H2,1H3/q+1 JJPOWRAZNKDAPG-UHFFFAOYSA-N 50320891 9-O-[3-(4-Chloro-phenoxyl)propyl]-berberine bromide::CHEMBL1164137 Cholinesterase 1800 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320891 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320891&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46907295 104142420 CHEMBL1164137 ZINC49803477 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582906 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCCOc1ccc(Cl)cc1 InChI=1S/C29H27ClNO5/c1-32-26-9-4-19-14-25-23-16-28-27(35-18-36-28)15-20(23)10-11-31(25)17-24(19)29(26)34-13-3-2-12-33-22-7-5-21(30)6-8-22/h4-9,14-17H,2-3,10-13,18H2,1H3/q+1 UBNNFRWMIILCFJ-UHFFFAOYSA-N 50320892 9-O-[3-(4-Chloro-phenoxyl)butyl]-berberine bromide::CHEMBL1163817 Cholinesterase 2200 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320892 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320892&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46906611 104142421 CHEMBL1163817 ZINC49803185 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582907 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCOc1ccc(Br)cc1 InChI=1S/C28H25BrNO5/c1-31-25-8-3-18-13-24-22-15-27-26(34-17-35-27)14-19(22)9-10-30(24)16-23(18)28(25)33-12-2-11-32-21-6-4-20(29)5-7-21/h3-8,13-16H,2,9-12,17H2,1H3/q+1 YCLXPLCVVISSBE-UHFFFAOYSA-N 50320893 9-O-[3-(4-Bromo-phenoxyl)propyl]-berberine bromide::CHEMBL1163818 Cholinesterase 4240 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320893 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320893&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46906613 104142422 CHEMBL1163818 ZINC49803186 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582908 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCCOc1ccc(Br)cc1 InChI=1S/C29H27BrNO5/c1-32-26-9-4-19-14-25-23-16-28-27(35-18-36-28)15-20(23)10-11-31(25)17-24(19)29(26)34-13-3-2-12-33-22-7-5-21(30)6-8-22/h4-9,14-17H,2-3,10-13,18H2,1H3/q+1 XSYYQOISAKERBC-UHFFFAOYSA-N 50320894 9-O-[3-(4-Bromo-phenoxyl)butyl]-berberine bromide::CHEMBL1163985 Cholinesterase 5440 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320894 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320894&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46906615 104142423 CHEMBL1163985 ZINC49803093 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582909 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCOc1ccc(cc1)[N+]([O-])=O InChI=1S/C28H25N2O7/c1-33-25-8-3-18-13-24-22-15-27-26(36-17-37-27)14-19(22)9-10-29(24)16-23(18)28(25)35-12-2-11-34-21-6-4-20(5-7-21)30(31)32/h3-8,13-16H,2,9-12,17H2,1H3/q+1 LIDBCEVCQGCJNE-UHFFFAOYSA-N 50320895 9-O-[3-(4-Nitro-phenoxyl)propyl]-berberine bromide::CHEMBL1164074 Cholinesterase 2830 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320895 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320895&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46906657 104142424 CHEMBL1164074 ZINC49803033 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582910 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCCOc1ccc(cc1)[N+]([O-])=O InChI=1S/C29H27N2O7/c1-34-26-9-4-19-14-25-23-16-28-27(37-18-38-28)15-20(23)10-11-30(25)17-24(19)29(26)36-13-3-2-12-35-22-7-5-21(6-8-22)31(32)33/h4-9,14-17H,2-3,10-13,18H2,1H3/q+1 APBFBLUUWLQIQX-UHFFFAOYSA-N 50320896 9-O-[3-(4-Nitro-phenoxyl)butyl]-berberine bromide::CHEMBL1165676 Cholinesterase 2050 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320896 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320896&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46906659 104142425 CHEMBL1165676 ZINC49807655 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582911 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCCOc1ccccn1 InChI=1S/C28H27N2O5/c1-31-24-8-7-19-14-23-21-16-26-25(34-18-35-26)15-20(21)9-11-30(23)17-22(19)28(24)33-13-5-4-12-32-27-6-2-3-10-29-27/h2-3,6-8,10,14-17H,4-5,9,11-13,18H2,1H3/q+1 MZPIENUCQFUDBE-UHFFFAOYSA-N 50320897 9-O-[3-(2-Pyridinoxyl)butyl]-berberine bromide::CHEMBL1163829 Cholinesterase 4160 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320897 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320897&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46906661 104142426 CHEMBL1163829 ZINC49802845 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582912 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCNc1ccccc1 InChI=1S/C28H27N2O4/c1-31-25-9-8-19-14-24-22-16-27-26(33-18-34-27)15-20(22)10-12-30(24)17-23(19)28(25)32-13-5-11-29-21-6-3-2-4-7-21/h2-4,6-9,14-17,29H,5,10-13,18H2,1H3/q+1 BRNHZXILANUSDI-UHFFFAOYSA-N 50320898 9-O-[3-(Phenylamino)propyl]-berberine bromide::CHEMBL1164163 Cholinesterase 1760 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320898 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320898&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46906703 104142427 CHEMBL1164163 ZINC49807910 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582913 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCN(C)c1ccccc1 InChI=1S/C29H29N2O4/c1-30(22-7-4-3-5-8-22)12-6-14-33-29-24-18-31-13-11-21-16-27-28(35-19-34-27)17-23(21)25(31)15-20(24)9-10-26(29)32-2/h3-5,7-10,15-18H,6,11-14,19H2,1-2H3/q+1 SIMQPRATGUMRRJ-UHFFFAOYSA-N 50320899 9-O-[3-(N-Methyl-phenylamino)propyl]-berberine bromide::CHEMBL1163831 Cholinesterase 2170 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320899 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320899&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46906705 104142428 CHEMBL1163831 ZINC49803131 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582914 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCOc1ccc2ccccc2c1 InChI=1S/C32H28NO5/c1-34-29-10-8-23-16-28-26-18-31-30(37-20-38-31)17-24(26)11-12-33(28)19-27(23)32(29)36-14-4-13-35-25-9-7-21-5-2-3-6-22(21)15-25/h2-3,5-10,15-19H,4,11-14,20H2,1H3/q+1 BGFIGOPXAIGFNA-UHFFFAOYSA-N 50320900 9-O-[3-(Naphthalen-2-yloxy)propyl]-berberine bromide::CHEMBL1163907 Cholinesterase 2200 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320900 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320900&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46906707 104142429 CHEMBL1163907 ZINC49802511 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582915 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCCOc1ccc2ccccc2c1 InChI=1S/C33H30NO5/c1-35-30-11-9-24-17-29-27-19-32-31(38-21-39-32)18-25(27)12-13-34(29)20-28(24)33(30)37-15-5-4-14-36-26-10-8-22-6-2-3-7-23(22)16-26/h2-3,6-11,16-20H,4-5,12-15,21H2,1H3/q+1 ASGAQZKMYHVVJH-UHFFFAOYSA-N 50320901 9-O-[3-(Naphthalen-2-yloxy)butyl]-berberine bromide::CHEMBL1164250 Cholinesterase 1100 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320901 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320901&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46906763 104142430 CHEMBL1164250 ZINC49807916 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582916 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCSc1ccc2ccccc2c1 InChI=1S/C32H28NO4S/c1-34-29-10-8-23-16-28-26-18-31-30(36-20-37-31)17-24(26)11-12-33(28)19-27(23)32(29)35-13-4-14-38-25-9-7-21-5-2-3-6-22(21)15-25/h2-3,5-10,15-19H,4,11-14,20H2,1H3/q+1 OQIGIFPIZMGWEI-UHFFFAOYSA-N 50320902 9-O-[3-(Naphthalene-2-ylthio)propyl]-berberine bromide::CHEMBL1163909 Cholinesterase 548 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320902 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320902&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46906765 104142431 CHEMBL1163909 ZINC49802513 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582917 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCCSc1ccc2ccccc2c1 InChI=1S/C33H30NO4S/c1-35-30-11-9-24-17-29-27-19-32-31(37-21-38-32)18-25(27)12-13-34(29)20-28(24)33(30)36-14-4-5-15-39-26-10-8-22-6-2-3-7-23(22)16-26/h2-3,6-11,16-20H,4-5,12-15,21H2,1H3/q+1 YQUIPEQWEOEKRO-UHFFFAOYSA-N 50320903 9-O-[3-(Naphthalene-2-ylthio)butyl]-berberine bromide::CHEMBL1163991 Cholinesterase 78 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320903 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320903&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46906767 104142432 CHEMBL1163991 ZINC49802673 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582918 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCC(=O)Nc1ccccc1 InChI=1S/C28H24N2O5/c1-32-24-8-7-18-13-23-21-15-26-25(34-17-35-26)14-19(21)9-11-30(23)16-22(18)28(24)33-12-10-27(31)29-20-5-3-2-4-6-20/h2-8,13-16H,9-12,17H2,1H3/p+1 GFLOZEGMDHHSEW-UHFFFAOYSA-O 50320904 9-O-[(3-Oxo-3-phenylamino)propyl]-berberine bromide::CHEMBL1164079 Cholinesterase 2180 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320904 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320904&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46906833 104142433 CHEMBL1164079 ZINC49803164 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582919 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCC(=O)Nc1ccc(C)cc1 InChI=1S/C29H26N2O5/c1-18-3-6-21(7-4-18)30-28(32)10-12-34-29-23-16-31-11-9-20-14-26-27(36-17-35-26)15-22(20)24(31)13-19(23)5-8-25(29)33-2/h3-8,13-16H,9-12,17H2,1-2H3/p+1 NKNUDDNLOUKOKU-UHFFFAOYSA-O 50320905 9-O-[(3-Oxo-3-p-tolylamino)propyl]-berberine bromide::CHEMBL1164080 Cholinesterase 1310 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320905 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320905&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46906835 104142434 CHEMBL1164080 ZINC49803165 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582920 COc1ccc(NC(=O)CCOc2c(OC)ccc3cc4-c5cc6OCOc6cc5CC[n+]4cc23)cc1 InChI=1S/C29H26N2O6/c1-33-21-6-4-20(5-7-21)30-28(32)10-12-35-29-23-16-31-11-9-19-14-26-27(37-17-36-26)15-22(19)24(31)13-18(23)3-8-25(29)34-2/h3-8,13-16H,9-12,17H2,1-2H3/p+1 DGYOYLKTHWEJNH-UHFFFAOYSA-O 50320906 9-O-[(3-Oxo-3-p-methoxyamino)propyl]-berberine bromide::CHEMBL1164683 Cholinesterase 1010 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320906 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320906&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46907253 104142435 CHEMBL1164683 ZINC49807420 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582921 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCC(=O)Nc1ccc(Cl)cc1 InChI=1S/C28H23ClN2O5/c1-33-24-7-2-17-12-23-21-14-26-25(35-16-36-26)13-18(21)8-10-31(23)15-22(17)28(24)34-11-9-27(32)30-20-5-3-19(29)4-6-20/h2-7,12-15H,8-11,16H2,1H3/p+1 RCYKNNVLJSCSFQ-UHFFFAOYSA-O 50320907 9-O-[(3-Oxo-3-p-chlorophenylamino)propyl]-berberine bromide::CHEMBL1164259 Cholinesterase 1680 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320907 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320907&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46906837 104142436 CHEMBL1164259 ZINC49808152 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582922 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCC(=O)Nc1ccc(cc1)[N+]([O-])=O InChI=1S/C28H23N3O7/c1-35-24-7-2-17-12-23-21-14-26-25(37-16-38-26)13-18(21)8-10-30(23)15-22(17)28(24)36-11-9-27(32)29-19-3-5-20(6-4-19)31(33)34/h2-7,12-15H,8-11,16H2,1H3/p+1 CKONAVZMTWPGKI-UHFFFAOYSA-O 50320908 9-O-[(3-Oxo-3-p-nitrophenylamino)propyl]-berberine bromide::CHEMBL1164081 Cholinesterase 5530 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320908 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320908&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46906893 104142437 CHEMBL1164081 C02125 ZINC49802350 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582923 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCC[n+]1ccccc1 InChI=1S/C26H24N2O4/c1-29-23-6-5-18-13-22-20-15-25-24(31-17-32-25)14-19(20)7-10-28(22)16-21(18)26(23)30-12-11-27-8-3-2-4-9-27/h2-6,8-9,13-16H,7,10-12,17H2,1H3/q+2 SZJVMXBUMGSKBI-UHFFFAOYSA-N 50320909 9-O-[(2-Pyridinium)bromide ethyl]-berberine bromide::CHEMBL1164169 Cholinesterase 2820 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320909 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320909&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46906895 104142438 CHEMBL1164169 ZINC49808142 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582924 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCC[n+]1ccccc1 InChI=1S/C27H26N2O4/c1-30-24-7-6-19-14-23-21-16-26-25(32-18-33-26)15-20(21)8-12-29(23)17-22(19)27(24)31-13-5-11-28-9-3-2-4-10-28/h2-4,6-7,9-10,14-17H,5,8,11-13,18H2,1H3/q+2 UUWMOHVVUKZBMG-UHFFFAOYSA-N 50320910 9-O-[(3-Pyridinium bromide)propyl]-berberine dibromide::CHEMBL1164170 Cholinesterase 13300 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320910 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320910&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44583330 104142439 CHEMBL1164170 ZINC40424834 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582925 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCC[n+]1cccc(C)c1 InChI=1S/C27H26N2O4/c1-18-4-3-8-28(15-18)10-11-31-27-22-16-29-9-7-20-13-25-26(33-17-32-25)14-21(20)23(29)12-19(22)5-6-24(27)30-2/h3-6,8,12-16H,7,9-11,17H2,1-2H3/q+2 QGMYWZRHXYJXFT-UHFFFAOYSA-N 50320911 9-O-[(2-(3-Methyl)pyridinium bromide)ethyl]-berberine bromide::CHEMBL1164261 Cholinesterase 2460 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320911 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320911&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46871784 104142440 CHEMBL1164261 ZINC49808274 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582926 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCC[n+]1cccc(C)c1 InChI=1S/C28H28N2O4/c1-19-5-3-9-29(16-19)10-4-12-32-28-23-17-30-11-8-21-14-26-27(34-18-33-26)15-22(21)24(30)13-20(23)6-7-25(28)31-2/h3,5-7,9,13-17H,4,8,10-12,18H2,1-2H3/q+2 KZENMAWGLCWOQJ-UHFFFAOYSA-N 50320912 9-O-[3-(3-Methyl pyridinium bromide)propyl]-berberine bromide::CHEMBL1164349 Cholinesterase 15800 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320912 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320912&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44583270 104142441 CHEMBL1164349 ZINC40956760 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582927 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCOc1c(OC)ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc12 InChI=1S/C40H34N2O8/c1-43-33-5-3-23-13-31-27-17-37-35(47-21-49-37)15-25(27)7-9-41(31)19-29(23)39(33)45-11-12-46-40-30-20-42-10-8-26-16-36-38(50-22-48-36)18-28(26)32(42)14-24(30)4-6-34(40)44-2/h3-6,13-20H,7-12,21-22H2,1-2H3/q+2 KHTZNQPZFCEMGU-UHFFFAOYSA-N 50320913 1,2-Di(berberine-9-O-yl)ethane dibromide::CHEMBL1163560 Cholinesterase 1110 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320913 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320913&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46906937 104142442 CHEMBL1163560 ZINC49803945 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582928 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCOc1c(OC)ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc12 InChI=1S/C41H36N2O8/c1-44-34-6-4-24-14-32-28-18-38-36(48-22-50-38)16-26(28)8-10-42(32)20-30(24)40(34)46-12-3-13-47-41-31-21-43-11-9-27-17-37-39(51-23-49-37)19-29(27)33(43)15-25(31)5-7-35(41)45-2/h4-7,14-21H,3,8-13,22-23H2,1-2H3/q+2 AOMDJTYUICYNJP-UHFFFAOYSA-N 50320914 1,3-Di(berberine-9-O-yl)ethane dibromide::CHEMBL1163253 Cholinesterase 531 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320914 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320914&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11643451 104142443 CHEMBL1163253 ZINC28475126 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582929 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCCOc1c(OC)ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc12 InChI=1S/C42H38N2O8/c1-45-35-7-5-25-15-33-29-19-39-37(49-23-51-39)17-27(29)9-11-43(33)21-31(25)41(35)47-13-3-4-14-48-42-32-22-44-12-10-28-18-38-40(52-24-50-38)20-30(28)34(44)16-26(32)6-8-36(42)46-2/h5-8,15-22H,3-4,9-14,23-24H2,1-2H3/q+2 SJALLAIALHPUMH-UHFFFAOYSA-N 50320915 1,4-Di(berberine-9-O-yl)ethane dibromide::CHEMBL1165194 Cholinesterase 231 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50320915 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50320915&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44400818 104142444 CHEMBL1165194 ZINC28475129 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50582930 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 15700 ChEMBL 10.1016/j.bmc.2010.04.063 10.7270/Q2513ZC5 20471843 Huang, L; Luo, Z; He, F; Lu, J; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50620145 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 5.2 ChEMBL 10.1016/j.ejmech.2010.08.054 10.7270/Q2NZ87X6 21111515 Tomassoli, I; Ismaili, L; Pudlo, M; de Los Rios, C; Soriano, E; Colmena, I; Gandia, L; Rivas, L; Samadi, A; Marco-Contelles, J; Refouvelet, B Université de Franche-Comté http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50620146 CCN1C(=O)NC2C(C(=O)Nc3c2cccc3[N+]([O-])=O)=C1C InChI=1S/C14H14N4O4/c1-3-17-7(2)10-12(16-14(17)20)8-5-4-6-9(18(21)22)11(8)15-13(10)19/h4-6,12H,3H2,1-2H3,(H,15,19)(H,16,20) HGZVFTLDYVJYTF-UHFFFAOYSA-N 50335633 CHEMBL1651814::rac-3-Ethyl-4-methyl-7-nitro-6,10b-dihydropyrimido[5,4-c]quinoline-2,5(1H,3H)-dione Cholinesterase >30000 ChEMBL 10.1016/j.ejmech.2010.08.054 10.7270/Q2NZ87X6 21111515 Tomassoli, I; Ismaili, L; Pudlo, M; de Los Rios, C; Soriano, E; Colmena, I; Gandia, L; Rivas, L; Samadi, A; Marco-Contelles, J; Refouvelet, B Université de Franche-Comté http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50335633 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50335633&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 50993934 125085735 CHEMBL1651814 ZINC66066107 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50620147 CN1C(=O)NC2C(C(=O)Nc3c2cccc3[N+]([O-])=O)=C1C InChI=1S/C13H12N4O4/c1-6-9-11(15-13(19)16(6)2)7-4-3-5-8(17(20)21)10(7)14-12(9)18/h3-5,11H,1-2H3,(H,14,18)(H,15,19) PQQCOFMACIGRST-UHFFFAOYSA-N 50335634 CHEMBL1651813::rac-3,4-Dimethyl-7-nitro-6,10b-dihydropyrimido[5,4-c]quinoline-2,5(1H,3H)-dione Cholinesterase >30000 ChEMBL 10.1016/j.ejmech.2010.08.054 10.7270/Q2NZ87X6 21111515 Tomassoli, I; Ismaili, L; Pudlo, M; de Los Rios, C; Soriano, E; Colmena, I; Gandia, L; Rivas, L; Samadi, A; Marco-Contelles, J; Refouvelet, B Université de Franche-Comté http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50335634 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50335634&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 50994015 125085736 CHEMBL1651813 ZINC66103101 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50620148 Oc1ccc(\C=N\NC(=O)c2c(O)c3c(Cl)cccc3[nH]c2=O)c(O)c1 InChI=1S/C17H12ClN3O5/c18-10-2-1-3-11-13(10)15(24)14(16(25)20-11)17(26)21-19-7-8-4-5-9(22)6-12(8)23/h1-7,22-23H,(H,21,26)(H2,20,24,25)/b19-7+ RIIOYYVUUQTLBU-FBCYGCLPSA-N 50335635 5-Chloro-N'-[(E)-(2,4-dihydroxyphenyl)methylidene]-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carbohydrazide::CHEMBL1651812 Cholinesterase >30000 ChEMBL 10.1016/j.ejmech.2010.08.054 10.7270/Q2NZ87X6 21111515 Tomassoli, I; Ismaili, L; Pudlo, M; de Los Rios, C; Soriano, E; Colmena, I; Gandia, L; Rivas, L; Samadi, A; Marco-Contelles, J; Refouvelet, B Université de Franche-Comté http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50335635 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50335635&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54730028 125085737 CHEMBL1651812 ZINC66066105 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50620149 Cn1c2ccccc2c(O)c(C(=O)NCCNCCNCCN)c1=O InChI=1S/C17H25N5O3/c1-22-13-5-3-2-4-12(13)15(23)14(17(22)25)16(24)21-11-10-20-9-8-19-7-6-18/h2-5,19-20,23H,6-11,18H2,1H3,(H,21,24) KVYYZNYNSCMRTP-UHFFFAOYSA-N 50335636 CHEMBL1651811::N-[2-({2-[(2-Aminoethyl)amino]ethyl}amino)ethyl]-4-hydroxy-1-methyl-2-oxo-1,2-dihydroquinoline-3-carboxamide Cholinesterase 5200 ChEMBL 10.1016/j.ejmech.2010.08.054 10.7270/Q2NZ87X6 21111515 Tomassoli, I; Ismaili, L; Pudlo, M; de Los Rios, C; Soriano, E; Colmena, I; Gandia, L; Rivas, L; Samadi, A; Marco-Contelles, J; Refouvelet, B Université de Franche-Comté http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50335636 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50335636&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54730029 125085738 CHEMBL1651811 ZINC66066104 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50620150 NCCNCCNCCNC(=O)c1c(O)c2ccccc2[nH]c1=O InChI=1S/C16H23N5O3/c17-5-6-18-7-8-19-9-10-20-15(23)13-14(22)11-3-1-2-4-12(11)21-16(13)24/h1-4,18-19H,5-10,17H2,(H,20,23)(H2,21,22,24) FCPJAACLGKPDJK-UHFFFAOYSA-N 50335637 CHEMBL1651810::N-[2-({2-[(2-Aminoethyl)amino]ethyl}amino)ethyl]-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxamide Cholinesterase 19000 ChEMBL 10.1016/j.ejmech.2010.08.054 10.7270/Q2NZ87X6 21111515 Tomassoli, I; Ismaili, L; Pudlo, M; de Los Rios, C; Soriano, E; Colmena, I; Gandia, L; Rivas, L; Samadi, A; Marco-Contelles, J; Refouvelet, B Université de Franche-Comté http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50335637 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50335637&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54730030 125085739 CHEMBL1651810 ZINC66066218 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50621459 CCCCC(=O)N(CCCCN=c1n2CCCCCCc2nc2ccccc12)CCCN=c1n2CCCCCCc2nc2ccccc12 InChI=1S/C40H55N7O/c1-2-3-25-38(48)45(29-18-27-42-40-33-20-11-13-22-35(33)44-37-24-9-5-7-16-31-47(37)40)28-17-14-26-41-39-32-19-10-12-21-34(32)43-36-23-8-4-6-15-30-46(36)39/h10-13,19-22H,2-9,14-18,23-31H2,1H3 QDLADSKESQSXNF-UHFFFAOYSA-N 50336107 CHEMBL1669462::N-(4-(8,9,10,11-Tetrahydro-6H-azocino[2,1-b]quinazolin-13(7H)-ylideneamino)butyl)-N-(3-(8,9,10,11-tetrahydro-6H-azocino[2,1-b]quinazolin-13(7H)-ylideneamino)propyl)-pentanamide Cholinesterase 12.9 ChEMBL 10.1016/j.bmc.2010.12.034 10.7270/Q2TH8N04 21232964 Chen, X; Tikhonova, IG; Decker, M Queen's University Belfast http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336107 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336107&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53318878 125086209 CHEMBL1669462 ZINC66073747 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50621460 CC(C)CC(=O)N(CCCCN=c1n2CCCCCCc2nc2ccccc12)CCCN=c1n2CCCCCCc2nc2ccccc12 InChI=1S/C40H55N7O/c1-31(2)30-38(48)45(27-17-25-42-40-33-19-10-12-21-35(33)44-37-23-8-4-6-15-29-47(37)40)26-16-13-24-41-39-32-18-9-11-20-34(32)43-36-22-7-3-5-14-28-46(36)39/h9-12,18-21,31H,3-8,13-17,22-30H2,1-2H3 RLOWMEOOGXHRCE-UHFFFAOYSA-N 50336108 3-Methyl-N-(4-(8,9,10,11-tetrahydro-6H-azocino-[2,1-b]quinazolin-13(7H)-ylideneamino)butyl)-N-(3-(8,9,-10,11-tetrahydro-6H-azocino[2,1-b]quinazolin-13(7H)-ylideneamino)propyl)butanamide::CHEMBL1669463 Cholinesterase 8.1 ChEMBL 10.1016/j.bmc.2010.12.034 10.7270/Q2TH8N04 21232964 Chen, X; Tikhonova, IG; Decker, M Queen's University Belfast http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336108 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336108&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53325468 125086210 CHEMBL1669463 ZINC66074207 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50621461 CC(C)CCC(=O)N(CCCCN=c1n2CCCCCCc2nc2ccccc12)CCCN=c1n2CCCCCCc2nc2ccccc12 InChI=1S/C41H57N7O/c1-32(2)24-25-39(49)46(29-17-27-43-41-34-19-10-12-21-36(34)45-38-23-8-4-6-15-31-48(38)41)28-16-13-26-42-40-33-18-9-11-20-35(33)44-37-22-7-3-5-14-30-47(37)40/h9-12,18-21,32H,3-8,13-17,22-31H2,1-2H3 FWJHBDBMRLMYEQ-UHFFFAOYSA-N 50336109 4-Methyl-N-(4-(8,9,10,11-tetrahydro-6H-azocino-[2,1-b]quinazolin-13(7H)-ylideneamino)butyl)-N-(3-(8,9,-10,11-tetrahydro-6H-azocino[2,1-b]quinazolin-13(7H)-ylideneamino)propyl)pentanamide::CHEMBL1669464 Cholinesterase 3 ChEMBL 10.1016/j.bmc.2010.12.034 10.7270/Q2TH8N04 21232964 Chen, X; Tikhonova, IG; Decker, M Queen's University Belfast http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336109 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336109&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53325469 125086211 CHEMBL1669464 ZINC72122201 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50621464 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 8400 ChEMBL 10.1016/j.bmc.2010.12.034 10.7270/Q2TH8N04 21232964 Chen, X; Tikhonova, IG; Decker, M Queen's University Belfast http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50621465 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 6.4 ChEMBL 10.1016/j.bmc.2010.12.034 10.7270/Q2TH8N04 21232964 Chen, X; Tikhonova, IG; Decker, M Queen's University Belfast http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50621467 C(\N=c1/n2CCCc2nc2ccccc12)c1ccccc1 InChI=1S/C18H17N3/c1-2-7-14(8-3-1)13-19-18-15-9-4-5-10-16(15)20-17-11-6-12-21(17)18/h1-5,7-10H,6,11-13H2/b19-18- PDHVHMZUUOWWAP-HNENSFHCSA-N 50336113 CHEMBL1669443::N-(2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-ylidene)-1-phenylmethanamine Cholinesterase 1900 ChEMBL 10.1016/j.bmc.2010.12.034 10.7270/Q2TH8N04 21232964 Chen, X; Tikhonova, IG; Decker, M Queen's University Belfast http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336113 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336113&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53318876 125086215 CHEMBL1669443 ZINC66097347 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50621469 C(\N=c1/n2CCCCCCc2nc2ccccc12)c1ccccc1 InChI=1S/C21H23N3/c1-2-9-15-24-20(14-6-1)23-19-13-8-7-12-18(19)21(24)22-16-17-10-4-3-5-11-17/h3-5,7-8,10-13H,1-2,6,9,14-16H2/b22-21- NNAHAIKGFFBXOZ-DQRAZIAOSA-N 50336114 1-phenyl-N-(8,9,10,11-tetrahydro-6H-azocino[2,1-b]quinazolin-13(7H)-ylidene)methanamine::CHEMBL1667881 Cholinesterase 1100 ChEMBL 10.1016/j.bmc.2010.12.034 10.7270/Q2TH8N04 21232964 Chen, X; Tikhonova, IG; Decker, M Queen's University Belfast http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336114 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336114&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53320629 125086216 CHEMBL1667881 ZINC66097349 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50614019 CN(C)c1nc2nc3CCCCc3c(N)c2cc1C#N InChI=1S/C15H17N5/c1-20(2)15-9(8-16)7-11-13(17)10-5-3-4-6-12(10)18-14(11)19-15/h7H,3-6H2,1-2H3,(H2,17,18,19) NIZNCODILBCKNL-UHFFFAOYSA-N 50333148 5-Amino-2-(dimethylamino)-6,7,8,9-tetrahydrobenzo[1,8-b]-naphthyridine-3-carbonitrile::CHEMBL1644721 Cholinesterase 5200 ChEMBL 10.1016/j.bmc.2010.11.040 10.7270/Q22R3RX5 21163662 Samadi, A; Valderas, C; de los Rios, C; Bastida, A; Chioua, M; Gonzalez-Lafuente, L; Colmena, I; Gandia, L; Romero, A; Del Barrio, L; Martin-de-Saavedra, MD; Lopez, MG; Villarroya, M; Marco-Contelles, J Laboratorio de Radicales Libres y Qu�mica Computacional (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50333148 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50333148&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 50994091 125083250 CHEMBL1644721 ZINC66258479 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50614020 Nc1c2CCCCc2nc2nc(N3CCCC3)c(cc12)C#N InChI=1S/C17H19N5/c18-10-11-9-13-15(19)12-5-1-2-6-14(12)20-16(13)21-17(11)22-7-3-4-8-22/h9H,1-8H2,(H2,19,20,21) RITVMMLBCWXEQF-UHFFFAOYSA-N 50333149 5-Amino-2-pyrrolidin-1-yl-6,7,8,9-tetrahydrobenzo[1,8-b]-naphthyridine-3-carbonitrile::CHEMBL1644722 Cholinesterase 5600 ChEMBL 10.1016/j.bmc.2010.11.040 10.7270/Q22R3RX5 21163662 Samadi, A; Valderas, C; de los Rios, C; Bastida, A; Chioua, M; Gonzalez-Lafuente, L; Colmena, I; Gandia, L; Romero, A; Del Barrio, L; Martin-de-Saavedra, MD; Lopez, MG; Villarroya, M; Marco-Contelles, J Laboratorio de Radicales Libres y Qu�mica Computacional (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50333149 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50333149&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 50994007 125083251 CHEMBL1644722 ZINC66258480 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50614021 Nc1c2CCCCc2nc2nc(N3CCCCC3)c(cc12)C#N InChI=1S/C18H21N5/c19-11-12-10-14-16(20)13-6-2-3-7-15(13)21-17(14)22-18(12)23-8-4-1-5-9-23/h10H,1-9H2,(H2,20,21,22) GAZLRMJAXHIEQV-UHFFFAOYSA-N 50333150 5-Amino-2-piperidin-1-yl-6,7,8,9-tetrahydrobenzo[1,8-b]-naphthyridine-3-carbonitrile::CHEMBL1644723 Cholinesterase 3600 ChEMBL 10.1016/j.bmc.2010.11.040 10.7270/Q22R3RX5 21163662 Samadi, A; Valderas, C; de los Rios, C; Bastida, A; Chioua, M; Gonzalez-Lafuente, L; Colmena, I; Gandia, L; Romero, A; Del Barrio, L; Martin-de-Saavedra, MD; Lopez, MG; Villarroya, M; Marco-Contelles, J Laboratorio de Radicales Libres y Qu�mica Computacional (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50333150 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50333150&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53326508 125083252 CHEMBL1644723 ZINC66258481 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50614022 Nc1c2CCCCc2nc2nc(NCC#C)c(cc12)C#N InChI=1S/C16H15N5/c1-2-7-19-15-10(9-17)8-12-14(18)11-5-3-4-6-13(11)20-16(12)21-15/h1,8H,3-7H2,(H3,18,19,20,21) VBYOUHRZXNCQNZ-UHFFFAOYSA-N 50333151 5-Amino-2-(prop-2-yn-1-ylamino)-6,7,8,9-tetrahydrobenzo[1,8-b]-naphthyridine-3-carbonitrile::CHEMBL1644724 Cholinesterase 2600 ChEMBL 10.1016/j.bmc.2010.11.040 10.7270/Q22R3RX5 21163662 Samadi, A; Valderas, C; de los Rios, C; Bastida, A; Chioua, M; Gonzalez-Lafuente, L; Colmena, I; Gandia, L; Romero, A; Del Barrio, L; Martin-de-Saavedra, MD; Lopez, MG; Villarroya, M; Marco-Contelles, J Laboratorio de Radicales Libres y Qu�mica Computacional (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50333151 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50333151&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53318652 125083253 CHEMBL1644724 ZINC66258419 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50614023 CN(C)c1nc2nc3CCCCc3c(N)c2c(-c2ccccc2)c1C#N InChI=1S/C21H21N5/c1-26(2)21-15(12-22)17(13-8-4-3-5-9-13)18-19(23)14-10-6-7-11-16(14)24-20(18)25-21/h3-5,8-9H,6-7,10-11H2,1-2H3,(H2,23,24,25) LKCYVFMFRAVOAD-UHFFFAOYSA-N 50333152 5-Amino-2-(dimethylamino)-4-phenyl-6,7,8,9-tetrahydrobenzo[1,8-b]-naphthyridine-3-carbonitrile::CHEMBL1644725 Cholinesterase 7500 ChEMBL 10.1016/j.bmc.2010.11.040 10.7270/Q22R3RX5 21163662 Samadi, A; Valderas, C; de los Rios, C; Bastida, A; Chioua, M; Gonzalez-Lafuente, L; Colmena, I; Gandia, L; Romero, A; Del Barrio, L; Martin-de-Saavedra, MD; Lopez, MG; Villarroya, M; Marco-Contelles, J Laboratorio de Radicales Libres y Qu�mica Computacional (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50333152 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50333152&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53323936 125083254 CHEMBL1644725 ZINC66252176 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50614024 COc1nc2nc3CCCCc3c(N)c2cc1C#N InChI=1S/C14H14N4O/c1-19-14-8(7-15)6-10-12(16)9-4-2-3-5-11(9)17-13(10)18-14/h6H,2-5H2,1H3,(H2,16,17,18) PQCQFSDRRXOQKV-UHFFFAOYSA-N 50333153 5-Amino-2-(methyloxy)-6,7,8,9-tetrahydrobenzo[1,8-b]-naphthyridine-3-carbonitrile::CHEMBL1644726 Cholinesterase 9600 ChEMBL 10.1016/j.bmc.2010.11.040 10.7270/Q22R3RX5 21163662 Samadi, A; Valderas, C; de los Rios, C; Bastida, A; Chioua, M; Gonzalez-Lafuente, L; Colmena, I; Gandia, L; Romero, A; Del Barrio, L; Martin-de-Saavedra, MD; Lopez, MG; Villarroya, M; Marco-Contelles, J Laboratorio de Radicales Libres y Qu�mica Computacional (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50333153 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50333153&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 50994006 125083255 CHEMBL1644726 ZINC66260157 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50614025 CCOc1nc2nc3CCCCc3c(N)c2cc1C#N InChI=1S/C15H16N4O/c1-2-20-15-9(8-16)7-11-13(17)10-5-3-4-6-12(10)18-14(11)19-15/h7H,2-6H2,1H3,(H2,17,18,19) KHRJTKKBYLOCCX-UHFFFAOYSA-N 50333154 5-Amino-2-(ethyloxy)-6,7,8,9-tetrahydrobenzo[1,8-b]-naphthyridine-3-carbonitrile::CHEMBL1644727 Cholinesterase >30000 ChEMBL 10.1016/j.bmc.2010.11.040 10.7270/Q22R3RX5 21163662 Samadi, A; Valderas, C; de los Rios, C; Bastida, A; Chioua, M; Gonzalez-Lafuente, L; Colmena, I; Gandia, L; Romero, A; Del Barrio, L; Martin-de-Saavedra, MD; Lopez, MG; Villarroya, M; Marco-Contelles, J Laboratorio de Radicales Libres y Qu�mica Computacional (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50333154 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50333154&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53320391 125083256 CHEMBL1644727 ZINC66251261 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50614026 COc1nc2nc3CCCCc3c(N)c2c(-c2ccccc2)c1C#N InChI=1S/C20H18N4O/c1-25-20-14(11-21)16(12-7-3-2-4-8-12)17-18(22)13-9-5-6-10-15(13)23-19(17)24-20/h2-4,7-8H,5-6,9-10H2,1H3,(H2,22,23,24) REKIKIBCVHTJKU-UHFFFAOYSA-N 50333155 5-Amino-2-methoxy-4-phenyl-6,7,8,9-tetrahydrobenzo[1,8-b]-naphthyridine-3-carbonitrile::CHEMBL1644728 Cholinesterase 5100 ChEMBL 10.1016/j.bmc.2010.11.040 10.7270/Q22R3RX5 21163662 Samadi, A; Valderas, C; de los Rios, C; Bastida, A; Chioua, M; Gonzalez-Lafuente, L; Colmena, I; Gandia, L; Romero, A; Del Barrio, L; Martin-de-Saavedra, MD; Lopez, MG; Villarroya, M; Marco-Contelles, J Laboratorio de Radicales Libres y Qu�mica Computacional (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50333155 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50333155&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53322899 125083257 CHEMBL1644728 ZINC66252177 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50614027 Nc1c2CCCCc2nc2nc(Cl)c(cc12)C#N InChI=1S/C13H11ClN4/c14-12-7(6-15)5-9-11(16)8-3-1-2-4-10(8)17-13(9)18-12/h5H,1-4H2,(H2,16,17,18) XJVOLELQFQHFOK-UHFFFAOYSA-N 50333156 5-Amino-2-chloro-6,7,8,9-tetrahydrobenzo[1,8-b]-naphthyridine-3-carbonitrile::CHEMBL1644729 Cholinesterase >30000 ChEMBL 10.1016/j.bmc.2010.11.040 10.7270/Q22R3RX5 21163662 Samadi, A; Valderas, C; de los Rios, C; Bastida, A; Chioua, M; Gonzalez-Lafuente, L; Colmena, I; Gandia, L; Romero, A; Del Barrio, L; Martin-de-Saavedra, MD; Lopez, MG; Villarroya, M; Marco-Contelles, J Laboratorio de Radicales Libres y Qu�mica Computacional (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50333156 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50333156&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53318653 125083258 CHEMBL1644729 ZINC66252178 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50614028 Nc1c2CCCCc2nc2nc(Cl)c(C#N)c(-c3ccccc3)c12 InChI=1S/C19H15ClN4/c20-18-13(10-21)15(11-6-2-1-3-7-11)16-17(22)12-8-4-5-9-14(12)23-19(16)24-18/h1-3,6-7H,4-5,8-9H2,(H2,22,23,24) BYMWEAGNYQSZHG-UHFFFAOYSA-N 50333157 5-Amino-2-chloro-4-phenyl-6,7,8,9-tetrahydrobenzo[1,8-b]-naphthyridine-3-carbonitrile::CHEMBL1644730 Cholinesterase >30000 ChEMBL 10.1016/j.bmc.2010.11.040 10.7270/Q22R3RX5 21163662 Samadi, A; Valderas, C; de los Rios, C; Bastida, A; Chioua, M; Gonzalez-Lafuente, L; Colmena, I; Gandia, L; Romero, A; Del Barrio, L; Martin-de-Saavedra, MD; Lopez, MG; Villarroya, M; Marco-Contelles, J Laboratorio de Radicales Libres y Qu�mica Computacional (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50333157 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50333157&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53322597 125083259 CHEMBL1644730 ZINC66252179 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50614029 COc1nc2nc3CCN(Cc4ccccc4)Cc3c(N)c2cc1C#N InChI=1S/C20H19N5O/c1-26-20-14(10-21)9-15-18(22)16-12-25(11-13-5-3-2-4-6-13)8-7-17(16)23-19(15)24-20/h2-6,9H,7-8,11-12H2,1H3,(H2,22,23,24) OVZKDPDAXFAGDB-UHFFFAOYSA-N 50333158 5-Amino-7-benzyl-2-methoxy-6,7,8,9-tetrahydropyrido[2,3-b][1,6]naphthyridine-3-carbonitrile::CHEMBL1644731 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2010.11.040 10.7270/Q22R3RX5 21163662 Samadi, A; Valderas, C; de los Rios, C; Bastida, A; Chioua, M; Gonzalez-Lafuente, L; Colmena, I; Gandia, L; Romero, A; Del Barrio, L; Martin-de-Saavedra, MD; Lopez, MG; Villarroya, M; Marco-Contelles, J Laboratorio de Radicales Libres y Qu�mica Computacional (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50333158 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50333158&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53326509 125083260 CHEMBL1644731 ZINC66252180 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50614030 Nc1c2CN(Cc3ccccc3)CCc2nc2nc(Cl)c(cc12)C#N InChI=1S/C19H16ClN5/c20-18-13(9-21)8-14-17(22)15-11-25(10-12-4-2-1-3-5-12)7-6-16(15)23-19(14)24-18/h1-5,8H,6-7,10-11H2,(H2,22,23,24) AJSOITFEAIHORD-UHFFFAOYSA-N 50333159 5-Amino-7-benzyl-2-chloro-6,7,8,9-tetrahydropyrido[2,3-b][1,6]naphthyridin-3-carbonitrile::CHEMBL1644818 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2010.11.040 10.7270/Q22R3RX5 21163662 Samadi, A; Valderas, C; de los Rios, C; Bastida, A; Chioua, M; Gonzalez-Lafuente, L; Colmena, I; Gandia, L; Romero, A; Del Barrio, L; Martin-de-Saavedra, MD; Lopez, MG; Villarroya, M; Marco-Contelles, J Laboratorio de Radicales Libres y Qu�mica Computacional (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50333159 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50333159&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53322745 125083261 CHEMBL1644818 ZINC66251858 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50614031 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 5.2 ChEMBL 10.1016/j.bmc.2010.11.040 10.7270/Q22R3RX5 21163662 Samadi, A; Valderas, C; de los Rios, C; Bastida, A; Chioua, M; Gonzalez-Lafuente, L; Colmena, I; Gandia, L; Romero, A; Del Barrio, L; Martin-de-Saavedra, MD; Lopez, MG; Villarroya, M; Marco-Contelles, J Laboratorio de Radicales Libres y Qu�mica Computacional (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50613087 CN1CCN(CC1)NCCN1c2ccccc2Sc2ccccc12 InChI=1S/C19H24N4S/c1-21-12-14-22(15-13-21)20-10-11-23-16-6-2-4-8-18(16)24-19-9-5-3-7-17(19)23/h2-9,20H,10-15H2,1H3 MWUAENAQTGSUCO-UHFFFAOYSA-N 50332797 CHEMBL1629794::N-[2-(10H-Phenothiazin-10-yl)ethyl]-4-methylpiperazin-1-amine dihydrochloride Cholinesterase 50000 ChEMBL 10.1016/j.ejmech.2010.09.039 10.7270/Q2KW5G84 20926162 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50332797 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50332797&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3064153 125082899 CHEMBL1629794 ZINC33882174 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50613088 CN(C)CCC(=O)NN1c2ccccc2Sc2cc(Cl)ccc12 InChI=1S/C17H18ClN3OS/c1-20(2)10-9-17(22)19-21-13-5-3-4-6-15(13)23-16-11-12(18)7-8-14(16)21/h3-8,11H,9-10H2,1-2H3,(H,19,22) OGSIAWJVXJZZOI-UHFFFAOYSA-N 50332798 CHEMBL1629795::N-(3-Chloro-10H-phenothiazin-10-yl)-3-(dimethylamino)propanamide Cholinesterase 700 ChEMBL 10.1016/j.ejmech.2010.09.039 10.7270/Q2KW5G84 20926162 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50332798 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50332798&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44555764 125082900 CHEMBL1629795 ZINC66258596 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50613089 CN1CCN(CC(=O)NN2c3ccccc3Sc3cc(Cl)ccc23)CC1 InChI=1S/C19H21ClN4OS/c1-22-8-10-23(11-9-22)13-19(25)21-24-15-4-2-3-5-17(15)26-18-12-14(20)6-7-16(18)24/h2-7,12H,8-11,13H2,1H3,(H,21,25) CSEGGUSEIOAOHR-UHFFFAOYSA-N 50332799 CHEMBL1629796::N-(3-Chloro-10H-phenothiazin-10-yl)-2-(4-methylpiperazin-1-yl)acetamide Cholinesterase 500 ChEMBL 10.1016/j.ejmech.2010.09.039 10.7270/Q2KW5G84 20926162 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50332799 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50332799&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44555641 125082901 CHEMBL1629796 ZINC66258597 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50613090 CC(=O)NN1c2ccccc2Sc2ccc(Cl)cc12 InChI=1S/C14H11ClN2OS/c1-9(18)16-17-11-4-2-3-5-13(11)19-14-7-6-10(15)8-12(14)17/h2-8H,1H3,(H,16,18) FYLMQXBBLMJFGT-UHFFFAOYSA-N 50332800 CHEMBL1629797::N-(2-Chloro-10H-phenothiazin-10-yl)acetamide Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2010.09.039 10.7270/Q2KW5G84 20926162 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50332800 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50332800&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12466700 125082902 CHEMBL1629797 ZINC39233815 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50613091 NN1c2ccccc2Sc2ccccc12 InChI=1S/C12H10N2S/c13-14-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)14/h1-8H,13H2 NHEQIMHXBMAEIJ-UHFFFAOYSA-N 50332801 10H-Phenothiazin-10-amine::CHEMBL1629798 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2010.09.039 10.7270/Q2KW5G84 20926162 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50332801 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50332801&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12466701 125082903 CHEMBL1629798 ZINC39233816 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50613092 CC(=O)n1n(C(C)=O)c2c(Cl)cccc2sc2ccccc12 InChI=1S/C16H13ClN2O2S/c1-10(20)18-13-7-3-4-8-14(13)22-15-9-5-6-12(17)16(15)19(18)11(2)21/h3-9H,1-2H3 WXINTIBNCAQMMV-UHFFFAOYSA-N 50332802 1,1'-(4-Chlorodibenzo[b,f][1,4,5]thiadiazepine-5,6-diyl)diethanone::CHEMBL1629799 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2010.09.039 10.7270/Q2KW5G84 20926162 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50332802 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50332802&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12946015 125082904 CHEMBL1629799 ZINC66258598 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50613093 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 10 ChEMBL 10.1016/j.ejmech.2010.09.039 10.7270/Q2KW5G84 20926162 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50620002 CC(C)O[C@@H]1O[C@H](COC(=O)\C=C\C[C@H](C)CCC=C(C)C)[C@@H](O)[C@H](O)[C@H]1O InChI=1S/C21H36O7/c1-13(2)8-6-9-15(5)10-7-11-17(22)26-12-16-18(23)19(24)20(25)21(28-16)27-14(3)4/h7-8,11,14-16,18-21,23-25H,6,9-10,12H2,1-5H3/b11-7+/t15-,16-,18-,19+,20-,21-/m1/s1 MHJOAVXYKHQVFT-NWECRORVSA-N 50335594 CHEMBL1651084::citrusoside A Cholinesterase 376000 ChEMBL 10.1021/np100531x 10.7270/Q2PV6KN8 20964319 Youkwan, J; Sutthivaiyakit, S; Sutthivaiyakit, P Ramkhamhaeng University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50335594 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50335594&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 50901156 125085696 70469 CHEMBL1651084 ZINC66103313 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50620003 CC(C)O[C@@H]1O[C@H](COC(=O)CC(C)(O)CC(=O)O[C@H](CC\C(C)=C\COc2c3ccoc3cc3oc(=O)ccc23)C(C)(C)O)[C@@H](O)[C@H](O)[C@H]1O InChI=1S/C36H48O15/c1-19(2)48-34-32(42)31(41)30(40)25(50-34)18-47-28(38)16-36(6,44)17-29(39)51-26(35(4,5)43)9-7-20(3)11-13-46-33-21-8-10-27(37)49-24(21)15-23-22(33)12-14-45-23/h8,10-12,14-15,19,25-26,30-32,34,40-44H,7,9,13,16-18H2,1-6H3/b20-11+/t25-,26-,30-,31+,32-,34-,36?/m1/s1 UBQMQNATXUCNPX-RCRVUDQWSA-N 50335595 CHEMBL1651085::citrusoside B Cholinesterase 339000 ChEMBL 10.1021/np100531x 10.7270/Q2PV6KN8 20964319 Youkwan, J; Sutthivaiyakit, S; Sutthivaiyakit, P Ramkhamhaeng University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50335595 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50335595&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 50901241 125085697 70470 CHEMBL1651085 ZINC72123800 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50620004 CC1(C)O[C@H]1COc1cc(=O)oc2cc3occc3cc12 InChI=1S/C16H14O5/c1-16(2)14(21-16)8-19-12-7-15(17)20-13-6-11-9(3-4-18-11)5-10(12)13/h3-7,14H,8H2,1-2H3/t14-/m0/s1 NUCBCBCPICFGMZ-AWEZNQCLSA-N 50335596 (+)-oxypeucedanin::CHEMBL1651087 Cholinesterase 64000 ChEMBL 10.1021/np100531x 10.7270/Q2PV6KN8 20964319 Youkwan, J; Sutthivaiyakit, S; Sutthivaiyakit, P Ramkhamhaeng University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50335596 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50335596&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53316971 125085698 CHEMBL1651087 ZINC00225574 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50620005 CC(C)=CCOc1c2ccoc2cc2oc(=O)ccc12 InChI=1S/C16H14O4/c1-10(2)5-7-19-16-11-3-4-15(17)20-14(11)9-13-12(16)6-8-18-13/h3-6,8-9H,7H2,1-2H3 IGWDEVSBEKYORK-UHFFFAOYSA-N 50242377 CHEMBL448060::isoimperatorin Cholinesterase 23100 ChEMBL 10.1021/np100531x 10.7270/Q2PV6KN8 20964319 Youkwan, J; Sutthivaiyakit, S; Sutthivaiyakit, P Ramkhamhaeng University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50242377 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50242377&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 68081 104099046 66071 CHEMBL448060 C16976 ZINC00296185 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50620006 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 3200 ChEMBL 10.1021/np100531x 10.7270/Q2PV6KN8 20964319 Youkwan, J; Sutthivaiyakit, S; Sutthivaiyakit, P Ramkhamhaeng University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50620007 COC(C)(C)[C@H](O)CC\C(C)=C\COc1c2ccoc2cc2oc(=O)ccc12 InChI=1S/C22H26O6/c1-14(5-7-19(23)22(2,3)25-4)9-11-27-21-15-6-8-20(24)28-18(15)13-17-16(21)10-12-26-17/h6,8-10,12-13,19,23H,5,7,11H2,1-4H3/b14-9+/t19-/m1/s1 DXUCGAHPDLXISA-CECLQJIQSA-N 50335597 6'-hydroxy-7'-methoxybergamottin::CHEMBL1651089 Cholinesterase 11200 ChEMBL 10.1021/np100531x 10.7270/Q2PV6KN8 20964319 Youkwan, J; Sutthivaiyakit, S; Sutthivaiyakit, P Ramkhamhaeng University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50335597 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50335597&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53316972 125085699 70474 CHEMBL1651089 ZINC38209316 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50620008 C\C(CC[C@@H](O)C(C)(C)O)=C/COc1c2ccoc2cc2oc(=O)ccc12 InChI=1S/C21H24O6/c1-13(4-6-18(22)21(2,3)24)8-10-26-20-14-5-7-19(23)27-17(14)12-16-15(20)9-11-25-16/h5,7-9,11-12,18,22,24H,4,6,10H2,1-3H3/b13-8+/t18-/m1/s1 IXZUPBUEKFXTSD-INMULRNOSA-N 50310824 6',7'-dihydroxybergamottin::CHEMBL1079119 Cholinesterase 15400 ChEMBL 10.1021/np100531x 10.7270/Q2PV6KN8 20964319 Youkwan, J; Sutthivaiyakit, S; Sutthivaiyakit, P Ramkhamhaeng University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50310824 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50310824&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12082365 104145185 70475 CHEMBL1079119 ZINC13829481 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50621441 C(CCC\N=c1\n2CCCc2nc2ccccc12)CCC\N=c1/n2CCCc2nc2ccccc12 InChI=1S/C29H34N6/c1(2-8-18-30-28-22-12-4-6-14-24(22)32-26-16-10-20-34(26)28)3-9-19-31-29-23-13-5-7-15-25(23)33-27-17-11-21-35(27)29/h4-7,12-15H,1-3,8-11,16-21H2/b30-28-,31-29+ PGTWZAKNFNDYAO-OAZKENCHSA-N 50194103 CHEMBL387257::N,N'-bis[2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-ylidene]heptane-1,7-diamine Cholinesterase 88 ChEMBL 10.1016/j.bmc.2010.12.034 10.7270/Q2TH8N04 21232964 Chen, X; Tikhonova, IG; Decker, M Queen's University Belfast http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50194103 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50194103&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 16082583 104076446 CHEMBL387257 ZINC49781938 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50621442 CN(CCCN=c1n2CCCc2nc2ccccc12)CCC\N=c1\n2CCCc2nc2ccccc12 InChI=1S/C29H35N7/c1-34(18-8-16-30-28-22-10-2-4-12-24(22)32-26-14-6-20-35(26)28)19-9-17-31-29-23-11-3-5-13-25(23)33-27-15-7-21-36(27)29/h2-5,10-13H,6-9,14-21H2,1H3/b30-28+,31-29? WFFNREUHEBAURM-XQQSBWCKSA-N 50336110 CHEMBL1669445::N1-(2,3-Dihydropyrrolo[2,1-b]quinazolin-9(1H)-ylidene)-N3-(3-(2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-ylideneamino)propyl)-N3-methylpropane-1,3-diamine Cholinesterase 547.1 ChEMBL 10.1016/j.bmc.2010.12.034 10.7270/Q2TH8N04 21232964 Chen, X; Tikhonova, IG; Decker, M Queen's University Belfast http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336110 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336110&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53317596 125086212 CHEMBL1669445 ZINC66080376 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50621443 CC(=O)N(CCCN=c1n2CCCc2nc2ccccc12)CCC\N=c1\n2CCCc2nc2ccccc12 InChI=1S/C30H35N7O/c1-22(38)35(18-8-16-31-29-23-10-2-4-12-25(23)33-27-14-6-20-36(27)29)19-9-17-32-30-24-11-3-5-13-26(24)34-28-15-7-21-37(28)30/h2-5,10-13H,6-9,14-21H2,1H3/b31-29+,32-30? RFCAXCSXCHJQAP-DNBXQQMDSA-N 50336111 CHEMBL1669446::N,N-Bis(3-(2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-ylideneamino)propyl)acetamide Cholinesterase 267 ChEMBL 10.1016/j.bmc.2010.12.034 10.7270/Q2TH8N04 21232964 Chen, X; Tikhonova, IG; Decker, M Queen's University Belfast http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336111 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336111&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53325467 125086213 CHEMBL1669446 ZINC66066017 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50621444 C(CCC\N=c1\n2CCCCCCc2nc2ccccc12)CCC\N=c1/n2CCCCCCc2nc2ccccc12 InChI=1S/C35H46N6/c1(4-14-24-36-34-28-18-10-12-20-30(28)38-32-22-8-2-6-16-26-40(32)34)5-15-25-37-35-29-19-11-13-21-31(29)39-33-23-9-3-7-17-27-41(33)35/h10-13,18-21H,1-9,14-17,22-27H2/b36-34-,37-35+ VONLTYRKEZGXEY-QYQVJVQQSA-N 50194095 CHEMBL214881::N,N'-bis[6,7,8,9,10,11-hexahydro-13H-azocino[2,1-b]quinazolin-13-ylidene]heptane-1,7-diamine Cholinesterase 27 ChEMBL 10.1016/j.bmc.2010.12.034 10.7270/Q2TH8N04 21232964 Chen, X; Tikhonova, IG; Decker, M Queen's University Belfast http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50194095 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50194095&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 16082585 104076438 CHEMBL214881 ZINC49942256 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50621445 CN(CCCN=c1n2CCCCCCc2nc2ccccc12)CCC\N=c1\n2CCCCCCc2nc2ccccc12 InChI=1S/C35H47N7/c1-40(24-14-22-36-34-28-16-8-10-18-30(28)38-32-20-6-2-4-12-26-41(32)34)25-15-23-37-35-29-17-9-11-19-31(29)39-33-21-7-3-5-13-27-42(33)35/h8-11,16-19H,2-7,12-15,20-27H2,1H3/b36-34+,37-35? HRGWPWPGDJPQJL-HHTLYKBMSA-N 50336112 CHEMBL1669448::N1-Methyl-N3-(8,9,10,11-tetrahydro-6H-azocino[2,1-b]quinazolin-13(7H)-ylidene)-N1-(3-(8,9,10,11-tetrahydro-6Hazocino[2,1-b]quinazolin-13(7H)-ylideneamino)propyl)propane-1,3-diamine Cholinesterase 197 ChEMBL 10.1016/j.bmc.2010.12.034 10.7270/Q2TH8N04 21232964 Chen, X; Tikhonova, IG; Decker, M Queen's University Belfast http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336112 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336112&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53321513 125086214 CHEMBL1669448 ZINC66073661 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50621446 CC(=O)N(CCCN=c1n2CCCCCCc2nc2ccccc12)CCC\N=c1\n2CCCCCCc2nc2ccccc12 InChI=1S/C36H47N7O/c1-28(44)41(24-14-22-37-35-29-16-8-10-18-31(29)39-33-20-6-2-4-12-26-42(33)35)25-15-23-38-36-30-17-9-11-19-32(30)40-34-21-7-3-5-13-27-43(34)36/h8-11,16-19H,2-7,12-15,20-27H2,1H3/b37-35+,38-36? WEFYPIAKSZIRBW-RMUZUKQLSA-N 50336096 CHEMBL1669449::N,N-Bis(3-(8,9,10,11-tetrahydro-6H-azocino[2,1-b]quinazolin-13(7H)-ylideneamino)propyl)acetamide Cholinesterase 72.7 ChEMBL 10.1016/j.bmc.2010.12.034 10.7270/Q2TH8N04 21232964 Chen, X; Tikhonova, IG; Decker, M Queen's University Belfast http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336096 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336096&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53320191 125086198 CHEMBL1669449 ZINC66073662 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50621447 C(CCCC\N=c1/n2CCCc2nc2ccccc12)CCC\N=c1/n2CCCc2nc2ccccc12 InChI=1S/C30H36N6/c1(3-9-19-31-29-23-13-5-7-15-25(23)33-27-17-11-21-35(27)29)2-4-10-20-32-30-24-14-6-8-16-26(24)34-28-18-12-22-36(28)30/h5-8,13-16H,1-4,9-12,17-22H2/b31-29-,32-30- PTHMERWLLKXUPI-SZDCHMHBSA-N 50194097 CHEMBL213609::N,N'-bis[2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-ylideneoctane]-1,8-diamine Cholinesterase 4.8 ChEMBL 10.1016/j.bmc.2010.12.034 10.7270/Q2TH8N04 21232964 Chen, X; Tikhonova, IG; Decker, M Queen's University Belfast http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50194097 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50194097&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 16082586 104076440 CHEMBL213609 ZINC49942239 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50621448 CN(CCCCN=c1n2CCCc2nc2ccccc12)CCCN=c1n2CCCc2nc2ccccc12 InChI=1S/C30H37N7/c1-35(20-10-18-32-30-24-12-3-5-14-26(24)34-28-16-9-22-37(28)30)19-7-6-17-31-29-23-11-2-4-13-25(23)33-27-15-8-21-36(27)29/h2-5,11-14H,6-10,15-22H2,1H3 LENODDIBXRWXAM-UHFFFAOYSA-N 50336097 CHEMBL1669451::N1-(2,3-Dihydropyrrolo[2,1-b]quinazolin-9(1H)-ylidene)-N4-(3-(2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-ylideneamino)propyl)-N4-methylbutane-1,4-diamine Cholinesterase 81.3 ChEMBL 10.1016/j.bmc.2010.12.034 10.7270/Q2TH8N04 21232964 Chen, X; Tikhonova, IG; Decker, M Queen's University Belfast http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336097 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336097&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53324169 125086199 CHEMBL1669451 ZINC66066581 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50621449 CC(=O)N(CCCCN=c1n2CCCc2nc2ccccc12)CCCN=c1n2CCCc2nc2ccccc12 InChI=1S/C31H37N7O/c1-23(39)36(20-10-18-33-31-25-12-3-5-14-27(25)35-29-16-9-22-38(29)31)19-7-6-17-32-30-24-11-2-4-13-26(24)34-28-15-8-21-37(28)30/h2-5,11-14H,6-10,15-22H2,1H3 WQKHWGNTOMYNEL-UHFFFAOYSA-N 50336098 CHEMBL1669452::N-(4-(2,3-Dihydropyrrolo[2,1-b]quinazolin-9(1H)-ylid-eneamino)butyl)-N-(3-(2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-ylideneamino)propyl)acetamide Cholinesterase 4 ChEMBL 10.1016/j.bmc.2010.12.034 10.7270/Q2TH8N04 21232964 Chen, X; Tikhonova, IG; Decker, M Queen's University Belfast http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336098 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336098&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53321514 125086200 CHEMBL1669452 ZINC66066582 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50621450 CCC(=O)N(CCCCN=c1n2CCCc2nc2ccccc12)CCCN=c1n2CCCc2nc2ccccc12 InChI=1S/C32H39N7O/c1-2-30(40)37(21-11-19-34-32-25-13-4-6-15-27(25)36-29-17-10-23-39(29)32)20-8-7-18-33-31-24-12-3-5-14-26(24)35-28-16-9-22-38(28)31/h3-6,12-15H,2,7-11,16-23H2,1H3 LCONIOXHASXSIY-UHFFFAOYSA-N 50336099 CHEMBL1669453::N-(4-(2,3-Dihydropyrrolo[2,1-b]quinazolin-9(1H)-ylideneamino)butyl)-N-(3-(2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-ylideneamino)propyl)propionamide Cholinesterase 5.9 ChEMBL 10.1016/j.bmc.2010.12.034 10.7270/Q2TH8N04 21232964 Chen, X; Tikhonova, IG; Decker, M Queen's University Belfast http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336099 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336099&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53322841 125086201 CHEMBL1669453 ZINC66066583 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50621451 CC(=C)C(=O)N(CCCCN=c1n2CCCc2nc2ccccc12)CCCN=c1n2CCCc2nc2ccccc12 InChI=1S/C33H39N7O/c1-24(2)33(41)38(21-11-19-35-32-26-13-4-6-15-28(26)37-30-17-10-23-40(30)32)20-8-7-18-34-31-25-12-3-5-14-27(25)36-29-16-9-22-39(29)31/h3-6,12-15H,1,7-11,16-23H2,2H3 XQXSKMBJETZDGS-UHFFFAOYSA-N 50336100 CHEMBL1669454::N-(4-(2,3-Dihydropyrrolo[2,1-b]quinazolin-9(1H)-ylideneamino)butyl)-N-(3-(2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-ylideneamino)propyl)methacrylamide Cholinesterase 10.6 ChEMBL 10.1016/j.bmc.2010.12.034 10.7270/Q2TH8N04 21232964 Chen, X; Tikhonova, IG; Decker, M Queen's University Belfast http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336100 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336100&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53317597 125086202 CHEMBL1669454 ZINC66066584 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50621452 C(CCCC\N=c1/n2CCCCCCc2nc2ccccc12)CCC\N=c1/n2CCCCCCc2nc2ccccc12 InChI=1S/C36H48N6/c1(5-15-25-37-35-29-19-11-13-21-31(29)39-33-23-9-3-7-17-27-41(33)35)2-6-16-26-38-36-30-20-12-14-22-32(30)40-34-24-10-4-8-18-28-42(34)36/h11-14,19-22H,1-10,15-18,23-28H2/b37-35-,38-36- IMQLTHGMTZPIHZ-JXPYRENWSA-N 50194106 (N1Z,N8Z)-N1,N8-bis(6,7,8,9,10,11-hexahydroazocino[2,1-b]quinazolin-13-ylidene)octane-1,8-diamine::CHEMBL213889::N,N'-bis[6,7,8,9,10,11-hexahydro-13H-azocino[2,1-b]quinazolin-13-ylidene]octane-1,8-diamine Cholinesterase 76 ChEMBL 10.1016/j.bmc.2010.12.034 10.7270/Q2TH8N04 21232964 Chen, X; Tikhonova, IG; Decker, M Queen's University Belfast http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50194106 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50194106&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 16082579 104076449 CHEMBL213889 ZINC49942231 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50621453 CN(CCCCN=c1n2CCCCCCc2nc2ccccc12)CCCN=c1n2CCCCCCc2nc2ccccc12 InChI=1S/C36H49N7/c1-41(26-16-24-38-36-30-18-9-11-20-32(30)40-34-22-7-3-5-14-28-43(34)36)25-15-12-23-37-35-29-17-8-10-19-31(29)39-33-21-6-2-4-13-27-42(33)35/h8-11,17-20H,2-7,12-16,21-28H2,1H3 GBRLUBUNUOVHDJ-UHFFFAOYSA-N 50336101 (Z)-N1-Methyl-N4-(8,9,10,11-tetrahydro-6H-azocino[2,1-b]quinazolin-13(7H)-ylidene)-N1-(3-((E)-8,9,10,11-tetrahydro-6H-azocino[2,1-b]quinazolin-13(7H)-ylideneamino)propyl)-butane-1,4-diamine::CHEMBL1669456 Cholinesterase 51.4 ChEMBL 10.1016/j.bmc.2010.12.034 10.7270/Q2TH8N04 21232964 Chen, X; Tikhonova, IG; Decker, M Queen's University Belfast http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336101 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336101&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53324170 125086203 CHEMBL1669456 ZINC66097449 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50621454 CC(=O)N(CCCCN=c1n2CCCCCCc2nc2ccccc12)CCCN=c1n2CCCCCCc2nc2ccccc12 InChI=1S/C37H49N7O/c1-29(45)42(26-16-24-39-37-31-18-9-11-20-33(31)41-35-22-7-3-5-14-28-44(35)37)25-15-12-23-38-36-30-17-8-10-19-32(30)40-34-21-6-2-4-13-27-43(34)36/h8-11,17-20H,2-7,12-16,21-28H2,1H3 YWFNTFJWXQPVLQ-UHFFFAOYSA-N 50336102 CHEMBL1669457::N-(4-(8,9,10,11-Tetrahydro-6H-azocino[2,1-b]quinazolin-13(7H)-ylideneamino)butyl)-N-(3-(8,9,10,11-tetrahydro-6H-azocino[2,1-b]quinazolin-13(7H)-ylideneamino)propyl)-acetamide Cholinesterase 43.1 ChEMBL 10.1016/j.bmc.2010.12.034 10.7270/Q2TH8N04 21232964 Chen, X; Tikhonova, IG; Decker, M Queen's University Belfast http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336102 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336102&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53320192 125086204 CHEMBL1669457 ZINC66099086 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50621455 CCC(=O)N(CCCCN=c1n2CCCCCCc2nc2ccccc12)CCCN=c1n2CCCCCCc2nc2ccccc12 InChI=1S/C38H51N7O/c1-2-36(46)43(27-17-25-40-38-31-19-10-12-21-33(31)42-35-23-8-4-6-15-29-45(35)38)26-16-13-24-39-37-30-18-9-11-20-32(30)41-34-22-7-3-5-14-28-44(34)37/h9-12,18-21H,2-8,13-17,22-29H2,1H3 RJYWGOOFOASGOC-UHFFFAOYSA-N 50336103 CHEMBL1669458::N-(4-(8,9,10,11-Tetrahydro-6H-azocino[2,1-b]quinazolin-13(7H)-ylideneamino)butyl)-N-(3-(8,9,10,11-tetrahydro-6H-azocino[2,1-b]quinazolin-13(7H)-ylideneamino)propyl)-propionamide Cholinesterase 46.3 ChEMBL 10.1016/j.bmc.2010.12.034 10.7270/Q2TH8N04 21232964 Chen, X; Tikhonova, IG; Decker, M Queen's University Belfast http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336103 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336103&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53320193 125086205 CHEMBL1669458 ZINC66099088 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50621456 CC(=C)C(=O)N(CCCCN=c1n2CCCCCCc2nc2ccccc12)CCCN=c1n2CCCCCCc2nc2ccccc12 InChI=1S/C39H51N7O/c1-30(2)39(47)44(27-17-25-41-38-32-19-10-12-21-34(32)43-36-23-8-4-6-15-29-46(36)38)26-16-13-24-40-37-31-18-9-11-20-33(31)42-35-22-7-3-5-14-28-45(35)37/h9-12,18-21H,1,3-8,13-17,22-29H2,2H3 CSCOWQRMRPBTSS-UHFFFAOYSA-N 50336104 CHEMBL1669459::N-(4-(8,9,10,11-Tetrahydro-6H-azocino[2,1-b]quinazolin-13(7H)-ylideneamino)butyl)-N-(3-(8,9,10,11-tetrahydro-6H-azocino[2,1-b]quinazolin-13(7H)-ylideneamino)propyl)-methacrylamide Cholinesterase 37.7 ChEMBL 10.1016/j.bmc.2010.12.034 10.7270/Q2TH8N04 21232964 Chen, X; Tikhonova, IG; Decker, M Queen's University Belfast http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336104 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336104&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53318877 125086206 CHEMBL1669459 ZINC66076361 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50621457 CC(=O)NCC(=O)N(CCCCN=c1n2CCCCCCc2nc2ccccc12)CCCN=c1n2CCCCCCc2nc2ccccc12 InChI=1S/C39H52N8O2/c1-30(48)42-29-37(49)45(26-16-24-41-39-32-18-9-11-20-34(32)44-36-22-7-3-5-14-28-47(36)39)25-15-12-23-40-38-31-17-8-10-19-33(31)43-35-21-6-2-4-13-27-46(35)38/h8-11,17-20H,2-7,12-16,21-29H2,1H3,(H,42,48) DUXAJLNFRUGTRP-UHFFFAOYSA-N 50336105 2-Acetamido-N-(4-(8,9,10,11-tetrahydro-6H-azocino-[2,1-b]quinazolin-13(7H)-ylideneamino)butyl)-N-(3-(8,9,10-11-tetrahydro-6H-azocino[2,1-b]quinazolin-13(7H)-ylideneamino)propyl)acetamide::CHEMBL1669460 Cholinesterase 122.1 ChEMBL 10.1016/j.bmc.2010.12.034 10.7270/Q2TH8N04 21232964 Chen, X; Tikhonova, IG; Decker, M Queen's University Belfast http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336105 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336105&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53326871 125086207 CHEMBL1669460 ZINC72122110 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50621458 CC(C)(C)C(=O)N(CCCCN=c1n2CCCCCCc2nc2ccccc12)CCCN=c1n2CCCCCCc2nc2ccccc12 InChI=1S/C40H55N7O/c1-40(2,3)39(48)45(28-18-26-42-38-32-20-11-13-22-34(32)44-36-24-9-5-7-16-30-47(36)38)27-17-14-25-41-37-31-19-10-12-21-33(31)43-35-23-8-4-6-15-29-46(35)37/h10-13,19-22H,4-9,14-18,23-30H2,1-3H3 GAVOICPUHQICOB-UHFFFAOYSA-N 50336106 CHEMBL1669461::N-(4-(8,9,10,11-Tetrahydro-6H-azocino[2,1-b]quinazolin-13(7H)-ylideneamino)butyl)-N-(3-(8,9,10,11-tetrahydro-6H-azocino[2,1-b]quinazolin-13(7H)-ylideneamino)propyl)-pivalamide Cholinesterase 25.5 ChEMBL 10.1016/j.bmc.2010.12.034 10.7270/Q2TH8N04 21232964 Chen, X; Tikhonova, IG; Decker, M Queen's University Belfast http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50336106 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50336106&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53322842 125086208 CHEMBL1669461 ZINC66066497 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50646245 COC(=O)C1C[C@]23CCO[C@H]2[C@@]2(C[C@@H]4C[C@]56CC(=O)O[C@H]5CCN5CC[C@]7([C@H]4N(C2)c2c7cccc2OC)[C@H]65)[C@@H](O)N2CC[C@@]4([C@H]32)C1=Nc1ccccc41 InChI=1S/C43H48N4O7/c1-51-28-9-5-7-26-31(28)47-22-41(19-23-18-40-21-30(48)54-29(40)10-14-45-15-11-43(26,33(23)47)35(40)45)37-39(13-17-53-37)20-24(34(49)52-2)32-42(12-16-46(36(39)42)38(41)50)25-6-3-4-8-27(25)44-32/h3-9,23-24,29,33,35-38,50H,10-22H2,1-2H3/t23-,24?,29-,33-,35-,36-,37+,38+,39-,40-,41-,42-,43-/m0/s1 RBROEORVZJMUPA-UOZQZNPOSA-N 50346858 CHEMBL1797183 Cholinesterase 16400 ChEMBL 10.1016/j.ejmech.2011.04.025 10.7270/Q27P8ZR5 21546135 Macabeo, AP; Vidar, WS; Chen, X; Decker, M; Heilmann, J; Wan, B; Franzblau, SG; Galvez, EV; Aguinaldo, MA; Cordell, GA University of Santo Tomas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346858 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346858&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91932277 136353544 CHEMBL1797183 ZINC95615605 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50646246 COC(=O)C1C[C@]23CCO[C@H]2[C@@]2(C[C@@H]4C[C@]56CCO[C@H]5CCN5CC[C@]7([C@H]4N(C2)c2c7cccc2OC)[C@H]65)CN2CC[C@@]4([C@H]32)C1=Nc1ccccc41 InChI=1S/C43H50N4O5/c1-49-30-9-5-7-28-32(30)47-24-39(20-25-21-40-13-18-51-31(40)10-15-45-16-12-43(28,34(25)47)36(40)45)23-46-17-11-42-27-6-3-4-8-29(27)44-33(42)26(35(48)50-2)22-41(37(42)46)14-19-52-38(39)41/h3-9,25-26,31,34,36-38H,10-24H2,1-2H3/t25-,26?,31+,34+,36+,37+,38+,39+,40-,41+,42+,43+/m1/s1 YJLLYBQUTGEOOV-PJDAUXCXSA-N 50346859 CHEMBL1797184 Cholinesterase 6200 ChEMBL 10.1016/j.ejmech.2011.04.025 10.7270/Q27P8ZR5 21546135 Macabeo, AP; Vidar, WS; Chen, X; Decker, M; Heilmann, J; Wan, B; Franzblau, SG; Galvez, EV; Aguinaldo, MA; Cordell, GA University of Santo Tomas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346859 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346859&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91932278 136353545 CHEMBL1797184 ZINC72173284 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50646247 COC(=O)C1C[C@]23CCO[C@H]2[C@@]2(C[C@@H]4C[C@]56CC(=O)O[C@H]5CCN5CC[C@]7([C@H]4N(C2)c2c7cccc2OC)[C@H]65)CN2CC[C@@]4([C@H]32)C1=Nc1ccccc41 InChI=1S/C43H48N4O6/c1-50-29-9-5-7-27-32(29)47-23-39(18-24-19-41-21-31(48)53-30(41)10-14-45-15-12-43(27,34(24)47)37(41)45)22-46-16-11-42-26-6-3-4-8-28(26)44-33(42)25(35(49)51-2)20-40(36(42)46)13-17-52-38(39)40/h3-9,24-25,30,34,36-38H,10-23H2,1-2H3/t24-,25?,30+,34+,36+,37+,38+,39+,40+,41+,42+,43+/m1/s1 CBKVQWUSUGUAAY-ZDPYNDQDSA-N 50346860 CHEMBL1797185 Cholinesterase 20200 ChEMBL 10.1016/j.ejmech.2011.04.025 10.7270/Q27P8ZR5 21546135 Macabeo, AP; Vidar, WS; Chen, X; Decker, M; Heilmann, J; Wan, B; Franzblau, SG; Galvez, EV; Aguinaldo, MA; Cordell, GA University of Santo Tomas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346860 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346860&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91932279 136353546 CHEMBL1797185 ZINC72173092 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50646248 COC(=O)C1C[C@]23CCO[C@H]2[C@@]2(C[C@@H]4C[C@]56CC(=O)C[C@H]5CCN5CC[C@]7([C@H]65)c5cccc(OC)c5N(C2)[C@@]47O)CN2CC[C@@]4([C@H]32)C1=Nc1ccccc41 InChI=1S/C44H50N4O6/c1-52-32-9-5-7-30-33(32)48-24-39(19-26-20-41-21-27(49)18-25(41)10-14-46-16-12-43(30,37(41)46)44(26,48)51)23-47-15-11-42-29-6-3-4-8-31(29)45-34(42)28(35(50)53-2)22-40(36(42)47)13-17-54-38(39)40/h3-9,25-26,28,36-38,51H,10-24H2,1-2H3/t25-,26-,28?,36+,37+,38+,39+,40+,41+,42+,43-,44-/m1/s1 YIOXHFBZCSLRKT-ITCCKCPTSA-N 50346861 CHEMBL1079129 Cholinesterase 18000 ChEMBL 10.1016/j.ejmech.2011.04.025 10.7270/Q27P8ZR5 21546135 Macabeo, AP; Vidar, WS; Chen, X; Decker, M; Heilmann, J; Wan, B; Franzblau, SG; Galvez, EV; Aguinaldo, MA; Cordell, GA University of Santo Tomas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346861 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346861&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91932280 136353547 CHEMBL1079129 ZINC49768181 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50646249 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 8400 ChEMBL 10.1016/j.ejmech.2011.04.025 10.7270/Q27P8ZR5 21546135 Macabeo, AP; Vidar, WS; Chen, X; Decker, M; Heilmann, J; Wan, B; Franzblau, SG; Galvez, EV; Aguinaldo, MA; Cordell, GA University of Santo Tomas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50642743 COc1ccc(CNCCCCNc2c3CCCCc3nc3ccccc23)cc1OC InChI=1S/C26H33N3O2/c1-30-24-14-13-19(17-25(24)31-2)18-27-15-7-8-16-28-26-20-9-3-5-11-22(20)29-23-12-6-4-10-21(23)26/h3,5,9,11,13-14,17,27H,4,6-8,10,12,15-16,18H2,1-2H3,(H,28,29) NNXKOOIDENOEBF-UHFFFAOYSA-N 50345195 CHEMBL1783190::N1-(3,4-Dimethoxybenzyl)-N4-(1,2,3,4-tetrahydroacridin-9-yl)butane-1,4-diamine Cholinesterase 37.2 ChEMBL 10.1016/j.ejmech.2011.03.058 10.7270/Q2BV7GZB 21497959 Luo, W; Li, YP; He, Y; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50345195 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50345195&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53304408 131348131 CHEMBL1783190 ZINC71295913 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50642744 COc1ccc(CNCCCCCNc2c3CCCCc3nc3ccccc23)cc1OC InChI=1S/C27H35N3O2/c1-31-25-15-14-20(18-26(25)32-2)19-28-16-8-3-9-17-29-27-21-10-4-6-12-23(21)30-24-13-7-5-11-22(24)27/h4,6,10,12,14-15,18,28H,3,5,7-9,11,13,16-17,19H2,1-2H3,(H,29,30) HAKBJGAKWDBTMR-UHFFFAOYSA-N 50345196 CHEMBL1783191::N1-(3,4-Dimethoxybenzyl)-N5-(1,2,3,4-tetrahydroacridin-9-yl)pentane-1,5-diamine Cholinesterase 24.4 ChEMBL 10.1016/j.ejmech.2011.03.058 10.7270/Q2BV7GZB 21497959 Luo, W; Li, YP; He, Y; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50345196 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50345196&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53304409 131348132 CHEMBL1783191 ZINC71295647 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50642745 Oc1ccc(CNCCCCCCNc2c3CCCCc3nc3ccccc23)cc1 InChI=1S/C26H33N3O/c30-21-15-13-20(14-16-21)19-27-17-7-1-2-8-18-28-26-22-9-3-5-11-24(22)29-25-12-6-4-10-23(25)26/h3,5,9,11,13-16,27,30H,1-2,4,6-8,10,12,17-19H2,(H,28,29) RVKMKRMWBALNOI-UHFFFAOYSA-N 50345197 4-((6-(1,2,3,4-Tetrahydroacridin-9-ylamino)hexylamino)methyl)phenol::CHEMBL1783192 Cholinesterase 7.5 ChEMBL 10.1016/j.ejmech.2011.03.058 10.7270/Q2BV7GZB 21497959 Luo, W; Li, YP; He, Y; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50345197 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50345197&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53304410 131348133 CHEMBL1783192 ZINC71294581 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50642746 COc1cc(CNCCCCCCNc2c3CCCCc3nc3ccccc23)ccc1O InChI=1S/C27H35N3O2/c1-32-26-18-20(14-15-25(26)31)19-28-16-8-2-3-9-17-29-27-21-10-4-6-12-23(21)30-24-13-7-5-11-22(24)27/h4,6,10,12,14-15,18,28,31H,2-3,5,7-9,11,13,16-17,19H2,1H3,(H,29,30) OVTLONNJDJOPJH-UHFFFAOYSA-N 50345198 2-Methoxy-4-((6-(1,2,3,4-tetrahydroacridin-9-ylamino)hexyl-amino)methyl)phenol::CHEMBL1783193 Cholinesterase 9.28 ChEMBL 10.1016/j.ejmech.2011.03.058 10.7270/Q2BV7GZB 21497959 Luo, W; Li, YP; He, Y; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50345198 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50345198&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53304557 131348134 CHEMBL1783193 ZINC71295221 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50642747 Oc1ccc(CNCCCCCCCCNc2c3CCCCc3nc3ccccc23)cc1 InChI=1S/C28H37N3O/c32-23-17-15-22(16-18-23)21-29-19-9-3-1-2-4-10-20-30-28-24-11-5-7-13-26(24)31-27-14-8-6-12-25(27)28/h5,7,11,13,15-18,29,32H,1-4,6,8-10,12,14,19-21H2,(H,30,31) SBZRQYNEDCHZSE-UHFFFAOYSA-N 50345199 4-((8-(1,2,3,4-Tetrahydroacridin-9-ylamino)octylamino)methyl)phenol::CHEMBL1783194 Cholinesterase 5.31 ChEMBL 10.1016/j.ejmech.2011.03.058 10.7270/Q2BV7GZB 21497959 Luo, W; Li, YP; He, Y; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50345199 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50345199&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53304558 131348135 CHEMBL1783194 ZINC71282428 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50642748 COc1cc(CNCCCCCCCCNc2c3CCCCc3nc3ccccc23)ccc1O InChI=1S/C29H39N3O2/c1-34-28-20-22(16-17-27(28)33)21-30-18-10-4-2-3-5-11-19-31-29-23-12-6-8-14-25(23)32-26-15-9-7-13-24(26)29/h6,8,12,14,16-17,20,30,33H,2-5,7,9-11,13,15,18-19,21H2,1H3,(H,31,32) SHCXTXHQPNUEGT-UHFFFAOYSA-N 50345200 2-Methoxy-4-((8-(1,2,3,4-tetrahydroacridin-9-ylamino)octylamino)methyl)phenol::CHEMBL1783195 Cholinesterase 3.41 ChEMBL 10.1016/j.ejmech.2011.03.058 10.7270/Q2BV7GZB 21497959 Luo, W; Li, YP; He, Y; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50345200 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50345200&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53248745 131348136 CHEMBL1783195 ZINC71280849 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50642749 COc1cc(CNCCCCCCCCNc2c3CCCCc3nc3ccccc23)cc(OC)c1O InChI=1S/C30H41N3O3/c1-35-27-19-22(20-28(36-2)30(27)34)21-31-17-11-5-3-4-6-12-18-32-29-23-13-7-9-15-25(23)33-26-16-10-8-14-24(26)29/h7,9,13,15,19-20,31,34H,3-6,8,10-12,14,16-18,21H2,1-2H3,(H,32,33) XZXYFTUBAUFZMZ-UHFFFAOYSA-N 50345201 2,6-Dimethoxy-4-((8-(1,2,3,4-tetrahydroacridin-9-ylamino)octylamino)methyl)phenol::CHEMBL1783237 Cholinesterase 4.08 ChEMBL 10.1016/j.ejmech.2011.03.058 10.7270/Q2BV7GZB 21497959 Luo, W; Li, YP; He, Y; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50345201 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50345201&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53304559 131348137 CHEMBL1783237 ZINC71282353 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50642750 Oc1cccc(CNCCCCCCCCNc2c3CCCCc3nc3ccccc23)c1 InChI=1S/C28H37N3O/c32-23-13-11-12-22(20-23)21-29-18-9-3-1-2-4-10-19-30-28-24-14-5-7-16-26(24)31-27-17-8-6-15-25(27)28/h5,7,11-14,16,20,29,32H,1-4,6,8-10,15,17-19,21H2,(H,30,31) MFONRPQRCLNWME-UHFFFAOYSA-N 50345202 3-((8-(1,2,3,4-Tetrahydroacridin-9-ylamino)octylamino)methyl)phenol::CHEMBL1783238 Cholinesterase 4.91 ChEMBL 10.1016/j.ejmech.2011.03.058 10.7270/Q2BV7GZB 21497959 Luo, W; Li, YP; He, Y; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50345202 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50345202&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53304560 131348138 CHEMBL1783238 ZINC71280509 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50642751 Oc1ccccc1CNCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C28H37N3O/c32-27-18-10-5-13-22(27)21-29-19-11-3-1-2-4-12-20-30-28-23-14-6-8-16-25(23)31-26-17-9-7-15-24(26)28/h5-6,8,10,13-14,16,18,29,32H,1-4,7,9,11-12,15,17,19-21H2,(H,30,31) RGFFJLGDSFNWLQ-UHFFFAOYSA-N 50345203 2-((8-(1,2,3,4-Tetrahydroacridin-9-ylamino)octylamino)methyl)phenol::CHEMBL1783239 Cholinesterase 10.2 ChEMBL 10.1016/j.ejmech.2011.03.058 10.7270/Q2BV7GZB 21497959 Luo, W; Li, YP; He, Y; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50345203 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50345203&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53304561 131348139 CHEMBL1783239 ZINC71295099 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50642752 COc1ccc(CNCCCCCCCCNc2c3CCCCc3nc3ccccc23)cc1 InChI=1S/C29H39N3O/c1-33-24-18-16-23(17-19-24)22-30-20-10-4-2-3-5-11-21-31-29-25-12-6-8-14-27(25)32-28-15-9-7-13-26(28)29/h6,8,12,14,16-19,30H,2-5,7,9-11,13,15,20-22H2,1H3,(H,31,32) GIOQDSMKIHQZEY-UHFFFAOYSA-N 50345204 CHEMBL1783240::N1-(4-Methoxybenzyl)-N8-(1,2,3,4-tetrahydroacridin-9-yl)octane-1,8-diamine Cholinesterase 4.82 ChEMBL 10.1016/j.ejmech.2011.03.058 10.7270/Q2BV7GZB 21497959 Luo, W; Li, YP; He, Y; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50345204 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50345204&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53304562 131348140 CHEMBL1783240 ZINC71295723 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50642753 C(CCCCNc1c2CCCCc2nc2ccccc12)CCCNCc1ccc2OCOc2c1 InChI=1S/C29H37N3O2/c1(3-9-17-30-20-22-15-16-27-28(19-22)34-21-33-27)2-4-10-18-31-29-23-11-5-7-13-25(23)32-26-14-8-6-12-24(26)29/h5,7,11,13,15-16,19,30H,1-4,6,8-10,12,14,17-18,20-21H2,(H,31,32) XAQVPOOZPPHYOO-UHFFFAOYSA-N 50345205 CHEMBL1783241::N1-(Benzo[d][1,3]dioxol-5-ylmethyl)-N8-(1,2,3,4-tetrahydroacridin-9-yl)octane-1,8-diamine Cholinesterase 3.44 ChEMBL 10.1016/j.ejmech.2011.03.058 10.7270/Q2BV7GZB 21497959 Luo, W; Li, YP; He, Y; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50345205 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50345205&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53304724 131348141 CHEMBL1783241 ZINC71294539 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50642754 C(CCCCNc1c2CCCCc2nc2ccccc12)CCCNCc1ccncc1 InChI=1S/C27H36N4/c1(3-9-17-29-21-22-15-19-28-20-16-22)2-4-10-18-30-27-23-11-5-7-13-25(23)31-26-14-8-6-12-24(26)27/h5,7,11,13,15-16,19-20,29H,1-4,6,8-10,12,14,17-18,21H2,(H,30,31) AHEFUMNZCIRKDC-UHFFFAOYSA-N 50345206 CHEMBL1783242::N1-(Pyridin-4-ylmethyl)-N8-(1,2,3,4-tetrahydroacridin-9-yl)octane-1,8-diamine Cholinesterase 4.66 ChEMBL 10.1016/j.ejmech.2011.03.058 10.7270/Q2BV7GZB 21497959 Luo, W; Li, YP; He, Y; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50345206 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50345206&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53304725 131348142 CHEMBL1783242 ZINC71295450 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50642755 O=C(NCCCCCCCCNc1c2CCCCc2nc2ccccc12)c1ccncc1 InChI=1S/C27H34N4O/c32-27(21-15-19-28-20-16-21)30-18-10-4-2-1-3-9-17-29-26-22-11-5-7-13-24(22)31-25-14-8-6-12-23(25)26/h5,7,11,13,15-16,19-20H,1-4,6,8-10,12,14,17-18H2,(H,29,31)(H,30,32) DPSOIKALXFWJTR-UHFFFAOYSA-N 50345207 CHEMBL1783243::N-(8-(1,2,3,4-tetrahydroacridin-9-ylamino)octyl)isonicotinamide Cholinesterase 38.7 ChEMBL 10.1016/j.ejmech.2011.03.058 10.7270/Q2BV7GZB 21497959 Luo, W; Li, YP; He, Y; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50345207 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50345207&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53304726 131348143 CHEMBL1783243 ZINC71281460 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50642756 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 27.1 ChEMBL 10.1016/j.ejmech.2011.03.058 10.7270/Q2BV7GZB 21497959 Luo, W; Li, YP; He, Y; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645399 C([C@@H]1CCCN2CCCC[C@H]12)N(c1ccccc1)c1ccccc1 InChI=1S/C22H28N2/c1-3-11-20(12-4-1)24(21-13-5-2-6-14-21)18-19-10-9-17-23-16-8-7-15-22(19)23/h1-6,11-14,19,22H,7-10,15-18H2/t19-,22+/m0/s1 GQZLJCJJYGIQOK-SIKLNZKXSA-N 50346401 CHEMBL1782726::N-[(1S,9aR)-(Octahydro-1H-quinolizin-1-yl)methyl]-Nphenylaniline Cholinesterase 8100 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346401 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346401&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53304967 131349332 CHEMBL1782726 ZINC71294406 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645400 C(C(c1ccccc1)c1ccccc1)[C@@H]1CCCN2CCCC[C@H]12 InChI=1S/C23H29N/c1-3-10-19(11-4-1)22(20-12-5-2-6-13-20)18-21-14-9-17-24-16-8-7-15-23(21)24/h1-6,10-13,21-23H,7-9,14-18H2/t21-,23+/m0/s1 HOCOGSQQTMYEBM-JTHBVZDNSA-N 50346402 1,1-Diphenyl-2-[(1S,9aR)-(octahydro-1H-quinolizin-1-yl)]ethane::CHEMBL1782727 Cholinesterase 5500 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346402 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346402&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53304968 131349333 CHEMBL1782727 ZINC71295600 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645401 C1CCN2CCC[C@@H](C=C(c3ccccc3)c3ccccc3)[C@H]2C1 InChI=1S/C23H27N/c1-3-10-19(11-4-1)22(20-12-5-2-6-13-20)18-21-14-9-17-24-16-8-7-15-23(21)24/h1-6,10-13,18,21,23H,7-9,14-17H2/t21-,23+/m0/s1 FPEGGYAGDGRTNR-JTHBVZDNSA-N 50346403 (1S,9aR)-1-(2,2-diphenylvinyl)octahydro-1H-quinolizine::CHEMBL1782728 Cholinesterase 3800 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346403 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346403&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54583226 131349334 CHEMBL1782728 ZINC71295824 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645402 C(SC(c1ccccc1)c1ccccc1)[C@@H]1CCCN2CCCC[C@H]12 InChI=1S/C23H29NS/c1-3-10-19(11-4-1)23(20-12-5-2-6-13-20)25-18-21-14-9-17-24-16-8-7-15-22(21)24/h1-6,10-13,21-23H,7-9,14-18H2/t21-,22+/m0/s1 QRKFWYLBWNOMIM-FCHUYYIVSA-N 50346404 (1R,9aR)-1-(benzhydrylthiomethyl)octahydro-1H-quinolizine::CHEMBL1782729 Cholinesterase 3300 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10760407 131349335 CHEMBL1782729 ZINC71295846 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645403 CCN(CC)C(C)C(=O)N1c2ccccc2Sc2ccccc12 InChI=1S/C19H22N2OS/c1-4-20(5-2)14(3)19(22)21-15-10-6-8-12-17(15)23-18-13-9-7-11-16(18)21/h6-14H,4-5H2,1-3H3 QCEWCMMSOWEHFC-UHFFFAOYSA-N 13551 10-[2-(Diethylamino)-1-oxopropyl]-10H-phenothiazine::2-(diethylamino)-1-(10H-phenothiazin-10-yl)propan-1-one::AS-1397::CHEMBL1782730 Cholinesterase 840 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=13551 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=13551&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1403 46513952 CHEMBL1782730 ZINC03870534 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645404 O=C(C[C@@H]1CCCN2CCCC[C@H]12)N1c2ccccc2Sc2ccccc12 InChI=1S/C23H26N2OS/c26-23(16-17-8-7-15-24-14-6-5-9-18(17)24)25-19-10-1-3-12-21(19)27-22-13-4-2-11-20(22)25/h1-4,10-13,17-18H,5-9,14-16H2/t17-,18+/m0/s1 VBFVMVZMRAKGBX-ZWKOTPCHSA-N 50346406 CHEMBL1782731::homolupinanoylphenothiazine Cholinesterase 3000 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346406 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346406&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54587102 131349337 CHEMBL1782731 ZINC33882487 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645405 O=C(C[C@H]1CCCN2CCCC[C@H]12)N1c2ccccc2Sc2ccccc12 InChI=1S/C23H26N2OS/c26-23(16-17-8-7-15-24-14-6-5-9-18(17)24)25-19-10-1-3-12-21(19)27-22-13-4-2-11-20(22)25/h1-4,10-13,17-18H,5-9,14-16H2/t17-,18-/m1/s1 VBFVMVZMRAKGBX-QZTJIDSGSA-N 50346407 2-((1R,9aR)-octahydro-1H-quinolizin-1-yl)-1-(10H-phenothiazin-10-yl)ethanone::CHEMBL1782732 Cholinesterase 4800 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346407 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346407&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11740408 131349338 CHEMBL1782732 ZINC36399769 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645406 O=C(CSC[C@@H]1CCCN2CCCC[C@H]12)N1c2ccccc2Sc2ccccc12 InChI=1S/C24H28N2OS2/c27-24(17-28-16-18-8-7-15-25-14-6-5-9-19(18)25)26-20-10-1-3-12-22(20)29-23-13-4-2-11-21(23)26/h1-4,10-13,18-19H,5-9,14-17H2/t18-,19+/m0/s1 IZNKKWAMYBRXGH-RBUKOAKNSA-N 50346408 2-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methylthio)-1-(10H-phenothiazin-10-yl)ethanone::CHEMBL1782733 Cholinesterase 430 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346408 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346408&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54584188 131349339 CHEMBL1782733 ZINC71294785 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645407 COc1ccc2Sc3ccccc3N(C(=O)CSC[C@@H]3CCCN4CCCC[C@H]34)c2c1 InChI=1S/C25H30N2O2S2/c1-29-19-11-12-24-22(15-19)27(21-9-2-3-10-23(21)31-24)25(28)17-30-16-18-7-6-14-26-13-5-4-8-20(18)26/h2-3,9-12,15,18,20H,4-8,13-14,16-17H2,1H3/t18-,20+/m0/s1 DWXAWPNKUKCSGR-AZUAARDMSA-N 50346409 1-(2-methoxy-10H-phenothiazin-10-yl)-2-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methylthio)ethanone::CHEMBL1782734 Cholinesterase 1200 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346409 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346409&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54583227 131349340 CHEMBL1782734 ZINC71282229 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645408 CC(SC[C@@H]1CCCN2CCCC[C@H]12)C(=O)N1c2ccccc2Sc2ccccc12 InChI=1S/C25H30N2OS2/c1-18(29-17-19-9-8-16-26-15-7-6-10-20(19)26)25(28)27-21-11-2-4-13-23(21)30-24-14-5-3-12-22(24)27/h2-5,11-14,18-20H,6-10,15-17H2,1H3/t18?,19-,20+/m0/s1 OIHWNHNKECXCTR-NRRUETGQSA-N 50346410 2-[(1R,9aR)-(Octahydro-1H-quinolizin-1-yl)methylthio]-1-(10H-phenothiazin-10-yl)propan-1-one::CHEMBL1782735 Cholinesterase 470 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346410 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346410&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53304969 131349341 CHEMBL1782735 ZINC71295430 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645409 O=C(CCSC[C@@H]1CCCN2CCCC[C@H]12)N1c2ccccc2Sc2ccccc12 InChI=1S/C25H30N2OS2/c28-25(14-17-29-18-19-8-7-16-26-15-6-5-9-20(19)26)27-21-10-1-3-12-23(21)30-24-13-4-2-11-22(24)27/h1-4,10-13,19-20H,5-9,14-18H2/t19-,20+/m0/s1 IIZZRBFBRZRZER-VQTJNVASSA-N 50346411 3-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methylthio)-1-(10H-phenothiazin-10-yl)propan-1-one::CHEMBL1782736 Cholinesterase 750 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346411 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346411&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54580220 131349342 CHEMBL1782736 ZINC71295329 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645410 O=C(CCCSC[C@@H]1CCCN2CCCC[C@H]12)N1c2ccccc2Sc2ccccc12 InChI=1S/C26H32N2OS2/c29-26(15-8-18-30-19-20-9-7-17-27-16-6-5-10-21(20)27)28-22-11-1-3-13-24(22)31-25-14-4-2-12-23(25)28/h1-4,11-14,20-21H,5-10,15-19H2/t20-,21+/m0/s1 IPAWGXJELFQQHQ-LEWJYISDSA-N 50346412 4-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methylthio)-1-(10H-phenothiazin-10-yl)butan-1-one::CHEMBL1782737 Cholinesterase 740 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346412 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346412&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54581221 131349343 CHEMBL1782737 ZINC71281999 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645411 O=C(CCCCSC[C@@H]1CCCN2CCCC[C@H]12)N1c2ccccc2Sc2ccccc12 InChI=1S/C27H34N2OS2/c30-27(29-23-12-1-3-14-25(23)32-26-15-4-2-13-24(26)29)16-6-8-19-31-20-21-10-9-18-28-17-7-5-11-22(21)28/h1-4,12-15,21-22H,5-11,16-20H2/t21-,22+/m0/s1 OJJNBKOHBHOLSV-FCHUYYIVSA-N 50346413 5-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methylthio)-1-(10H-phenothiazin-10-yl)pentan-1-one::CHEMBL1782738 Cholinesterase 890 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346413 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346413&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54583228 131349344 CHEMBL1782738 ZINC71294890 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645412 C(SCN1c2ccccc2CCc2ccccc12)[C@@H]1CCCN2CCCC[C@H]12 InChI=1S/C25H32N2S/c1-3-12-24-20(8-1)14-15-21-9-2-4-13-25(21)27(24)19-28-18-22-10-7-17-26-16-6-5-11-23(22)26/h1-4,8-9,12-13,22-23H,5-7,10-11,14-19H2/t22-,23+/m0/s1 XSOOJIUBTJQKSA-XZOQPEGZSA-N 50346414 5-((((1R,9aR)-octahydro-1H-quinolizin-1-yl)methylthio)methyl)-10,11-dihydro-5H-dibenzo[b,f]azepine::CHEMBL1782739 Cholinesterase 860 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346414 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346414&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54585144 131349345 CHEMBL1782739 ZINC71295239 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645413 CCN(CC)CCCC(C)Nc1c2ccc(Cl)cc2nc2ccc(OC)cc12 InChI=1S/C23H30ClN3O/c1-5-27(6-2)13-7-8-16(3)25-23-19-11-9-17(24)14-22(19)26-21-12-10-18(28-4)15-20(21)23/h9-12,14-16H,5-8,13H2,1-4H3,(H,25,26) GPKJTRJOBQGKQK-UHFFFAOYSA-N 50015214 6-chloro-2-methoxy-9-acridinyl(4-diethylamino-1-methylbutyl)amine::6-chloro-N-(5-(diethylamino)pentan-2-yl)-2-methoxyacridin-9-amine::CHEMBL7568::N'-(6-chloro-2-methoxy-acridin-9-yl)-N,N-diethyl-pentane-1,4-diamine::N*4*-(6-Chloro-2-methoxy-acridin-9-yl)-N*1*,N*1*-diethyl-pentane-1,4-diamine::N*4*-(6-Chloro-2-methoxy-acridin-9-yl)-N*1*,N*1*-diethyl-pentane-1,4-diamine (Mepacrine)::N*4*-(6-Chloro-2-methoxy-acridin-9-yl)-N*1*,N*1*-diethyl-pentane-1,4-diamine ; (mepacrine)::N-(4-Hydroxy-phenyl)-acetamide::cid_237::quinacrine Cholinesterase 4500 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50015214 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50015214&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search QUN 1JQE 237 103927049 8711 CHEMBL7568 DB01103 C07339 ZINC03830247 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645414 COc1ccc2nc3cc(Cl)ccc3c(NC[C@@H]3CCCN4CCCC[C@H]34)c2c1 InChI=1S/C24H28ClN3O/c1-29-18-8-10-21-20(14-18)24(19-9-7-17(25)13-22(19)27-21)26-15-16-5-4-12-28-11-3-2-6-23(16)28/h7-10,13-14,16,23H,2-6,11-12,15H2,1H3,(H,26,27)/t16-,23+/m0/s1 WDOZYYCIYOXKKX-QMHKHESXSA-N 50346415 6-chloro-2-methoxy-N-(((1S,9aR)-octahydro-1H-quinolizin-1-yl)methyl)acridin-9-amine::CHEMBL1782741 Cholinesterase 870 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346415 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346415&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54585145 131349346 CHEMBL1782741 ZINC05519367 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645415 COc1ccc2nc3cc(Cl)ccc3c(NCCSC[C@@H]3CCCN4CCCC[C@H]34)c2c1 InChI=1S/C26H32ClN3OS/c1-31-20-8-10-23-22(16-20)26(21-9-7-19(27)15-24(21)29-23)28-11-14-32-17-18-5-4-13-30-12-3-2-6-25(18)30/h7-10,15-16,18,25H,2-6,11-14,17H2,1H3,(H,28,29)/t18-,25+/m0/s1 XNSCYIBQQMVLBX-AVRWGWEMSA-N 50346416 6-chloro-2-methoxy-N-(2-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methylthio)ethyl)acridin-9-amine::CHEMBL1782742 Cholinesterase 340 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346416 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346416&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54583229 131349347 CHEMBL1782742 ZINC71294809 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645416 COc1ccc2nc3cc(Cl)ccc3c(NCCCSC[C@@H]3CCCN4CCCC[C@H]34)c2c1 InChI=1S/C27H34ClN3OS/c1-32-21-9-11-24-23(17-21)27(22-10-8-20(28)16-25(22)30-24)29-12-5-15-33-18-19-6-4-14-31-13-3-2-7-26(19)31/h8-11,16-17,19,26H,2-7,12-15,18H2,1H3,(H,29,30)/t19-,26+/m0/s1 HMKAKDYSOOVYMW-AFMDSPMNSA-N 50346417 6-chloro-2-methoxy-N-(3-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methylthio)propyl)acridin-9-amine::CHEMBL1782743 Cholinesterase 690 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346417 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346417&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54585146 131349348 CHEMBL1782743 ZINC71281989 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645417 COc1ccc2nc3cc(Cl)ccc3c(SC[C@@H]3CCCN4CCCC[C@H]34)c2c1 InChI=1S/C24H27ClN2OS/c1-28-18-8-10-21-20(14-18)24(19-9-7-17(25)13-22(19)26-21)29-15-16-5-4-12-27-11-3-2-6-23(16)27/h7-10,13-14,16,23H,2-6,11-12,15H2,1H3/t16-,23+/m0/s1 JMQZYBUNYNZUPH-QMHKHESXSA-N 50346418 6-chloro-2-methoxy-9-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methylthio)acridine::CHEMBL1782744 Cholinesterase 4700 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346418 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346418&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54587103 131349349 CHEMBL1782744 ZINC71294613 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645418 O=c1ccc2cc(OCCCSC[C@@H]3CCCN4CCCC[C@H]34)ccc2o1 InChI=1S/C22H29NO3S/c24-22-10-7-17-15-19(8-9-21(17)26-22)25-13-4-14-27-16-18-5-3-12-23-11-2-1-6-20(18)23/h7-10,15,18,20H,1-6,11-14,16H2/t18-,20+/m0/s1 QAFZMKUORVASTD-AZUAARDMSA-N 50346419 6-(3-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methylthio)propoxy)-2H-chromen-2-one::CHEMBL1782746 Cholinesterase 5400 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346419 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346419&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53248738 131349350 CHEMBL1782746 ZINC71647669 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645419 O=c1ccc2cc(OCCCCSC[C@@H]3CCCN4CCCC[C@H]34)ccc2o1 InChI=1S/C23H31NO3S/c25-23-11-8-18-16-20(9-10-22(18)27-23)26-14-3-4-15-28-17-19-6-5-13-24-12-2-1-7-21(19)24/h8-11,16,19,21H,1-7,12-15,17H2/t19-,21+/m0/s1 MBPONPFXNKHUNF-PZJWPPBQSA-N 50346420 6-(4-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methylthio)butoxy)-2H-chromen-2-one::CHEMBL1782747 Cholinesterase 4300 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346420 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346420&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53304972 131349351 CHEMBL1782747 ZINC71281391 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645420 O=c1ccc2cc(OCCCCCSC[C@@H]3CCCN4CCCC[C@H]34)ccc2o1 InChI=1S/C24H33NO3S/c26-24-12-9-19-17-21(10-11-23(19)28-24)27-15-4-1-5-16-29-18-20-7-6-14-25-13-3-2-8-22(20)25/h9-12,17,20,22H,1-8,13-16,18H2/t20-,22+/m0/s1 LARFNKKVRTVWOE-RBBKRZOGSA-N 50346421 6-(5-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methylthio)pentyloxy)-2H-chromen-2-one::CHEMBL1782748 Cholinesterase 5800 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346421 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346421&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53305117 131349352 CHEMBL1782748 ZINC71295563 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645421 CCN(CC)C(C)CN1c2ccccc2Sc2ccccc12 InChI=1S/C19H24N2S/c1-4-20(5-2)15(3)14-21-16-10-6-8-12-18(16)22-19-13-9-7-11-17(19)21/h6-13,15H,4-5,14H2,1-3H3 CDOZDBSBBXSXLB-UHFFFAOYSA-N 8958 10-(2-diethylaminopropyl)phenothiazine::CHEMBL1200970::CHEMBL1206::Ethopropazine::diethyl[1-(10H-phenothiazin-10-yl)propan-2-yl]amine Cholinesterase 720 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8958 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8958&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search BUW 6EQP 3290 46509734 313639 CHEMBL1200970CHEMBL1206 DB00392 7181 ZINC00056651 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645422 CN(C)CCCN1c2ccccc2Sc2ccc(cc12)C(F)(F)F InChI=1S/C18H19F3N2S/c1-22(2)10-5-11-23-14-6-3-4-7-16(14)24-17-9-8-13(12-15(17)23)18(19,20)21/h3-4,6-9,12H,5,10-11H2,1-2H3 XSCGXQMFQXDFCW-UHFFFAOYSA-N 67544 N,N-dimethyl-3-[2-(trifluoromethyl)-10-phenothiazinyl]-1-propanamine;hydrochloride::N,N-dimethyl-3-[2-(trifluoromethyl)phenothiazin-10-yl]propan-1-amine;hydrochloride::SR-01000000224-4::TRIFLUPROMAZINE::cid_66069::dimethyl-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]amine;hydrochloride::med.21724, Compound Triflupromazine Cholinesterase 7400 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=67544 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=67544&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5568 252645839 DB00508 ZINC00538507 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645423 OC1CCN(CCCN2c3ccccc3Sc3ccc(cc23)C#N)CC1 InChI=1S/C21H23N3OS/c22-15-16-6-7-21-19(14-16)24(18-4-1-2-5-20(18)26-21)11-3-10-23-12-8-17(25)9-13-23/h1-2,4-7,14,17,25H,3,8-13H2 LUALIOATIOESLM-UHFFFAOYSA-N 50346422 10-(3-(4-hydroxypiperidin-1-yl)propyl)-10H-phenothiazine-2-carbonitrile::CHEMBL251940::PROPERICIAZINE::periciazine Cholinesterase 230 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346422 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346422&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 4747 131349353 31981 CHEMBL251940 DB01608 ZINC00538159 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645424 C1CN2CCC1C(C2)N1c2ccccc2Sc2ccccc12 InChI=1S/C19H20N2S/c1-3-7-18-15(5-1)21(16-6-2-4-8-19(16)22-18)17-13-20-11-9-14(17)10-12-20/h1-8,14,17H,9-13H2 DZIUGYZZXPVEQO-UHFFFAOYSA-N 50346423 10-(1-Azabicyclo[2,2,2]oct-3-yl)phenothiazine::3-Phenothiazin-10-yl-1-azonia-bicyclo[2.2.2]octane::CHEMBL609132 Cholinesterase 3000 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346423 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346423&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 370124 131349354 CHEMBL609132 ZINC05593894 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645425 C([C@@H]1CCCN2CCCC[C@H]12)N1c2ccccc2Sc2ccccc12 InChI=1S/C22H26N2S/c1-3-12-21-19(10-1)24(20-11-2-4-13-22(20)25-21)16-17-8-7-15-23-14-6-5-9-18(17)23/h1-4,10-13,17-18H,5-9,14-16H2/t17-,18+/m0/s1 GZPPTPXSBCSPFO-ZWKOTPCHSA-N 50346424 CHEMBL1782708::lupinylphenothiazine Cholinesterase 2000 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346424 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346424&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54587097 131349355 CHEMBL1782708 ZINC01669268 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645426 C[N+]12CCCC[C@@H]1[C@H](CN1c3ccccc3Sc3ccccc13)CCC2 InChI=1S/C23H29N2S/c1-25-15-7-6-12-21(25)18(9-8-16-25)17-24-19-10-2-4-13-22(19)26-23-14-5-3-11-20(23)24/h2-5,10-11,13-14,18,21H,6-9,12,15-17H2,1H3/q+1/t18-,21+,25?/m0/s1 WHBJMLSMNQEBKY-BBRSIGJESA-N 50346425 (1S,9aR)-1-((10H-phenothiazin-10-yl)methyl)-5-methyldecahydroquinolizinium iodide::CHEMBL1782709 Cholinesterase 510 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346425 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346425&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54587099 131349356 CHEMBL1782709 ZINC71294682 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645427 FC(F)(F)c1ccc2Sc3ccccc3N(C[C@@H]3CCCN4CCCC[C@H]34)c2c1 InChI=1S/C23H25F3N2S/c24-23(25,26)17-10-11-22-20(14-17)28(19-8-1-2-9-21(19)29-22)15-16-6-5-13-27-12-4-3-7-18(16)27/h1-2,8-11,14,16,18H,3-7,12-13,15H2/t16-,18+/m0/s1 MRPBCSPHOZQBHD-FUHWJXTLSA-N 50346426 10-(((1S,9aR)-octahydro-1H-quinolizin-1-yl)methyl)-2-(trifluoromethyl)-10H-phenothiazine::CHEMBL1782710 Cholinesterase 4000 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346426 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346426&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54585140 131349357 CHEMBL1782710 ZINC71296020 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645428 C([C@@H]1CCCN2CCCC[C@H]12)N1c2ccccc2Oc2ccccc12 InChI=1S/C22H26N2O/c1-3-12-21-19(10-1)24(20-11-2-4-13-22(20)25-21)16-17-8-7-15-23-14-6-5-9-18(17)23/h1-4,10-13,17-18H,5-9,14-16H2/t17-,18+/m0/s1 YJQMMTUJLDBDEQ-ZWKOTPCHSA-N 50346427 10-(((1S,9aR)-octahydro-1H-quinolizin-1-yl)methyl)-10H-phenoxazine::CHEMBL1782711 Cholinesterase 2200 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346427 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346427&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54585141 131349358 CHEMBL1782711 ZINC05390480 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645429 C([C@@H]1CCCN2CCCC[C@H]12)N1c2ccccc2[Se]c2ccccc12 InChI=1S/C22H26N2Se/c1-3-12-21-19(10-1)24(20-11-2-4-13-22(20)25-21)16-17-8-7-15-23-14-6-5-9-18(17)23/h1-4,10-13,17-18H,5-9,14-16H2/t17-,18+/m0/s1 HQEXJFWZSQNDAX-ZWKOTPCHSA-N 50346428 10-(((1S,9aR)-octahydro-1H-quinolizin-1-yl)methyl)-10H-phenoselenazine::CHEMBL1782713 Cholinesterase 1100 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346428 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346428&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54586101 131349359 CHEMBL1782713 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645430 C([C@H]1CCCN2CCCC[C@H]12)N1c2ccccc2[Se]c2ccccc12 InChI=1S/C22H26N2Se/c1-3-12-21-19(10-1)24(20-11-2-4-13-22(20)25-21)16-17-8-7-15-23-14-6-5-9-18(17)23/h1-4,10-13,17-18H,5-9,14-16H2/t17-,18-/m1/s1 HQEXJFWZSQNDAX-QZTJIDSGSA-N 50346429 10-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methyl)-10H-phenoselenazine::CHEMBL1782714 Cholinesterase 870 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346429 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346429&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54585142 131349360 CHEMBL1782714 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645431 C([C@@H]1CCCN2CCCC[C@H]12)N1c2ccccc2Cc2ccccc12 InChI=1S/C23H28N2/c1-3-12-22-18(8-1)16-19-9-2-4-13-23(19)25(22)17-20-10-7-15-24-14-6-5-11-21(20)24/h1-4,8-9,12-13,20-21H,5-7,10-11,14-17H2/t20-,21+/m0/s1 MLKHRHOCCGTRMH-LEWJYISDSA-N 50346430 10-(((1S,9aR)-octahydro-1H-quinolizin-1-yl)methyl)-9,10-dihydroacridine::CHEMBL1782715 Cholinesterase 1400 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346430 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346430&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54583224 131349361 CHEMBL1782715 ZINC05390482 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645432 C([C@@H]1CCCN2CCCC[C@H]12)N1c2ccccc2CCc2ccccc12 InChI=1S/C24H30N2/c1-3-12-23-19(8-1)14-15-20-9-2-4-13-24(20)26(23)18-21-10-7-17-25-16-6-5-11-22(21)25/h1-4,8-9,12-13,21-22H,5-7,10-11,14-18H2/t21-,22+/m0/s1 JWPGJRXJVYVORQ-FCHUYYIVSA-N 50346431 5-(((1S,9aR)-octahydro-1H-quinolizin-1-yl)methyl)-10,11-dihydro-5H-dibenzo[b,f]azepine::CHEMBL1782716 Cholinesterase 2200 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346431 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346431&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54586102 131349362 CHEMBL1782716 ZINC05390479 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645433 C([C@@H]1CCCN2CCCC[C@H]12)N1c2ccccc2C=Cc2ccccc12 InChI=1S/C24H28N2/c1-3-12-23-19(8-1)14-15-20-9-2-4-13-24(20)26(23)18-21-10-7-17-25-16-6-5-11-22(21)25/h1-4,8-9,12-15,21-22H,5-7,10-11,16-18H2/t21-,22+/m0/s1 RTRVNRAJNZQPRH-FCHUYYIVSA-N 50346432 5-(((1S,9aR)-octahydro-1H-quinolizin-1-yl)methyl)-5H-dibenzo[b,f]azepine::CHEMBL1782717 Cholinesterase 2200 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346432 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346432&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54582247 131349363 CHEMBL1782717 ZINC05390484 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645434 CN1CCCC(CC2c3ccccc3Sc3ccccc23)C1 InChI=1S/C20H23NS/c1-21-12-6-7-15(14-21)13-18-16-8-2-4-10-19(16)22-20-11-5-3-9-17(18)20/h2-5,8-11,15,18H,6-7,12-14H2,1H3 MJFJKKXQDNNUJF-UHFFFAOYSA-N 79211 1-methyl-3-(9H-thioxanthen-9-ylmethyl)piperidine;hydrate;hydrochloride::METHIXENE::MLS002153842::Metixene::Metixene hydrochloride::SMR001233205::cid_71177 Cholinesterase 1600 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=79211 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=79211&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 4167 252655906 DB00340 ZINC01713960 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645439 C([C@@H]1CCCN2CCCC[C@H]12)C1c2ccccc2Sc2ccccc12 InChI=1S/C23H27NS/c1-3-12-22-18(9-1)20(19-10-2-4-13-23(19)25-22)16-17-8-7-15-24-14-6-5-11-21(17)24/h1-4,9-10,12-13,17,20-21H,5-8,11,14-16H2/t17-,21+/m0/s1 WVOUDCCPOUYBDE-LAUBAEHRSA-N 50346435 (1S,9aR)-1-((9H-thioxanthen-9-yl)methyl)octahydro-1H-quinolizine::CHEMBL1782718 Cholinesterase 150 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346435 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346435&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54585143 131349366 CHEMBL1782718 ZINC71295188 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645440 C[N+]12CCCC[C@@H]1[C@H](CC1c3ccccc3Sc3ccccc13)CCC2 InChI=1S/C24H30NS/c1-25-15-7-6-12-22(25)18(9-8-16-25)17-21-19-10-2-4-13-23(19)26-24-14-5-3-11-20(21)24/h2-5,10-11,13-14,18,21-22H,6-9,12,15-17H2,1H3/q+1/t18-,22+,25?/m0/s1 BLIMBNCYWMKEGF-HKUCRGJHSA-N 50346436 5-Methyl-1-(9H-thioxanthen-9-ylmethyl)-(1S,9aR)-octahydroquinolizinium iodide::CHEMBL1782719 Cholinesterase 410 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346436 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346436&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53304825 131349367 CHEMBL1782719 ZINC71296071 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645441 OC1(C[C@@H]2CCCN3CCCC[C@H]23)c2ccccc2Sc2ccccc12 InChI=1S/C23H27NOS/c25-23(16-17-8-7-15-24-14-6-5-11-20(17)24)18-9-1-3-12-21(18)26-22-13-4-2-10-19(22)23/h1-4,9-10,12-13,17,20,25H,5-8,11,14-16H2/t17-,20+/m0/s1 UQQDCAMIUCXPRV-FXAWDEMLSA-N 50346437 9-(((1S,9aR)-octahydro-1H-quinolizin-1-yl)methyl)-9H-thioxanthen-9-ol::CHEMBL1782720 Cholinesterase 950 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346437 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346437&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54587100 131349368 CHEMBL1782720 ZINC71294371 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645442 C1CCN2CCC[C@@H](C=C3c4ccccc4Sc4ccccc34)[C@H]2C1 InChI=1S/C23H25NS/c1-3-12-22-18(9-1)20(19-10-2-4-13-23(19)25-22)16-17-8-7-15-24-14-6-5-11-21(17)24/h1-4,9-10,12-13,16-17,21H,5-8,11,14-15H2/t17-,21+/m0/s1 DMUVJIIWYVZLFU-LAUBAEHRSA-N 50346438 (1S,9aR)-1-((9H-thioxanthen-9-ylidene)methyl)octahydro-1H-quinolizine::CHEMBL1782721 Cholinesterase 930 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346438 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346438&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54587101 131349369 CHEMBL1782721 ZINC71281097 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645443 C1CCN2CCC[C@@H](C=C3c4ccccc4CCc4ccccc34)[C@H]2C1 InChI=1S/C25H29N/c1-3-11-22-19(8-1)14-15-20-9-2-4-12-23(20)24(22)18-21-10-7-17-26-16-6-5-13-25(21)26/h1-4,8-9,11-12,18,21,25H,5-7,10,13-17H2/t21-,25+/m0/s1 XXJSMJREPJTXFU-SQJMNOBHSA-N 50346439 (1S,9aR)-1-(10,11-Dihydro-dibenzo[a,d]cyclohepten-5-ylidenemethyl)-octahydro-quinolizine::CHEMBL1782722 Cholinesterase 4200 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346439 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346439&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54582248 131349370 CHEMBL1782722 ZINC71294681 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645444 C1CCN2CCC[C@@H](C=C3c4ccccc4C=Cc4ccccc34)[C@H]2C1 InChI=1S/C25H27N/c1-3-11-22-19(8-1)14-15-20-9-2-4-12-23(20)24(22)18-21-10-7-17-26-16-6-5-13-25(21)26/h1-4,8-9,11-12,14-15,18,21,25H,5-7,10,13,16-17H2/t21-,25+/m0/s1 ZKCPMBXUVKYKAT-SQJMNOBHSA-N 50346440 (1S,9aR)-1-Dibenzo[a,d]cyclohepten-5-ylidenemethyl-octahydro-quinolizine::CHEMBL1782723 Cholinesterase 2000 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346440 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346440&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54581220 131349371 CHEMBL1782723 ZINC71295224 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645445 C([C@@H]1CCCN2CCCC[C@H]12)n1c2ccccc2c2ccccc12 InChI=1S/C22H26N2/c1-3-12-21-18(9-1)19-10-2-4-13-22(19)24(21)16-17-8-7-15-23-14-6-5-11-20(17)23/h1-4,9-10,12-13,17,20H,5-8,11,14-16H2/t17-,20+/m0/s1 MXAGSUACCIUARF-FXAWDEMLSA-N 50346441 9-[(1S,9aR)-(Octahydro-1H-quinolizin-1-yl)methyl]-9Hcarbazole::CHEMBL1782712 Cholinesterase 2000 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346441 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346441&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53304826 131349372 CHEMBL1782712 ZINC71294518 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645446 C(C1c2ccccc2-c2ccccc12)[C@@H]1CCCN2CCCC[C@H]12 InChI=1S/C23H27N/c1-3-11-20-18(9-1)19-10-2-4-12-21(19)22(20)16-17-8-7-15-24-14-6-5-13-23(17)24/h1-4,9-12,17,22-23H,5-8,13-16H2/t17-,23+/m0/s1 RPFNYEOSOUTFMU-GAJHUEQPSA-N 50346442 (1S,9aR)-1-((9H-fluoren-9-yl)methyl)octahydro-1H-quinolizine::CHEMBL1782724 Cholinesterase 630 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346442 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346442&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54584187 131349373 CHEMBL1782724 ZINC71295105 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50645447 C(C1c2ccccc2-c2ccccc12)[C@H]1CCCN2CCCC[C@H]12 InChI=1S/C23H27N/c1-3-11-20-18(9-1)19-10-2-4-12-21(19)22(20)16-17-8-7-15-24-14-6-5-13-23(17)24/h1-4,9-12,17,22-23H,5-8,13-16H2/t17-,23-/m1/s1 RPFNYEOSOUTFMU-UZUQRXQVSA-N 50346443 (1R,9aR)-1-((9H-fluoren-9-yl)methyl)octahydro-1H-quinolizine::CHEMBL1782725 Cholinesterase 1100 ChEMBL 10.1016/j.ejmech.2011.02.071 10.7270/Q2BK1CPG 21459491 Tasso, B; Catto, M; Nicolotti, O; Novelli, F; Tonelli, M; Giangreco, I; Pisani, L; Sparatore, A; Boido, V; Carotti, A; Sparatore, F Universit£ degli Studi di Genova http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50346443 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50346443&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54583225 131349374 CHEMBL1782725 ZINC71295804 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50630387 Cc1ccc(cc1)C1c2c(Oc3ccc4ccccc4c13)nc1CCCCc1c2N InChI=1S/C27H24N2O/c1-16-10-12-18(13-11-16)23-24-19-7-3-2-6-17(19)14-15-22(24)30-27-25(23)26(28)20-8-4-5-9-21(20)29-27/h2-3,6-7,10-15,23H,4-5,8-9H2,1H3,(H2,28,29) CHXPFOPYQVVSIH-UHFFFAOYSA-N 50340108 CHEMBL1762826::rac-14-(4'-Methylphenyl)-10,11,12,14-tetrahydro-9H-benzo[5,6]chromeno[2,3-b]quinolin-13-amine Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2011.02.094 10.7270/Q2D79BQQ 21411323 Maalej, E; Chabchoub, F; Samadi, A; de los Rios, C; Perona, A; Morreale, A; Marco-Contelles, J Universit£ de Sfax http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50340108 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50340108&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54581054 131343044 CHEMBL1762826 ZINC71317062 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50630388 Nc1c2CCCCc2nc2Oc3ccc4ccccc4c3C(c3ccc(O)cc3)c12 InChI=1S/C26H22N2O2/c27-25-19-7-3-4-8-20(19)28-26-24(25)22(16-9-12-17(29)13-10-16)23-18-6-2-1-5-15(18)11-14-21(23)30-26/h1-2,5-6,9-14,22,29H,3-4,7-8H2,(H2,27,28) CSKKIWCKDPLSDW-UHFFFAOYSA-N 50340109 CHEMBL1762827::rac-4-[(13-Amino-10,11,12,14-tetrahydro-9H-benzo[5,6]chromeno[2,3-b]quinolin-14-yl]phenol Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2011.02.094 10.7270/Q2D79BQQ 21411323 Maalej, E; Chabchoub, F; Samadi, A; de los Rios, C; Perona, A; Morreale, A; Marco-Contelles, J Universit£ de Sfax http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50340109 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50340109&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 52918291 131343045 CHEMBL1762827 ZINC71316303 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50630389 COc1ccc(cc1)C1c2c(N)c3CCCCc3nc2Oc2ccc3ccccc3c12 InChI=1S/C27H24N2O2/c1-30-18-13-10-17(11-14-18)23-24-19-7-3-2-6-16(19)12-15-22(24)31-27-25(23)26(28)20-8-4-5-9-21(20)29-27/h2-3,6-7,10-15,23H,4-5,8-9H2,1H3,(H2,28,29) GZKOZWKZCQCMFW-UHFFFAOYSA-N 50340110 CHEMBL1762828::rac-14-(4'-Methoxyphenyl)-10,11,12,14-tetrahydro-9H-benzo[5,6]chromeno[2,3-b]quinolin-13-amine Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2011.02.094 10.7270/Q2D79BQQ 21411323 Maalej, E; Chabchoub, F; Samadi, A; de los Rios, C; Perona, A; Morreale, A; Marco-Contelles, J Universit£ de Sfax http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50340110 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50340110&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54580072 131343046 CHEMBL1762828 ZINC71329248 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50630390 COc1cccc(c1)C1c2c(N)c3CCCCc3nc2Oc2ccc3ccccc3c12 InChI=1S/C27H24N2O2/c1-30-18-9-6-8-17(15-18)23-24-19-10-3-2-7-16(19)13-14-22(24)31-27-25(23)26(28)20-11-4-5-12-21(20)29-27/h2-3,6-10,13-15,23H,4-5,11-12H2,1H3,(H2,28,29) KSDJTELWHBDLIN-UHFFFAOYSA-N 50340111 CHEMBL1762829::rac-14-(3'-Methoxyphenyl)-10,11,12,14-tetrahydro-9H-benzo[5,6]chromeno[2,3-b]quinolin-13-amine Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2011.02.094 10.7270/Q2D79BQQ 21411323 Maalej, E; Chabchoub, F; Samadi, A; de los Rios, C; Perona, A; Morreale, A; Marco-Contelles, J Universit£ de Sfax http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50340111 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50340111&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54584040 131343047 CHEMBL1762829 ZINC71329593 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50630391 COc1ccccc1C1c2c(N)c3CCCCc3nc2Oc2ccc3ccccc3c12 InChI=1S/C27H24N2O2/c1-30-21-13-7-5-11-19(21)24-23-17-9-3-2-8-16(17)14-15-22(23)31-27-25(24)26(28)18-10-4-6-12-20(18)29-27/h2-3,5,7-9,11,13-15,24H,4,6,10,12H2,1H3,(H2,28,29) QVGAOTIUMFMLBN-UHFFFAOYSA-N 50340112 CHEMBL1762830::rac-14-(2'-Methoxyphenyl)-10,11,12,14-tetrahydro-9H-benzo[5,6]chromeno[2,3-b]quinolin-13-amine Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2011.02.094 10.7270/Q2D79BQQ 21411323 Maalej, E; Chabchoub, F; Samadi, A; de los Rios, C; Perona, A; Morreale, A; Marco-Contelles, J Universit£ de Sfax http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50340112 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50340112&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54584994 131343048 CHEMBL1762830 ZINC71296442 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50630392 COc1cc(ccc1O)C1c2c(N)c3CCCc3nc2Oc2ccc3ccccc3c12 InChI=1S/C26H22N2O3/c1-30-21-13-15(9-11-19(21)29)22-23-16-6-3-2-5-14(16)10-12-20(23)31-26-24(22)25(27)17-7-4-8-18(17)28-26/h2-3,5-6,9-13,22,29H,4,7-8H2,1H3,(H2,27,28) JPZOSHNEWNUMJQ-UHFFFAOYSA-N 50340113 CHEMBL1762831::rac-4-[12-Amino-9,10,11,13-tetrahydrobenzo[5,6]chromeno[2,3-b]cyclopenta[e]pyridin-13-yl]-2-methoxyphenol Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2011.02.094 10.7270/Q2D79BQQ 21411323 Maalej, E; Chabchoub, F; Samadi, A; de los Rios, C; Perona, A; Morreale, A; Marco-Contelles, J Universit£ de Sfax http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50340113 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50340113&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54581055 131343049 CHEMBL1762831 ZINC71296981 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50630393 COc1cc(ccc1O)C1c2c(N)c3CCCCc3nc2Oc2ccc3ccccc3c12 InChI=1S/C27H24N2O3/c1-31-22-14-16(10-12-20(22)30)23-24-17-7-3-2-6-15(17)11-13-21(24)32-27-25(23)26(28)18-8-4-5-9-19(18)29-27/h2-3,6-7,10-14,23,30H,4-5,8-9H2,1H3,(H2,28,29) WUDMZCGNMXLYBE-UHFFFAOYSA-N 50340114 CHEMBL1762832::rac-4-[13-Amino-10,11,12,14-tetrahydro-9H-benzo[5,6]chromeno[2,3-b]quinolin-14-yl]-2-methoxyphenol Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2011.02.094 10.7270/Q2D79BQQ 21411323 Maalej, E; Chabchoub, F; Samadi, A; de los Rios, C; Perona, A; Morreale, A; Marco-Contelles, J Universit£ de Sfax http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50340114 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50340114&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54583031 131343050 CHEMBL1762832 ZINC71318572 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50630394 COc1ccc(cc1OC)C1c2c(N)c3CCCCc3nc2Oc2ccc3ccccc3c12 InChI=1S/C28H26N2O3/c1-31-21-13-12-17(15-23(21)32-2)24-25-18-8-4-3-7-16(18)11-14-22(25)33-28-26(24)27(29)19-9-5-6-10-20(19)30-28/h3-4,7-8,11-15,24H,5-6,9-10H2,1-2H3,(H2,29,30) KFJSZOXQHHFOPN-UHFFFAOYSA-N 50340115 CHEMBL1762833::rac-14-(3',4'-Dimethoxyphenyl)-10,11,12,14-tetrahydro-9H-benzo[5,6]chromeno[2,3-b]quinolin-13-amine Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2011.02.094 10.7270/Q2D79BQQ 21411323 Maalej, E; Chabchoub, F; Samadi, A; de los Rios, C; Perona, A; Morreale, A; Marco-Contelles, J Universit£ de Sfax http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50340115 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50340115&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54584995 131343051 CHEMBL1762833 ZINC71318596 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50630395 COc1cc(cc(OC)c1OC)C1c2c(N)c3CCCCc3nc2Oc2ccc3ccccc3c12 InChI=1S/C29H28N2O4/c1-32-22-14-17(15-23(33-2)28(22)34-3)24-25-18-9-5-4-8-16(18)12-13-21(25)35-29-26(24)27(30)19-10-6-7-11-20(19)31-29/h4-5,8-9,12-15,24H,6-7,10-11H2,1-3H3,(H2,30,31) DDZQZFCLNJWTRS-UHFFFAOYSA-N 50340116 CHEMBL1762834::rac-14-(3',4',5'-Trimethoxyphenyl)-10,11,12,14-tetrahydro-9H-benzo[5,6]chromeno[2,3-b]quinolin-13-amine Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2011.02.094 10.7270/Q2D79BQQ 21411323 Maalej, E; Chabchoub, F; Samadi, A; de los Rios, C; Perona, A; Morreale, A; Marco-Contelles, J Universit£ de Sfax http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50340116 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50340116&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54585943 131343052 CHEMBL1762834 ZINC71319309 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50630396 Nc1c2CCCCc2nc2Oc3ccc4ccccc4c3C(c3ccc(cc3)[N+]([O-])=O)c12 InChI=1S/C26H21N3O3/c27-25-19-7-3-4-8-20(19)28-26-24(25)22(16-9-12-17(13-10-16)29(30)31)23-18-6-2-1-5-15(18)11-14-21(23)32-26/h1-2,5-6,9-14,22H,3-4,7-8H2,(H2,27,28) ZAYJCQAUIAWUDR-UHFFFAOYSA-N 50340117 CHEMBL1762835::rac-14-(4'-Nitrophenyl)-10,11,12,14-tetrahydro-9H-benzo[5,6]chromeno[2,3-b]quinolin-13-amine Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2011.02.094 10.7270/Q2D79BQQ 21411323 Maalej, E; Chabchoub, F; Samadi, A; de los Rios, C; Perona, A; Morreale, A; Marco-Contelles, J Universit£ de Sfax http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50340117 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50340117&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54583032 131343053 CHEMBL1762835 ZINC71330001 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50630397 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 5.2 ChEMBL 10.1016/j.bmcl.2011.02.094 10.7270/Q2D79BQQ 21411323 Maalej, E; Chabchoub, F; Samadi, A; de los Rios, C; Perona, A; Morreale, A; Marco-Contelles, J Universit£ de Sfax http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50636987 CN(C)CCOc1cnc2-c3ccccc3C(=O)c3cccc1c23 InChI=1S/C20H18N2O2/c1-22(2)10-11-24-17-12-21-19-13-6-3-4-7-14(13)20(23)16-9-5-8-15(17)18(16)19/h3-9,12H,10-11H2,1-2H3 YJUZOLKITOBRRR-UHFFFAOYSA-N 50342754 3-(2-(Dimethylamino)ethoxy)-7H-dibenzo[de,h]quinolin-7-one::CHEMBL1770204 Cholinesterase 1640 ChEMBL 10.1016/j.ejmech.2011.02.005 10.7270/Q2TM7BFW 21367493 Li, YP; Ning, FX; Yang, MB; Li, YC; Nie, MH; Ou, TM; Tan, JH; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50342754 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50342754&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53231529 131345690 CHEMBL1770204 ZINC71420827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50636988 CCN(CC)CCOc1cnc2-c3ccccc3C(=O)c3cccc1c23 InChI=1S/C22H22N2O2/c1-3-24(4-2)12-13-26-19-14-23-21-15-8-5-6-9-16(15)22(25)18-11-7-10-17(19)20(18)21/h5-11,14H,3-4,12-13H2,1-2H3 MTEXBKFFTSVXID-UHFFFAOYSA-N 50342755 3-(2-(Diethylamino)ethoxy)-7H-dibenzo[de,h]quinolin-7-one::CHEMBL1770201 Cholinesterase 1486 ChEMBL 10.1016/j.ejmech.2011.02.005 10.7270/Q2TM7BFW 21367493 Li, YP; Ning, FX; Yang, MB; Li, YC; Nie, MH; Ou, TM; Tan, JH; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50342755 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50342755&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53231530 131345691 CHEMBL1770201 ZINC71340442 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50636989 O=C1c2ccccc2-c2ncc(OCCN3CCCC3)c3cccc1c23 InChI=1S/C22H20N2O2/c25-22-16-7-2-1-6-15(16)21-20-17(8-5-9-18(20)22)19(14-23-21)26-13-12-24-10-3-4-11-24/h1-2,5-9,14H,3-4,10-13H2 AXICBACTWUBGMF-UHFFFAOYSA-N 50342756 3-(2-(Pyrrolidin-1-yl)ethoxy)-7H-dibenzo[de,h]quinolin-7-one::CHEMBL1770200 Cholinesterase 790 ChEMBL 10.1016/j.ejmech.2011.02.005 10.7270/Q2TM7BFW 21367493 Li, YP; Ning, FX; Yang, MB; Li, YC; Nie, MH; Ou, TM; Tan, JH; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50342756 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50342756&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53231531 131345692 CHEMBL1770200 ZINC71342014 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50636990 O=C1c2ccccc2-c2ncc(OCCN3CCCCC3)c3cccc1c23 InChI=1S/C23H22N2O2/c26-23-17-8-3-2-7-16(17)22-21-18(9-6-10-19(21)23)20(15-24-22)27-14-13-25-11-4-1-5-12-25/h2-3,6-10,15H,1,4-5,11-14H2 HODFYJBDWOPUQK-UHFFFAOYSA-N 50342757 3-(2-(Piperidin-1-yl)ethoxy)-7H-dibenzo[de,h]quinolin-7-one::CHEMBL1770199 Cholinesterase 723 ChEMBL 10.1016/j.ejmech.2011.02.005 10.7270/Q2TM7BFW 21367493 Li, YP; Ning, FX; Yang, MB; Li, YC; Nie, MH; Ou, TM; Tan, JH; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50342757 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50342757&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53231532 131345693 CHEMBL1770199 ZINC71342048 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50636991 C[N+](C)(C)CCOc1cnc2-c3ccccc3C(=O)c3cccc1c23 InChI=1S/C21H21N2O2/c1-23(2,3)11-12-25-18-13-22-20-14-7-4-5-8-15(14)21(24)17-10-6-9-16(18)19(17)20/h4-10,13H,11-12H2,1-3H3/q+1 YGCNKTQCSRVOMY-UHFFFAOYSA-N 50342758 CHEMBL1770198::N,N,N-trimethyl-2-(7-oxo-7H-dibenzo[de,h]quinolin-3-yloxy)ethanaminium iodide Cholinesterase 972 ChEMBL 10.1016/j.ejmech.2011.02.005 10.7270/Q2TM7BFW 21367493 Li, YP; Ning, FX; Yang, MB; Li, YC; Nie, MH; Ou, TM; Tan, JH; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50342758 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50342758&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53231534 131345694 CHEMBL1770198 ZINC71340714 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50636992 CC[N+](C)(CC)CCOc1cnc2-c3ccccc3C(=O)c3cccc1c23 InChI=1S/C23H25N2O2/c1-4-25(3,5-2)13-14-27-20-15-24-22-16-9-6-7-10-17(16)23(26)19-12-8-11-18(20)21(19)22/h6-12,15H,4-5,13-14H2,1-3H3/q+1 ABMHYDLGKOCRPF-UHFFFAOYSA-N 50342759 CHEMBL1770197::N,N-diethyl-N-methyl-2-(7-oxo-7H-dibenzo[de,h]quinolin-3-yloxy)ethanaminium iodide Cholinesterase 708 ChEMBL 10.1016/j.ejmech.2011.02.005 10.7270/Q2TM7BFW 21367493 Li, YP; Ning, FX; Yang, MB; Li, YC; Nie, MH; Ou, TM; Tan, JH; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50342759 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50342759&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53231536 131345695 CHEMBL1770197 ZINC71341650 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50636993 C[N+]1(CCOc2cnc3-c4ccccc4C(=O)c4cccc2c34)CCCC1 InChI=1S/C23H23N2O2/c1-25(11-4-5-12-25)13-14-27-20-15-24-22-16-7-2-3-8-17(16)23(26)19-10-6-9-18(20)21(19)22/h2-3,6-10,15H,4-5,11-14H2,1H3/q+1 AUHBAWMQACSNCQ-UHFFFAOYSA-N 50342760 1-methyl-1-(2-(7-oxo-7H-dibenzo[de,h]quinolin-3-yloxy)ethyl)pyrrolidinium iodide::CHEMBL1770203 Cholinesterase 302 ChEMBL 10.1016/j.ejmech.2011.02.005 10.7270/Q2TM7BFW 21367493 Li, YP; Ning, FX; Yang, MB; Li, YC; Nie, MH; Ou, TM; Tan, JH; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50342760 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50342760&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53231768 131345696 CHEMBL1770203 ZINC71359407 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50636994 C[N+]1(CCOc2cnc3-c4ccccc4C(=O)c4cccc2c34)CCCCC1 InChI=1S/C24H25N2O2/c1-26(12-5-2-6-13-26)14-15-28-21-16-25-23-17-8-3-4-9-18(17)24(27)20-11-7-10-19(21)22(20)23/h3-4,7-11,16H,2,5-6,12-15H2,1H3/q+1 ZTTKISAGSBXNKQ-UHFFFAOYSA-N 50342761 1-methyl-1-(2-(7-oxo-7H-dibenzo[de,h]quinolin-3-yloxy)ethyl)piperidinium iodide::CHEMBL1770202 Cholinesterase 255 ChEMBL 10.1016/j.ejmech.2011.02.005 10.7270/Q2TM7BFW 21367493 Li, YP; Ning, FX; Yang, MB; Li, YC; Nie, MH; Ou, TM; Tan, JH; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50342761 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50342761&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53231653 131345697 CHEMBL1770202 ZINC71331654 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50636995 CCN(CC)CCOc1ccc2C(=O)c3ccccc3-c3nccc1c23 InChI=1S/C22H22N2O2/c1-3-24(4-2)13-14-26-19-10-9-18-20-17(19)11-12-23-21(20)15-7-5-6-8-16(15)22(18)25/h5-12H,3-4,13-14H2,1-2H3 CNPWXPJDNUFTRA-UHFFFAOYSA-N 50342762 4-(2-(Diethylamino)ethoxy)-7H-dibenzo[de,h]quinolin-7-one::CHEMBL1770152 Cholinesterase 3068 ChEMBL 10.1016/j.ejmech.2011.02.005 10.7270/Q2TM7BFW 21367493 Li, YP; Ning, FX; Yang, MB; Li, YC; Nie, MH; Ou, TM; Tan, JH; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50342762 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50342762&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53231655 131345698 CHEMBL1770152 ZINC71341519 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50636996 CCN(CC)CCCOc1ccc2C(=O)c3ccccc3-c3nccc1c23 InChI=1S/C23H24N2O2/c1-3-25(4-2)14-7-15-27-20-11-10-19-21-18(20)12-13-24-22(21)16-8-5-6-9-17(16)23(19)26/h5-6,8-13H,3-4,7,14-15H2,1-2H3 ZDPSFZOJIPSGRF-UHFFFAOYSA-N 50342763 4-(3-(Diethylamino)propoxy)-7H-dibenzo[de,h]quinolin-7-one::CHEMBL1770196 Cholinesterase 2696 ChEMBL 10.1016/j.ejmech.2011.02.005 10.7270/Q2TM7BFW 21367493 Li, YP; Ning, FX; Yang, MB; Li, YC; Nie, MH; Ou, TM; Tan, JH; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50342763 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50342763&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 52953211 131345699 CHEMBL1770196 ZINC71335225 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50636997 O=C1c2ccccc2-c2nccc3c(OCCN4CCCCC4)ccc1c23 InChI=1S/C23H22N2O2/c26-23-17-7-3-2-6-16(17)22-21-18(10-11-24-22)20(9-8-19(21)23)27-15-14-25-12-4-1-5-13-25/h2-3,6-11H,1,4-5,12-15H2 LZRZFBQWWOJNLQ-UHFFFAOYSA-N 50342764 4-(2-(Piperidin-1-yl)ethoxy)-7H-dibenzo[de,h]quinolin-7-one::CHEMBL1770205 Cholinesterase 2208 ChEMBL 10.1016/j.ejmech.2011.02.005 10.7270/Q2TM7BFW 21367493 Li, YP; Ning, FX; Yang, MB; Li, YC; Nie, MH; Ou, TM; Tan, JH; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50342764 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50342764&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 52953210 131345700 CHEMBL1770205 ZINC71405087 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50636998 O=C1c2ccccc2-c2nccc3c(OCCCN4CCCCC4)ccc1c23 InChI=1S/C24H24N2O2/c27-24-18-8-3-2-7-17(18)23-22-19(11-12-25-23)21(10-9-20(22)24)28-16-6-15-26-13-4-1-5-14-26/h2-3,7-12H,1,4-6,13-16H2 AQQCKOMUSAPZEU-UHFFFAOYSA-N 50342765 4-(3-(Piperidin-1-yl)propoxy)-7H-dibenzo[de,h]quinolin-7-one::CHEMBL1770206 Cholinesterase 905 ChEMBL 10.1016/j.ejmech.2011.02.005 10.7270/Q2TM7BFW 21367493 Li, YP; Ning, FX; Yang, MB; Li, YC; Nie, MH; Ou, TM; Tan, JH; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50342765 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50342765&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 52953209 131345701 CHEMBL1770206 ZINC71420888 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50636999 CN1CCN(CCOc2ccc3C(=O)c4ccccc4-c4nccc2c34)CC1 InChI=1S/C23H23N3O2/c1-25-10-12-26(13-11-25)14-15-28-20-7-6-19-21-18(20)8-9-24-22(21)16-4-2-3-5-17(16)23(19)27/h2-9H,10-15H2,1H3 NWDIJOHBBCBVAQ-UHFFFAOYSA-N 50342766 4-(2-(4-Methylpiperazin-1-yl)ethoxy)-7H-dibenzo[de,h]quinolin-7-one::CHEMBL1770207 Cholinesterase 2748 ChEMBL 10.1016/j.ejmech.2011.02.005 10.7270/Q2TM7BFW 21367493 Li, YP; Ning, FX; Yang, MB; Li, YC; Nie, MH; Ou, TM; Tan, JH; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50342766 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50342766&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53231656 131345702 CHEMBL1770207 ZINC71341858 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50637000 CN1CCN(CCCOc2ccc3C(=O)c4ccccc4-c4nccc2c34)CC1 InChI=1S/C24H25N3O2/c1-26-12-14-27(15-13-26)11-4-16-29-21-8-7-20-22-19(21)9-10-25-23(22)17-5-2-3-6-18(17)24(20)28/h2-3,5-10H,4,11-16H2,1H3 LOIVFJYITDDQIW-UHFFFAOYSA-N 50342767 4-(3-(4-Methylpiperazin-1-yl)propoxy)-7H-dibenzo[de,h]quinolin-7-one::CHEMBL1770208 Cholinesterase 5498 ChEMBL 10.1016/j.ejmech.2011.02.005 10.7270/Q2TM7BFW 21367493 Li, YP; Ning, FX; Yang, MB; Li, YC; Nie, MH; Ou, TM; Tan, JH; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50342767 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50342767&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53231657 131345703 CHEMBL1770208 ZINC71335340 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50637001 CN(C)CCCNc1ccc2C(=O)c3ccccc3-c3nccc1c23 InChI=1S/C21H21N3O/c1-24(2)13-5-11-22-18-9-8-17-19-16(18)10-12-23-20(19)14-6-3-4-7-15(14)21(17)25/h3-4,6-10,12,22H,5,11,13H2,1-2H3 ZBMIZTIAZBZING-UHFFFAOYSA-N 50342768 4-(3-(Dimethylamino)propylamino)-7H-dibenzo[de,h]quinolin-7-one::CHEMBL1770209 Cholinesterase 3350 ChEMBL 10.1016/j.ejmech.2011.02.005 10.7270/Q2TM7BFW 21367493 Li, YP; Ning, FX; Yang, MB; Li, YC; Nie, MH; Ou, TM; Tan, JH; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50342768 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50342768&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 52953208 131345704 CHEMBL1770209 ZINC71340484 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50637002 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 11 ChEMBL 10.1016/j.ejmech.2011.02.005 10.7270/Q2TM7BFW 21367493 Li, YP; Ning, FX; Yang, MB; Li, YC; Nie, MH; Ou, TM; Tan, JH; Huang, SL; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50664158 CN1CCN(CC1)c1nccc(NCc2cccc3ccccc23)n1 InChI=1S/C20H23N5/c1-24-11-13-25(14-12-24)20-21-10-9-19(23-20)22-15-17-7-4-6-16-5-2-3-8-18(16)17/h2-10H,11-15H2,1H3,(H,21,22,23) NFCOLVLKQFZNOB-UHFFFAOYSA-N 50319981 2-(4-methylpiperazin-1-yl)-N-(naphthalen-1-ylmethyl)pyrimidin-4-amine::CHEMBL1084213 Cholinesterase 2600 ChEMBL 10.1016/j.bmcl.2011.07.091 10.7270/Q2C829P7 21873056 Mohamed, T; Yeung, JC; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50319981 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50319981&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46891120 104154342 CHEMBL1084213 ZINC49046157 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50664159 CC1CCN(CC1)c1nccc(NCc2cccc3ccccc23)n1 InChI=1S/C21H24N4/c1-16-10-13-25(14-11-16)21-22-12-9-20(24-21)23-15-18-7-4-6-17-5-2-3-8-19(17)18/h2-9,12,16H,10-11,13-15H2,1H3,(H,22,23,24) NWKKJIKRNYNBQW-UHFFFAOYSA-N 50342149 2-(4-Methylpiperidin-1-yl)-N-(naphth-1-ylmethyl)pyrimidin-4-amine::CHEMBL1766151 Cholinesterase 2200 ChEMBL 10.1016/j.bmcl.2011.07.091 10.7270/Q2C829P7 21873056 Mohamed, T; Yeung, JC; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50342149 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50342149&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54587308 131345085 CHEMBL1766151 ZINC71329475 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50664162 CC(C)(C)OC(=O)N1CCN(CC1)c1nccc(NCc2cccc3ccccc23)n1 InChI=1S/C24H29N5O2/c1-24(2,3)31-23(30)29-15-13-28(14-16-29)22-25-12-11-21(27-22)26-17-19-9-6-8-18-7-4-5-10-20(18)19/h4-12H,13-17H2,1-3H3,(H,25,26,27) BJXFHKHIABEKFL-UHFFFAOYSA-N 50354721 CHEMBL1834065 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2011.07.091 10.7270/Q2C829P7 21873056 Mohamed, T; Yeung, JC; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50354721 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50354721&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56661786 136361407 CHEMBL1834065 ZINC72123403 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50664163 CC(C)(C)OC(=O)N1CCN(CC1)c1nccc(NC(c2ccccc2)c2ccccc2)n1 InChI=1S/C26H31N5O2/c1-26(2,3)33-25(32)31-18-16-30(17-19-31)24-27-15-14-22(29-24)28-23(20-10-6-4-7-11-20)21-12-8-5-9-13-21/h4-15,23H,16-19H2,1-3H3,(H,27,28,29) ZSZJENSOCJBMJJ-UHFFFAOYSA-N 50354720 CHEMBL1834076 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2011.07.091 10.7270/Q2C829P7 21873056 Mohamed, T; Yeung, JC; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50354720 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50354720&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56665232 136361406 CHEMBL1834076 ZINC72126123 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50664164 C1CN(CCN1)c1nccc(NC(c2ccccc2)c2ccccc2)n1 InChI=1S/C21H23N5/c1-3-7-17(8-4-1)20(18-9-5-2-6-10-18)24-19-11-12-23-21(25-19)26-15-13-22-14-16-26/h1-12,20,22H,13-16H2,(H,23,24,25) PSBOCDRVKVEKLS-UHFFFAOYSA-N 50354722 CHEMBL1834077 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2011.07.091 10.7270/Q2C829P7 21873056 Mohamed, T; Yeung, JC; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50354722 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50354722&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56658287 136361408 CHEMBL1834077 ZINC72125796 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50664165 COCCN1CCN(CC1)c1nccc(NC(c2ccccc2)c2ccccc2)n1 InChI=1S/C24H29N5O/c1-30-19-18-28-14-16-29(17-15-28)24-25-13-12-22(27-24)26-23(20-8-4-2-5-9-20)21-10-6-3-7-11-21/h2-13,23H,14-19H2,1H3,(H,25,26,27) XMNROCANBHGXJN-UHFFFAOYSA-N 50354723 CHEMBL1834079 Cholinesterase 28400 ChEMBL 10.1016/j.bmcl.2011.07.091 10.7270/Q2C829P7 21873056 Mohamed, T; Yeung, JC; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50354723 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50354723&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56675546 136361409 CHEMBL1834079 ZINC72125798 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50664166 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 21 ChEMBL 10.1016/j.bmcl.2011.07.091 10.7270/Q2C829P7 21873056 Mohamed, T; Yeung, JC; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50664167 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 3600 ChEMBL 10.1016/j.bmcl.2011.07.091 10.7270/Q2C829P7 21873056 Mohamed, T; Yeung, JC; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50664168 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 12600 ChEMBL 10.1016/j.bmcl.2011.07.091 10.7270/Q2C829P7 21873056 Mohamed, T; Yeung, JC; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50664191 CC(C)N1CCN(CC1)c1nccc(NCc2cccc3ccccc23)n1 InChI=1S/C22H27N5/c1-17(2)26-12-14-27(15-13-26)22-23-11-10-21(25-22)24-16-19-8-5-7-18-6-3-4-9-20(18)19/h3-11,17H,12-16H2,1-2H3,(H,23,24,25) TYKPGRUYXMYNGZ-UHFFFAOYSA-N 50354724 CHEMBL1834060 Cholinesterase 7600 ChEMBL 10.1016/j.bmcl.2011.07.091 10.7270/Q2C829P7 21873056 Mohamed, T; Yeung, JC; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50354724 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50354724&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56661785 136361410 CHEMBL1834060 ZINC72124399 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50664192 CC(C)C1CCN(CC1)c1nccc(NCc2cccc3ccccc23)n1 InChI=1S/C23H28N4/c1-17(2)18-11-14-27(15-12-18)23-24-13-10-22(26-23)25-16-20-8-5-7-19-6-3-4-9-21(19)20/h3-10,13,17-18H,11-12,14-16H2,1-2H3,(H,24,25,26) XRGDRBAOIBNRQZ-UHFFFAOYSA-N 50354725 CHEMBL1834061 Cholinesterase 9100 ChEMBL 10.1016/j.bmcl.2011.07.091 10.7270/Q2C829P7 21873056 Mohamed, T; Yeung, JC; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50354725 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50354725&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56668687 136361411 CHEMBL1834061 ZINC72123468 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50664193 CCCN1CCN(CC1)c1nccc(NCc2cccc3ccccc23)n1 InChI=1S/C22H27N5/c1-2-12-26-13-15-27(16-14-26)22-23-11-10-21(25-22)24-17-19-8-5-7-18-6-3-4-9-20(18)19/h3-11H,2,12-17H2,1H3,(H,23,24,25) XCJNYXHURPREPK-UHFFFAOYSA-N 50354726 CHEMBL1834062 Cholinesterase 18100 ChEMBL 10.1016/j.bmcl.2011.07.091 10.7270/Q2C829P7 21873056 Mohamed, T; Yeung, JC; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50354726 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50354726&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56668688 136361412 CHEMBL1834062 ZINC72123155 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50664194 C(Nc1ccnc(n1)N1CCN(CC1)C1CCCCC1)c1cccc2ccccc12 InChI=1S/C25H31N5/c1-2-10-22(11-3-1)29-15-17-30(18-16-29)25-26-14-13-24(28-25)27-19-21-9-6-8-20-7-4-5-12-23(20)21/h4-9,12-14,22H,1-3,10-11,15-19H2,(H,26,27,28) DPVZNLKVPWECGM-UHFFFAOYSA-N 50354727 CHEMBL1834063 Cholinesterase 3900 ChEMBL 10.1016/j.bmcl.2011.07.091 10.7270/Q2C829P7 21873056 Mohamed, T; Yeung, JC; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50354727 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50354727&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53484185 136361413 CHEMBL1834063 ZINC72122801 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50664195 CC(=O)N1CCN(CC1)c1nccc(NCc2cccc3ccccc23)n1 InChI=1S/C21H23N5O/c1-16(27)25-11-13-26(14-12-25)21-22-10-9-20(24-21)23-15-18-7-4-6-17-5-2-3-8-19(17)18/h2-10H,11-15H2,1H3,(H,22,23,24) VWSPYGVSTWEEDZ-UHFFFAOYSA-N 50354728 CHEMBL1834064 Cholinesterase 32900 ChEMBL 10.1016/j.bmcl.2011.07.091 10.7270/Q2C829P7 21873056 Mohamed, T; Yeung, JC; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50354728 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50354728&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56672159 136361414 CHEMBL1834064 ZINC72141082 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50664196 C(Nc1ccnc(n1)N1CCNCC1)c1cccc2ccccc12 InChI=1S/C19H21N5/c1-2-7-17-15(4-1)5-3-6-16(17)14-22-18-8-9-21-19(23-18)24-12-10-20-11-13-24/h1-9,20H,10-14H2,(H,21,22,23) XGFNUPSMSGUBHW-UHFFFAOYSA-N 50354729 CHEMBL1834066 Cholinesterase 25400 ChEMBL 10.1016/j.bmcl.2011.07.091 10.7270/Q2C829P7 21873056 Mohamed, T; Yeung, JC; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50354729 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50354729&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56672160 136361415 CHEMBL1834066 ZINC72123404 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50664197 OCCN1CCN(CC1)c1nccc(NCc2cccc3ccccc23)n1 InChI=1S/C21H25N5O/c27-15-14-25-10-12-26(13-11-25)21-22-9-8-20(24-21)23-16-18-6-3-5-17-4-1-2-7-19(17)18/h1-9,27H,10-16H2,(H,22,23,24) DHFIEEAUWIMEDU-UHFFFAOYSA-N 50354730 CHEMBL1834067 Cholinesterase 17900 ChEMBL 10.1016/j.bmcl.2011.07.091 10.7270/Q2C829P7 21873056 Mohamed, T; Yeung, JC; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50354730 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50354730&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56678881 136361416 CHEMBL1834067 ZINC72123405 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50664198 COCCN1CCN(CC1)c1nccc(NCc2cccc3ccccc23)n1 InChI=1S/C22H27N5O/c1-28-16-15-26-11-13-27(14-12-26)22-23-10-9-21(25-22)24-17-19-7-4-6-18-5-2-3-8-20(18)19/h2-10H,11-17H2,1H3,(H,23,24,25) DZIRKEXGKAKOQQ-UHFFFAOYSA-N 50354731 CHEMBL1834068 Cholinesterase 26500 ChEMBL 10.1016/j.bmcl.2011.07.091 10.7270/Q2C829P7 21873056 Mohamed, T; Yeung, JC; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50354731 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50354731&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56661787 136361417 CHEMBL1834068 ZINC72123234 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50664199 CN1CCN(CC1)c1nccc(NC(c2ccccc2)c2ccccc2)n1 InChI=1S/C22H25N5/c1-26-14-16-27(17-15-26)22-23-13-12-20(25-22)24-21(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-13,21H,14-17H2,1H3,(H,23,24,25) QNWZDUYKZZHAGJ-UHFFFAOYSA-N 50354732 CHEMBL1834069 Cholinesterase 23800 ChEMBL 10.1016/j.bmcl.2011.07.091 10.7270/Q2C829P7 21873056 Mohamed, T; Yeung, JC; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50354732 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50354732&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56682198 136361418 CHEMBL1834069 ZINC72141083 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50664200 CC1CCN(CC1)c1nccc(NC(c2ccccc2)c2ccccc2)n1 InChI=1S/C23H26N4/c1-18-13-16-27(17-14-18)23-24-15-12-21(26-23)25-22(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-12,15,18,22H,13-14,16-17H2,1H3,(H,24,25,26) MPKJUPMKOWVRJN-UHFFFAOYSA-N 50354733 CHEMBL1834070 Cholinesterase 33800 ChEMBL 10.1016/j.bmcl.2011.07.091 10.7270/Q2C829P7 21873056 Mohamed, T; Yeung, JC; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50354733 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50354733&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56658286 136361419 CHEMBL1834070 ZINC72123235 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50664201 CC(C)N1CCN(CC1)c1nccc(NC(c2ccccc2)c2ccccc2)n1 InChI=1S/C24H29N5/c1-19(2)28-15-17-29(18-16-28)24-25-14-13-22(27-24)26-23(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-14,19,23H,15-18H2,1-2H3,(H,25,26,27) LEAAVIRMAKBSFE-UHFFFAOYSA-N 50354734 CHEMBL1834071 Cholinesterase 9700 ChEMBL 10.1016/j.bmcl.2011.07.091 10.7270/Q2C829P7 21873056 Mohamed, T; Yeung, JC; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50354734 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50354734&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56661788 136361420 CHEMBL1834071 ZINC72122708 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50664202 CC(C)C1CCN(CC1)c1nccc(NC(c2ccccc2)c2ccccc2)n1 InChI=1S/C25H30N4/c1-19(2)20-14-17-29(18-15-20)25-26-16-13-23(28-25)27-24(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h3-13,16,19-20,24H,14-15,17-18H2,1-2H3,(H,26,27,28) CVQHIOMRMRSNJG-UHFFFAOYSA-N 50354735 CHEMBL1834072 Cholinesterase 87000 ChEMBL 10.1016/j.bmcl.2011.07.091 10.7270/Q2C829P7 21873056 Mohamed, T; Yeung, JC; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50354735 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50354735&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56665231 136361421 CHEMBL1834072 ZINC72122709 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50664203 CCCN1CCN(CC1)c1nccc(NC(c2ccccc2)c2ccccc2)n1 InChI=1S/C24H29N5/c1-2-15-28-16-18-29(19-17-28)24-25-14-13-22(27-24)26-23(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-14,23H,2,15-19H2,1H3,(H,25,26,27) DYOASIUUFDKCDY-UHFFFAOYSA-N 50354736 CHEMBL1834073 Cholinesterase 17500 ChEMBL 10.1016/j.bmcl.2011.07.091 10.7270/Q2C829P7 21873056 Mohamed, T; Yeung, JC; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50354736 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50354736&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56672161 136361422 CHEMBL1834073 ZINC72122710 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50664204 C1CCC(CC1)N1CCN(CC1)c1nccc(NC(c2ccccc2)c2ccccc2)n1 InChI=1S/C27H33N5/c1-4-10-22(11-5-1)26(23-12-6-2-7-13-23)29-25-16-17-28-27(30-25)32-20-18-31(19-21-32)24-14-8-3-9-15-24/h1-2,4-7,10-13,16-17,24,26H,3,8-9,14-15,18-21H2,(H,28,29,30) PUBPSPLUBMSJBN-UHFFFAOYSA-N 50354737 CHEMBL1834074 Cholinesterase 7600 ChEMBL 10.1016/j.bmcl.2011.07.091 10.7270/Q2C829P7 21873056 Mohamed, T; Yeung, JC; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50354737 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50354737&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53484186 136361423 CHEMBL1834074 ZINC72124509 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50664205 OCCN1CCN(CC1)c1nccc(NC(c2ccccc2)c2ccccc2)n1 InChI=1S/C23H27N5O/c29-18-17-27-13-15-28(16-14-27)23-24-12-11-21(26-23)25-22(19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-12,22,29H,13-18H2,(H,24,25,26) FZADFPZVKLQJAL-UHFFFAOYSA-N 50354739 CHEMBL1834078 Cholinesterase 59500 ChEMBL 10.1016/j.bmcl.2011.07.091 10.7270/Q2C829P7 21873056 Mohamed, T; Yeung, JC; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50354739 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50354739&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56668689 136361425 CHEMBL1834078 ZINC72125797 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50664207 CC(=O)N1CCN(CC1)c1nccc(NC(c2ccccc2)c2ccccc2)n1 InChI=1S/C23H25N5O/c1-18(29)27-14-16-28(17-15-27)23-24-13-12-21(26-23)25-22(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-13,22H,14-17H2,1H3,(H,24,25,26) CCGCMKRPCWRKHM-UHFFFAOYSA-N 50354738 CHEMBL1834075 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2011.07.091 10.7270/Q2C829P7 21873056 Mohamed, T; Yeung, JC; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50354738 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50354738&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56678882 136361424 CHEMBL1834075 ZINC72139892 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50662043 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 21 ChEMBL 10.1016/j.ejmech.2011.08.002 10.7270/Q20C4W5X 21871694 Tang, H; Zhao, LZ; Zhao, HT; Huang, SL; Zhong, SM; Qin, JK; Chen, ZF; Huang, ZS; Liang, H Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50662044 O=C(CCNCCCCNc1c2CCCCCc2nc2ccccc12)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 InChI=1S/C37H37N5O2/c43-33(41-25-15-16-26-30(23-25)37(44)29-12-8-9-24-17-22-40-36(26)34(24)29)18-21-38-19-6-7-20-39-35-27-10-2-1-3-13-31(27)42-32-14-5-4-11-28(32)35/h4-5,8-9,11-12,14-17,22-23,38H,1-3,6-7,10,13,18-21H2,(H,39,42)(H,41,43) AZJSQHOYALXJEK-UHFFFAOYSA-N 50353679 CHEMBL1830633 Cholinesterase 150 ChEMBL 10.1016/j.ejmech.2011.08.002 10.7270/Q20C4W5X 21871694 Tang, H; Zhao, LZ; Zhao, HT; Huang, SL; Zhong, SM; Qin, JK; Chen, ZF; Huang, ZS; Liang, H Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50353679 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50353679&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56641101 136360365 CHEMBL1830633 ZINC72118965 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50662045 O=C(CCNCCCNc1c2CCCCCc2nc2ccccc12)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 InChI=1S/C36H35N5O2/c42-32(40-24-14-15-25-29(22-24)36(43)28-11-6-8-23-16-21-39-35(25)33(23)28)17-20-37-18-7-19-38-34-26-9-2-1-3-12-30(26)41-31-13-5-4-10-27(31)34/h4-6,8,10-11,13-16,21-22,37H,1-3,7,9,12,17-20H2,(H,38,41)(H,40,42) USRMGDJTJJOPSG-UHFFFAOYSA-N 50353680 CHEMBL1830632 Cholinesterase 21.1 ChEMBL 10.1016/j.ejmech.2011.08.002 10.7270/Q20C4W5X 21871694 Tang, H; Zhao, LZ; Zhao, HT; Huang, SL; Zhong, SM; Qin, JK; Chen, ZF; Huang, ZS; Liang, H Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50353680 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50353680&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56641100 136360366 CHEMBL1830632 ZINC72116740 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50662046 O=C(CCNCCNc1c2CCCCCc2nc2ccccc12)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 InChI=1S/C35H33N5O2/c41-31(39-23-13-14-24-28(21-23)35(42)27-10-6-7-22-15-18-37-34(24)32(22)27)16-17-36-19-20-38-33-25-8-2-1-3-11-29(25)40-30-12-5-4-9-26(30)33/h4-7,9-10,12-15,18,21,36H,1-3,8,11,16-17,19-20H2,(H,38,40)(H,39,41) JIGGUHFOHWJPOA-UHFFFAOYSA-N 50353681 CHEMBL1830631 Cholinesterase 65 ChEMBL 10.1016/j.ejmech.2011.08.002 10.7270/Q20C4W5X 21871694 Tang, H; Zhao, LZ; Zhao, HT; Huang, SL; Zhong, SM; Qin, JK; Chen, ZF; Huang, ZS; Liang, H Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50353681 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50353681&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54753991 136360367 CHEMBL1830631 ZINC72120045 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50662047 O=C(CCNCCCCNc1c2CCCCc2nc2ccccc12)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 InChI=1S/C36H35N5O2/c42-32(40-24-14-15-25-29(22-24)36(43)28-11-7-8-23-16-21-39-35(25)33(23)28)17-20-37-18-5-6-19-38-34-26-9-1-3-12-30(26)41-31-13-4-2-10-27(31)34/h1,3,7-9,11-12,14-16,21-22,37H,2,4-6,10,13,17-20H2,(H,38,41)(H,40,42) YBIZIAOYICQADS-UHFFFAOYSA-N 50353682 CHEMBL1830629 Cholinesterase 288 ChEMBL 10.1016/j.ejmech.2011.08.002 10.7270/Q20C4W5X 21871694 Tang, H; Zhao, LZ; Zhao, HT; Huang, SL; Zhong, SM; Qin, JK; Chen, ZF; Huang, ZS; Liang, H Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50353682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50353682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56640976 136360368 CHEMBL1830629 ZINC72120042 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50662048 O=C(CCNCCCNc1c2CCCCc2nc2ccccc12)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 InChI=1S/C35H33N5O2/c41-31(39-23-13-14-24-28(21-23)35(42)27-10-5-7-22-15-20-38-34(24)32(22)27)16-19-36-17-6-18-37-33-25-8-1-3-11-29(25)40-30-12-4-2-9-26(30)33/h1,3,5,7-8,10-11,13-15,20-21,36H,2,4,6,9,12,16-19H2,(H,37,40)(H,39,41) DJFVILMGABHEQT-UHFFFAOYSA-N 50353683 CHEMBL1830628 Cholinesterase 199 ChEMBL 10.1016/j.ejmech.2011.08.002 10.7270/Q20C4W5X 21871694 Tang, H; Zhao, LZ; Zhao, HT; Huang, SL; Zhong, SM; Qin, JK; Chen, ZF; Huang, ZS; Liang, H Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50353683 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50353683&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54754172 136360369 CHEMBL1830628 ZINC72120041 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50662049 O=C(CCNCCNc1c2CCCCc2nc2ccccc12)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 InChI=1S/C34H31N5O2/c40-30(15-16-35-18-19-37-32-24-7-1-3-10-28(24)39-29-11-4-2-8-25(29)32)38-22-12-13-23-27(20-22)34(41)26-9-5-6-21-14-17-36-33(23)31(21)26/h1,3,5-7,9-10,12-14,17,20,35H,2,4,8,11,15-16,18-19H2,(H,37,39)(H,38,40) ULABGWUYZRTDHX-UHFFFAOYSA-N 50353684 CHEMBL1830627 Cholinesterase 110 ChEMBL 10.1016/j.ejmech.2011.08.002 10.7270/Q20C4W5X 21871694 Tang, H; Zhao, LZ; Zhao, HT; Huang, SL; Zhong, SM; Qin, JK; Chen, ZF; Huang, ZS; Liang, H Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50353684 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50353684&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54753805 136360370 CHEMBL1830627 ZINC72120329 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50662051 O=C(CCNCCCCNc1c2CCCc2nc2ccccc12)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 InChI=1S/C35H33N5O2/c41-31(39-23-13-14-24-28(21-23)35(42)27-10-5-7-22-15-20-38-34(24)32(22)27)16-19-36-17-3-4-18-37-33-25-8-1-2-11-29(25)40-30-12-6-9-26(30)33/h1-2,5,7-8,10-11,13-15,20-21,36H,3-4,6,9,12,16-19H2,(H,37,40)(H,39,41) KTMTUPHTVNDPJJ-UHFFFAOYSA-N 50353686 CHEMBL1830625 Cholinesterase 199 ChEMBL 10.1016/j.ejmech.2011.08.002 10.7270/Q20C4W5X 21871694 Tang, H; Zhao, LZ; Zhao, HT; Huang, SL; Zhong, SM; Qin, JK; Chen, ZF; Huang, ZS; Liang, H Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50353686 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50353686&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56640975 136360372 CHEMBL1830625 ZINC72121432 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50662052 O=C(CCNCCCNc1c2CCCc2nc2ccccc12)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 InChI=1S/C34H31N5O2/c40-30(15-18-35-16-5-17-36-32-24-7-1-2-10-28(24)39-29-11-4-8-25(29)32)38-22-12-13-23-27(20-22)34(41)26-9-3-6-21-14-19-37-33(23)31(21)26/h1-3,6-7,9-10,12-14,19-20,35H,4-5,8,11,15-18H2,(H,36,39)(H,38,40) AWJGEENOHURINO-UHFFFAOYSA-N 50353687 CHEMBL1830624 Cholinesterase 399 ChEMBL 10.1016/j.ejmech.2011.08.002 10.7270/Q20C4W5X 21871694 Tang, H; Zhao, LZ; Zhao, HT; Huang, SL; Zhong, SM; Qin, JK; Chen, ZF; Huang, ZS; Liang, H Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50353687 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50353687&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56640974 136360373 CHEMBL1830624 ZINC72121431 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50662053 O=C(CNCCNc1c2CCCc2nc2ccccc12)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 InChI=1S/C32H27N5O2/c38-28(18-33-15-16-35-30-22-6-1-2-9-26(22)37-27-10-4-7-23(27)30)36-20-11-12-21-25(17-20)32(39)24-8-3-5-19-13-14-34-31(21)29(19)24/h1-3,5-6,8-9,11-14,17,33H,4,7,10,15-16,18H2,(H,35,37)(H,36,38) HCQYXICOBMKIRR-UHFFFAOYSA-N 50353688 CHEMBL1830622 Cholinesterase 243 ChEMBL 10.1016/j.ejmech.2011.08.002 10.7270/Q20C4W5X 21871694 Tang, H; Zhao, LZ; Zhao, HT; Huang, SL; Zhong, SM; Qin, JK; Chen, ZF; Huang, ZS; Liang, H Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50353688 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50353688&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56640972 136360374 CHEMBL1830622 ZINC72119655 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50662054 Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 InChI=1S/C16H10N2O/c17-10-4-5-11-13(8-10)16(19)12-3-1-2-9-6-7-18-15(11)14(9)12/h1-8H,17H2 SWTAISDIUOZWOE-UHFFFAOYSA-N 50211247 9-Amino-1-azabenzanthrone::9-amino-1-aza-benzo[de]anthracen-7-one::9-amino-7H-dibenzo[de,h]quinolin-7-one::CHEMBL246681 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2011.08.002 10.7270/Q20C4W5X 21871694 Tang, H; Zhao, LZ; Zhao, HT; Huang, SL; Zhong, SM; Qin, JK; Chen, ZF; Huang, ZS; Liang, H Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211247 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211247&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44440937 104087482 CHEMBL246681 ZINC28902586 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50662069 O=C(CCNCCNc1c2CCCc2nc2ccccc12)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 InChI=1S/C33H29N5O2/c39-29(14-15-34-17-18-36-31-23-6-1-2-9-27(23)38-28-10-4-7-24(28)31)37-21-11-12-22-26(19-21)33(40)25-8-3-5-20-13-16-35-32(22)30(20)25/h1-3,5-6,8-9,11-13,16,19,34H,4,7,10,14-15,17-18H2,(H,36,38)(H,37,39) UKYNTSAWGXWBFQ-UHFFFAOYSA-N 50353690 CHEMBL1830623 Cholinesterase 1760 ChEMBL 10.1016/j.ejmech.2011.08.002 10.7270/Q20C4W5X 21871694 Tang, H; Zhao, LZ; Zhao, HT; Huang, SL; Zhong, SM; Qin, JK; Chen, ZF; Huang, ZS; Liang, H Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50353690 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50353690&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56640973 136360376 CHEMBL1830623 ZINC72119612 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50662070 O=C(CNCCNc1c2CCCCCc2nc2ccccc12)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 InChI=1S/C34H31N5O2/c40-30(20-35-17-18-37-32-24-8-2-1-3-11-28(24)39-29-12-5-4-9-25(29)32)38-22-13-14-23-27(19-22)34(41)26-10-6-7-21-15-16-36-33(23)31(21)26/h4-7,9-10,12-16,19,35H,1-3,8,11,17-18,20H2,(H,37,39)(H,38,40) LOHRAGBTUWVJJT-UHFFFAOYSA-N 50353689 CHEMBL1830630 Cholinesterase 211 ChEMBL 10.1016/j.ejmech.2011.08.002 10.7270/Q20C4W5X 21871694 Tang, H; Zhao, LZ; Zhao, HT; Huang, SL; Zhong, SM; Qin, JK; Chen, ZF; Huang, ZS; Liang, H Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50353689 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50353689&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54753990 136360375 CHEMBL1830630 ZINC72120044 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50662050 O=C(CNCCNc1c2CCCCc2nc2ccccc12)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 InChI=1S/C33H29N5O2/c39-29(19-34-16-17-36-31-23-7-1-3-10-27(23)38-28-11-4-2-8-24(28)31)37-21-12-13-22-26(18-21)33(40)25-9-5-6-20-14-15-35-32(22)30(20)25/h1,3,5-7,9-10,12-15,18,34H,2,4,8,11,16-17,19H2,(H,36,38)(H,37,39) DIWGQLKDVUAWID-UHFFFAOYSA-N 50353685 CHEMBL1830626 Cholinesterase 433 ChEMBL 10.1016/j.ejmech.2011.08.002 10.7270/Q20C4W5X 21871694 Tang, H; Zhao, LZ; Zhao, HT; Huang, SL; Zhong, SM; Qin, JK; Chen, ZF; Huang, ZS; Liang, H Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50353685 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50353685&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54753804 136360371 CHEMBL1830626 ZINC72121410 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50711435 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 10 ChEMBL 10.1016/j.ejmech.2011.03.003 10.7270/Q2X34XWC 21420206 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Romero, A; del Barrio, L; Martin-de-Saavedra, MD; Egea, J; Leon, R; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50711436 CN1CCN(CCC(=O)NN2c3ccccc3Sc3cc(ccc23)[N+]([O-])=O)CC1 InChI=1S/C20H23N5O3S/c1-22-10-12-23(13-11-22)9-8-20(26)21-24-16-4-2-3-5-18(16)29-19-14-15(25(27)28)6-7-17(19)24/h2-7,14H,8-13H2,1H3,(H,21,26) RWHFFGWWHGLRHL-UHFFFAOYSA-N 50361445 CHEMBL1938467 Cholinesterase 1500 ChEMBL 10.1016/j.ejmech.2011.03.003 10.7270/Q2X34XWC 21420206 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Romero, A; del Barrio, L; Martin-de-Saavedra, MD; Egea, J; Leon, R; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50361445 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50361445&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53306061 136965507 CHEMBL1938467 ZINC82157786 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50711437 COc1ccc2N(NC(=O)CCN3CCN(C)CC3)c3ccccc3Sc2c1 InChI=1S/C21H26N4O2S/c1-23-11-13-24(14-12-23)10-9-21(26)22-25-17-5-3-4-6-19(17)28-20-15-16(27-2)7-8-18(20)25/h3-8,15H,9-14H2,1-2H3,(H,22,26) NKDXKDSKOXRNRM-UHFFFAOYSA-N 50361446 CHEMBL1938466 Cholinesterase 2000 ChEMBL 10.1016/j.ejmech.2011.03.003 10.7270/Q2X34XWC 21420206 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Romero, A; del Barrio, L; Martin-de-Saavedra, MD; Egea, J; Leon, R; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50361446 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50361446&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53306060 136965508 CHEMBL1938466 ZINC73142095 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50711438 CN1CCN(CCC(=O)NN2c3ccccc3Sc3cc(Cl)ccc23)CC1 InChI=1S/C20H23ClN4OS/c1-23-10-12-24(13-11-23)9-8-20(26)22-25-16-4-2-3-5-18(16)27-19-14-15(21)6-7-17(19)25/h2-7,14H,8-13H2,1H3,(H,22,26) LDTUHBBEUPFGII-UHFFFAOYSA-N 50361447 CHEMBL1938397 Cholinesterase 900 ChEMBL 10.1016/j.ejmech.2011.03.003 10.7270/Q2X34XWC 21420206 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Romero, A; del Barrio, L; Martin-de-Saavedra, MD; Egea, J; Leon, R; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50361447 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50361447&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53306059 136965509 CHEMBL1938397 ZINC73161112 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50711439 CN1CCN(CCC(=O)NN2c3ccccc3Sc3ccccc23)CC1 InChI=1S/C20H24N4OS/c1-22-12-14-23(15-13-22)11-10-20(25)21-24-16-6-2-4-8-18(16)26-19-9-5-3-7-17(19)24/h2-9H,10-15H2,1H3,(H,21,25) CIVPMIGRKOYJCI-UHFFFAOYSA-N 50361448 CHEMBL1938465 Cholinesterase 1300 ChEMBL 10.1016/j.ejmech.2011.03.003 10.7270/Q2X34XWC 21420206 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Romero, A; del Barrio, L; Martin-de-Saavedra, MD; Egea, J; Leon, R; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50361448 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50361448&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53306058 136965510 CHEMBL1938465 ZINC73161109 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50711440 COc1ccc2N(NC(=O)CCN3CCCC3)c3ccccc3Sc2c1 InChI=1S/C20H23N3O2S/c1-25-15-8-9-17-19(14-15)26-18-7-3-2-6-16(18)23(17)21-20(24)10-13-22-11-4-5-12-22/h2-3,6-9,14H,4-5,10-13H2,1H3,(H,21,24) QWXWNGLHZBXGGK-UHFFFAOYSA-N 50361449 CHEMBL1938464 Cholinesterase 800 ChEMBL 10.1016/j.ejmech.2011.03.003 10.7270/Q2X34XWC 21420206 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Romero, A; del Barrio, L; Martin-de-Saavedra, MD; Egea, J; Leon, R; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50361449 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50361449&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44555769 136965511 CHEMBL1938464 ZINC68196770 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50711441 Clc1ccc2N(NC(=O)CCN3CCCC3)c3ccccc3Sc2c1 InChI=1S/C19H20ClN3OS/c20-14-7-8-16-18(13-14)25-17-6-2-1-5-15(17)23(16)21-19(24)9-12-22-10-3-4-11-22/h1-2,5-8,13H,3-4,9-12H2,(H,21,24) KRKONNGCDXPUEO-UHFFFAOYSA-N 50361450 CHEMBL1938463 Cholinesterase 3000 ChEMBL 10.1016/j.ejmech.2011.03.003 10.7270/Q2X34XWC 21420206 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Romero, A; del Barrio, L; Martin-de-Saavedra, MD; Egea, J; Leon, R; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50361450 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50361450&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44555768 136965512 CHEMBL1938463 ZINC73222313 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50711442 O=C(CCN1CCCC1)NN1c2ccccc2Sc2ccccc12 InChI=1S/C19H21N3OS/c23-19(11-14-21-12-5-6-13-21)20-22-15-7-1-3-9-17(15)24-18-10-4-2-8-16(18)22/h1-4,7-10H,5-6,11-14H2,(H,20,23) WNKODICAVUIHQQ-UHFFFAOYSA-N 50361451 CHEMBL1938462 Cholinesterase 1400 ChEMBL 10.1016/j.ejmech.2011.03.003 10.7270/Q2X34XWC 21420206 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Romero, A; del Barrio, L; Martin-de-Saavedra, MD; Egea, J; Leon, R; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50361451 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50361451&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44555767 136965513 CHEMBL1938462 ZINC73161097 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50711443 CC(=O)NN1c2ccccc2Sc2cc(Cl)ccc12 InChI=1S/C14H11ClN2OS/c1-9(18)16-17-11-4-2-3-5-13(11)19-14-8-10(15)6-7-12(14)17/h2-8H,1H3,(H,16,18) JSGWOFUTVMOIQZ-UHFFFAOYSA-N 50361452 CHEMBL1938461 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2011.03.003 10.7270/Q2X34XWC 21420206 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Romero, A; del Barrio, L; Martin-de-Saavedra, MD; Egea, J; Leon, R; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50361452 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50361452&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12466699 136965514 CHEMBL1938461 ZINC39233814 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50711444 Clc1ccc2N(NC(=O)CN3CCCC3)c3ccccc3Sc2c1 InChI=1S/C18H18ClN3OS/c19-13-7-8-15-17(11-13)24-16-6-2-1-5-14(16)22(15)20-18(23)12-21-9-3-4-10-21/h1-2,5-8,11H,3-4,9-10,12H2,(H,20,23) LLYYMSFSWPNTPP-UHFFFAOYSA-N 50361453 CHEMBL1938460 Cholinesterase 1000 ChEMBL 10.1016/j.ejmech.2011.03.003 10.7270/Q2X34XWC 21420206 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Romero, A; del Barrio, L; Martin-de-Saavedra, MD; Egea, J; Leon, R; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50361453 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50361453&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12445970 136965515 CHEMBL1938460 ZINC73161095 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50711445 Clc1ccc2Sc3ccccc3N(NC(=O)CN3CCCC3)c2c1 InChI=1S/C18H18ClN3OS/c19-13-7-8-17-15(11-13)22(14-5-1-2-6-16(14)24-17)20-18(23)12-21-9-3-4-10-21/h1-2,5-8,11H,3-4,9-10,12H2,(H,20,23) WAIVAUWOHYEOFD-UHFFFAOYSA-N 50361454 CHEMBL1938459 Cholinesterase 4300 ChEMBL 10.1016/j.ejmech.2011.03.003 10.7270/Q2X34XWC 21420206 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Romero, A; del Barrio, L; Martin-de-Saavedra, MD; Egea, J; Leon, R; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50361454 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50361454&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12445974 136965516 CHEMBL1938459 ZINC73163725 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50711446 O=C(CN1CCCC1)NN1c2ccccc2Sc2ccccc12 InChI=1S/C18H19N3OS/c22-18(13-20-11-5-6-12-20)19-21-14-7-1-3-9-16(14)23-17-10-4-2-8-15(17)21/h1-4,7-10H,5-6,11-13H2,(H,19,22) NUEOXSIDDNCRSA-UHFFFAOYSA-N 50361455 CHEMBL1938458 Cholinesterase 800 ChEMBL 10.1016/j.ejmech.2011.03.003 10.7270/Q2X34XWC 21420206 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Romero, A; del Barrio, L; Martin-de-Saavedra, MD; Egea, J; Leon, R; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50361455 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50361455&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12445966 136965517 CHEMBL1938458 ZINC73163722 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50711447 Clc1ccc2N(NC(=O)CN3CCCCC3)c3ccccc3Sc2c1 InChI=1S/C19H20ClN3OS/c20-14-8-9-16-18(12-14)25-17-7-3-2-6-15(17)23(16)21-19(24)13-22-10-4-1-5-11-22/h2-3,6-9,12H,1,4-5,10-11,13H2,(H,21,24) WKYMGPHLAUGKGR-UHFFFAOYSA-N 50361456 CHEMBL1938457 Cholinesterase 700 ChEMBL 10.1016/j.ejmech.2011.03.003 10.7270/Q2X34XWC 21420206 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Romero, A; del Barrio, L; Martin-de-Saavedra, MD; Egea, J; Leon, R; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50361456 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50361456&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12445971 136965518 CHEMBL1938457 ZINC73163719 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50711448 Clc1ccc2Sc3ccccc3N(NC(=O)CN3CCCCC3)c2c1 InChI=1S/C19H20ClN3OS/c20-14-8-9-18-16(12-14)23(15-6-2-3-7-17(15)25-18)21-19(24)13-22-10-4-1-5-11-22/h2-3,6-9,12H,1,4-5,10-11,13H2,(H,21,24) JQQPIOIJGXIPLF-UHFFFAOYSA-N 50361457 CHEMBL1938456 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2011.03.003 10.7270/Q2X34XWC 21420206 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Romero, A; del Barrio, L; Martin-de-Saavedra, MD; Egea, J; Leon, R; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50361457 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50361457&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12445975 136965519 CHEMBL1938456 ZINC73163716 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50711449 Clc1cccc2Sc3ccccc3N(NC(=O)CN3CCCCC3)c12 InChI=1S/C19H20ClN3OS/c20-14-7-6-10-17-19(14)23(15-8-2-3-9-16(15)25-17)21-18(24)13-22-11-4-1-5-12-22/h2-3,6-10H,1,4-5,11-13H2,(H,21,24) KBZSFWLURQFJSH-UHFFFAOYSA-N 50361458 CHEMBL1938455 Cholinesterase 2200 ChEMBL 10.1016/j.ejmech.2011.03.003 10.7270/Q2X34XWC 21420206 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Romero, A; del Barrio, L; Martin-de-Saavedra, MD; Egea, J; Leon, R; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50361458 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50361458&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44555640 136965520 CHEMBL1938455 ZINC73163713 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50711450 O=C(CN1CCCCC1)NN1c2ccccc2Sc2ccccc12 InChI=1S/C19H21N3OS/c23-19(14-21-12-6-1-7-13-21)20-22-15-8-2-4-10-17(15)24-18-11-5-3-9-16(18)22/h2-5,8-11H,1,6-7,12-14H2,(H,20,23) ALVVXSSFOOYRDP-UHFFFAOYSA-N 50361459 CHEMBL1938454 Cholinesterase 400 ChEMBL 10.1016/j.ejmech.2011.03.003 10.7270/Q2X34XWC 21420206 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Romero, A; del Barrio, L; Martin-de-Saavedra, MD; Egea, J; Leon, R; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50361459 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50361459&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search XOC 5AAN 12445967 136965521 CHEMBL1938454 ZINC73195989 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50711451 CN(C)CC(=O)NN1c2ccccc2Sc2cc(Cl)ccc12 InChI=1S/C16H16ClN3OS/c1-19(2)10-16(21)18-20-12-5-3-4-6-14(12)22-15-9-11(17)7-8-13(15)20/h3-9H,10H2,1-2H3,(H,18,21) BZPJQAGUAPIWBK-UHFFFAOYSA-N 50361460 CHEMBL1938453 Cholinesterase 5000 ChEMBL 10.1016/j.ejmech.2011.03.003 10.7270/Q2X34XWC 21420206 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Romero, A; del Barrio, L; Martin-de-Saavedra, MD; Egea, J; Leon, R; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50361460 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50361460&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12445968 136965522 CHEMBL1938453 ZINC68196775 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50711452 CN(C)CC(=O)NN1c2ccccc2Sc2ccc(Cl)cc12 InChI=1S/C16H16ClN3OS/c1-19(2)10-16(21)18-20-12-5-3-4-6-14(12)22-15-8-7-11(17)9-13(15)20/h3-9H,10H2,1-2H3,(H,18,21) QZEILJFOMBSNNN-UHFFFAOYSA-N 50361461 CHEMBL1938452 Cholinesterase 7100 ChEMBL 10.1016/j.ejmech.2011.03.003 10.7270/Q2X34XWC 21420206 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Romero, A; del Barrio, L; Martin-de-Saavedra, MD; Egea, J; Leon, R; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50361461 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50361461&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12445972 136965523 CHEMBL1938452 ZINC73195988 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50711453 CN(C)CC(=O)NN1c2ccccc2Sc2ccccc12 InChI=1S/C16H17N3OS/c1-18(2)11-16(20)17-19-12-7-3-5-9-14(12)21-15-10-6-4-8-13(15)19/h3-10H,11H2,1-2H3,(H,17,20) GEHFMOURDWWNQT-UHFFFAOYSA-N 50361462 CHEMBL1938451 Cholinesterase 1700 ChEMBL 10.1016/j.ejmech.2011.03.003 10.7270/Q2X34XWC 21420206 Gonzalez-Munoz, GC; Arce, MP; Lopez, B; Perez, C; Romero, A; del Barrio, L; Martin-de-Saavedra, MD; Egea, J; Leon, R; Villarroya, M; Lopez, MG; Garcia, AG; Conde, S; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50361462 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50361462&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12445964 136965524 CHEMBL1938451 ZINC68196769 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50704249 CP(=O)(OCC#C)OC(C(F)(F)F)C(F)(F)F InChI=1S/C7H7F6O3P/c1-3-4-15-17(2,14)16-5(6(8,9)10)7(11,12)13/h1,5H,4H2,2H3 XOWVPELMLPDDSD-UHFFFAOYSA-N 50358311 CHEMBL1922540 Cholinesterase 249000 ChEMBL 10.1016/j.bmcl.2011.09.030 10.7270/Q2W66M65 22001085 Sokolova, NV; Nenajdenko, VG; Sokolov, VB; Serebryakova, OG; Makhaeva, GF Moscow State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358311 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358311&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57398511 136962335 CHEMBL1922540 ZINC73196143 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50704250 COC(=O)C(OP(C)(=O)OCC#C)C(F)(F)F InChI=1S/C8H10F3O5P/c1-4-5-15-17(3,13)16-6(7(12)14-2)8(9,10)11/h1,6H,5H2,2-3H3 OEFVRNNHTUIANX-UHFFFAOYSA-N 50358312 CHEMBL1922541 Cholinesterase 28900 ChEMBL 10.1016/j.bmcl.2011.09.030 10.7270/Q2W66M65 22001085 Sokolova, NV; Nenajdenko, VG; Sokolov, VB; Serebryakova, OG; Makhaeva, GF Moscow State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358312 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358312&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57391511 136962336 CHEMBL1922541 ZINC73402732 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50704251 CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N(Cc1ccc(OC)cc1OC)C(C)(C)C(=O)N[C@@H](C)Cn1cc(COP(C)(=O)OC(C(F)(F)F)C(F)(F)F)nn1 InChI=1S/C34H51F6N6O9P/c1-12-20(2)26(42-30(49)54-31(4,5)6)27(47)46(17-22-13-14-24(51-9)15-25(22)52-10)32(7,8)29(48)41-21(3)16-45-18-23(43-44-45)19-53-56(11,50)55-28(33(35,36)37)34(38,39)40/h13-15,18,20-21,26,28H,12,16-17,19H2,1-11H3,(H,41,48)(H,42,49)/t20-,21-,26-,56?/m0/s1 WPKAPUMSJALCTL-CPDMDARBSA-N 50358313 CHEMBL1922542 Cholinesterase 777000 ChEMBL 10.1016/j.bmcl.2011.09.030 10.7270/Q2W66M65 22001085 Sokolova, NV; Nenajdenko, VG; Sokolov, VB; Serebryakova, OG; Makhaeva, GF Moscow State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358313 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358313&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57403730 136962337 CHEMBL1922542 ZINC95548812 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50704252 CC(C)[C@@H](Cn1cc(COP(C)(=O)OC(C(F)(F)F)C(F)(F)F)nn1)NC(=O)CN(Cc1ccccc1)C(=O)[C@H](C)NC(=O)OC(C)(C)C InChI=1S/C29H41F6N6O7P/c1-18(2)22(15-41-14-21(38-39-41)17-46-49(7,45)48-25(28(30,31)32)29(33,34)35)37-23(42)16-40(13-20-11-9-8-10-12-20)24(43)19(3)36-26(44)47-27(4,5)6/h8-12,14,18-19,22,25H,13,15-17H2,1-7H3,(H,36,44)(H,37,42)/t19-,22+,49?/m0/s1 ICGNNDDOMOCEER-OZBRRETESA-N 50358314 CHEMBL1922543 Cholinesterase 595000 ChEMBL 10.1016/j.bmcl.2011.09.030 10.7270/Q2W66M65 22001085 Sokolova, NV; Nenajdenko, VG; Sokolov, VB; Serebryakova, OG; Makhaeva, GF Moscow State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358314 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358314&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57396739 136962338 CHEMBL1922543 ZINC84538168 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50704253 CC[C@H](C)[C@@H](Cn1cc(COP(C)(=O)OC(C(F)(F)F)C(F)(F)F)nn1)NC(=O)CN(Cc1ccccc1)C(=O)C(F)(F)F InChI=1S/C24H29F9N5O5P/c1-4-15(2)18(34-19(39)13-37(21(40)24(31,32)33)10-16-8-6-5-7-9-16)12-38-11-17(35-36-38)14-42-44(3,41)43-20(22(25,26)27)23(28,29)30/h5-9,11,15,18,20H,4,10,12-14H2,1-3H3,(H,34,39)/t15-,18+,44?/m0/s1 YYBRERXSACXEOV-CHLCYDMMSA-N 50358315 CHEMBL1922544 Cholinesterase 702000 ChEMBL 10.1016/j.bmcl.2011.09.030 10.7270/Q2W66M65 22001085 Sokolova, NV; Nenajdenko, VG; Sokolov, VB; Serebryakova, OG; Makhaeva, GF Moscow State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358315 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358315&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54765022 136962339 CHEMBL1922544 ZINC82139956 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50704254 CC(C)(N(Cc1ccccc1)C(=O)C(F)(F)F)C(=O)NCCn1cc(COP(C)(=O)OC(C(F)(F)F)C(F)(F)F)nn1 InChI=1S/C22H25F9N5O5P/c1-19(2,36(18(38)22(29,30)31)11-14-7-5-4-6-8-14)17(37)32-9-10-35-12-15(33-34-35)13-40-42(3,39)41-16(20(23,24)25)21(26,27)28/h4-8,12,16H,9-11,13H2,1-3H3,(H,32,37) KQTWYZXYJKACLX-UHFFFAOYSA-N 50358316 CHEMBL1922545 Cholinesterase 746000 ChEMBL 10.1016/j.bmcl.2011.09.030 10.7270/Q2W66M65 22001085 Sokolova, NV; Nenajdenko, VG; Sokolov, VB; Serebryakova, OG; Makhaeva, GF Moscow State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358316 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358316&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57403731 136962340 CHEMBL1922545 ZINC82138021 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50704255 C[C@@H](Cn1cc(COP(C)(=O)OC(C(F)(F)F)C(F)(F)F)nn1)NC(=O)CN(Cc1ccccc1)C(=O)C(F)(F)F InChI=1S/C21H23F9N5O5P/c1-13(31-16(36)11-34(18(37)21(28,29)30)9-14-6-4-3-5-7-14)8-35-10-15(32-33-35)12-39-41(2,38)40-17(19(22,23)24)20(25,26)27/h3-7,10,13,17H,8-9,11-12H2,1-2H3,(H,31,36)/t13-,41?/m0/s1 XPYUZYGRFPDQCC-VSNIYNPYSA-N 50358317 CHEMBL1922546 Cholinesterase 218000 ChEMBL 10.1016/j.bmcl.2011.09.030 10.7270/Q2W66M65 22001085 Sokolova, NV; Nenajdenko, VG; Sokolov, VB; Serebryakova, OG; Makhaeva, GF Moscow State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358317 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358317&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57401976 136962341 CHEMBL1922546 ZINC82138023 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50704256 CC(C)[C@@H](Cn1cc(COP(C)(=O)OC(C(F)(F)F)C(F)(F)F)nn1)NC(=O)CN(Cc1ccccc1)C(=O)C(F)(F)F InChI=1S/C23H27F9N5O5P/c1-14(2)17(33-18(38)12-36(20(39)23(30,31)32)9-15-7-5-4-6-8-15)11-37-10-16(34-35-37)13-41-43(3,40)42-19(21(24,25)26)22(27,28)29/h4-8,10,14,17,19H,9,11-13H2,1-3H3,(H,33,38)/t17-,43?/m1/s1 XZIMOFSJXSRBSW-ZAUMCVORSA-N 50358318 CHEMBL1922547 Cholinesterase 1100000 ChEMBL 10.1016/j.bmcl.2011.09.030 10.7270/Q2W66M65 22001085 Sokolova, NV; Nenajdenko, VG; Sokolov, VB; Serebryakova, OG; Makhaeva, GF Moscow State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358318 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358318&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57396740 136962342 CHEMBL1922547 ZINC82138025 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50704257 COC(=O)C(OP(C)(=O)OCc1cn(C[C@@H](NC(=O)CN(Cc2ccccc2)C(=O)C(F)(F)F)C(C)C)nn1)C(F)(F)F InChI=1S/C24H30F6N5O7P/c1-15(2)18(31-19(36)13-34(22(38)24(28,29)30)10-16-8-6-5-7-9-16)12-35-11-17(32-33-35)14-41-43(4,39)42-20(21(37)40-3)23(25,26)27/h5-9,11,15,18,20H,10,12-14H2,1-4H3,(H,31,36)/t18-,20?,43?/m1/s1 NKFZFYAEMBRNQW-CPIOVHPHSA-N 50358319 CHEMBL1922548 Cholinesterase 2000000 ChEMBL 10.1016/j.bmcl.2011.09.030 10.7270/Q2W66M65 22001085 Sokolova, NV; Nenajdenko, VG; Sokolov, VB; Serebryakova, OG; Makhaeva, GF Moscow State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358319 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358319&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57391512 136962343 CHEMBL1922548 ZINC82138039 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50704258 COC(=O)C(OP(C)(=O)OCc1cn(C[C@@H](NC(=O)CN(Cc2ccccc2)C(=O)[C@H](C)NC(=O)OC(C)(C)C)C(C)C)nn1)C(F)(F)F InChI=1S/C30H44F3N6O9P/c1-19(2)23(16-39-15-22(36-37-39)18-46-49(8,44)48-25(27(42)45-7)30(31,32)33)35-24(40)17-38(14-21-12-10-9-11-13-21)26(41)20(3)34-28(43)47-29(4,5)6/h9-13,15,19-20,23,25H,14,16-18H2,1-8H3,(H,34,43)(H,35,40)/t20-,23+,25?,49?/m0/s1 COPHSKRKDCTOTE-WOKMSAAMSA-N 50358320 CHEMBL1922549 Cholinesterase 960000 ChEMBL 10.1016/j.bmcl.2011.09.030 10.7270/Q2W66M65 22001085 Sokolova, NV; Nenajdenko, VG; Sokolov, VB; Serebryakova, OG; Makhaeva, GF Moscow State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358320 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358320&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57401977 136962344 CHEMBL1922549 ZINC82138063 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703348 Nc1c2CCCCc2nc2oc(cc12)-c1ccccc1 InChI=1S/C17H16N2O/c18-16-12-8-4-5-9-14(12)19-17-13(16)10-15(20-17)11-6-2-1-3-7-11/h1-3,6-7,10H,4-5,8-9H2,(H2,18,19) KEPWYKBQWJYLMT-UHFFFAOYSA-N 50357941 CHEMBL1916766 Cholinesterase 3600 ChEMBL 10.1016/j.ejmech.2011.09.038 10.7270/Q27M08BS 22000936 Martins, C; Carreiras, MC; Leon, R; de los Rios, C; Bartolini, M; Andrisano, V; Iriepa, I; Moraleda, I; Galvez, E; Garcia, M; Egea, J; Samadi, A; Chioua, M; Marco-Contelles, J University of Lisbon http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50357941 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50357941&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56933910 136961965 CHEMBL1916766 ZINC73196459 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703349 Nc1c2CCCCCc2nc2oc(cc12)-c1ccccc1 InChI=1S/C18H18N2O/c19-17-13-9-5-2-6-10-15(13)20-18-14(17)11-16(21-18)12-7-3-1-4-8-12/h1,3-4,7-8,11H,2,5-6,9-10H2,(H2,19,20) OQGBUSPYXSZWQT-UHFFFAOYSA-N 50357942 CHEMBL1916767 Cholinesterase 6000 ChEMBL 10.1016/j.ejmech.2011.09.038 10.7270/Q27M08BS 22000936 Martins, C; Carreiras, MC; Leon, R; de los Rios, C; Bartolini, M; Andrisano, V; Iriepa, I; Moraleda, I; Galvez, E; Garcia, M; Egea, J; Samadi, A; Chioua, M; Marco-Contelles, J University of Lisbon http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50357942 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50357942&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56933911 136961966 CHEMBL1916767 ZINC73196664 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703350 Nc1c2CCCCc2nc2n(c(cc12)-c1ccccc1)-c1ccccc1 InChI=1S/C23H21N3/c24-22-18-13-7-8-14-20(18)25-23-19(22)15-21(16-9-3-1-4-10-16)26(23)17-11-5-2-6-12-17/h1-6,9-12,15H,7-8,13-14H2,(H2,24,25) VRGOOLXPHWCIIA-UHFFFAOYSA-N 50357943 CHEMBL1916768 Cholinesterase 74 ChEMBL 10.1016/j.ejmech.2011.09.038 10.7270/Q27M08BS 22000936 Martins, C; Carreiras, MC; Leon, R; de los Rios, C; Bartolini, M; Andrisano, V; Iriepa, I; Moraleda, I; Galvez, E; Garcia, M; Egea, J; Samadi, A; Chioua, M; Marco-Contelles, J University of Lisbon http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50357943 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50357943&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56649564 136961967 CHEMBL1916768 ZINC73196665 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703351 Nc1c2CCCCCc2nc2n(c(cc12)-c1ccccc1)-c1ccccc1 InChI=1S/C24H23N3/c25-23-19-14-8-3-9-15-21(19)26-24-20(23)16-22(17-10-4-1-5-11-17)27(24)18-12-6-2-7-13-18/h1-2,4-7,10-13,16H,3,8-9,14-15H2,(H2,25,26) SAQGSFDAUDUZBY-UHFFFAOYSA-N 50357944 CHEMBL1916769 Cholinesterase 1100 ChEMBL 10.1016/j.ejmech.2011.09.038 10.7270/Q27M08BS 22000936 Martins, C; Carreiras, MC; Leon, R; de los Rios, C; Bartolini, M; Andrisano, V; Iriepa, I; Moraleda, I; Galvez, E; Garcia, M; Egea, J; Samadi, A; Chioua, M; Marco-Contelles, J University of Lisbon http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50357944 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50357944&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56934198 136961968 CHEMBL1916769 ZINC73199249 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703352 Cc1ccc(cc1)-c1cc2c(N)c3CCCCc3nc2o1 InChI=1S/C18H18N2O/c1-11-6-8-12(9-7-11)16-10-14-17(19)13-4-2-3-5-15(13)20-18(14)21-16/h6-10H,2-5H2,1H3,(H2,19,20) WBYXOCICGJQRPO-UHFFFAOYSA-N 50357945 CHEMBL1916770 Cholinesterase 2900 ChEMBL 10.1016/j.ejmech.2011.09.038 10.7270/Q27M08BS 22000936 Martins, C; Carreiras, MC; Leon, R; de los Rios, C; Bartolini, M; Andrisano, V; Iriepa, I; Moraleda, I; Galvez, E; Garcia, M; Egea, J; Samadi, A; Chioua, M; Marco-Contelles, J University of Lisbon http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50357945 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50357945&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56933912 136961969 CHEMBL1916770 ZINC73199251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703353 Cc1ccc(cc1)-c1cc2c(N)c3CCCCCc3nc2o1 InChI=1S/C19H20N2O/c1-12-7-9-13(10-8-12)17-11-15-18(20)14-5-3-2-4-6-16(14)21-19(15)22-17/h7-11H,2-6H2,1H3,(H2,20,21) OQWWJWLANXKPCC-UHFFFAOYSA-N 50357946 CHEMBL1916926 Cholinesterase 13000 ChEMBL 10.1016/j.ejmech.2011.09.038 10.7270/Q27M08BS 22000936 Martins, C; Carreiras, MC; Leon, R; de los Rios, C; Bartolini, M; Andrisano, V; Iriepa, I; Moraleda, I; Galvez, E; Garcia, M; Egea, J; Samadi, A; Chioua, M; Marco-Contelles, J University of Lisbon http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50357946 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50357946&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56934050 136961970 CHEMBL1916926 ZINC73160937 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703354 Nc1c2CCCCc2nc2oc(cc12)-c1ccc(Cl)cc1 InChI=1S/C17H15ClN2O/c18-11-7-5-10(6-8-11)15-9-13-16(19)12-3-1-2-4-14(12)20-17(13)21-15/h5-9H,1-4H2,(H2,19,20) RWPNPBZHXLMADD-UHFFFAOYSA-N 50357947 CHEMBL1916927 Cholinesterase 23000 ChEMBL 10.1016/j.ejmech.2011.09.038 10.7270/Q27M08BS 22000936 Martins, C; Carreiras, MC; Leon, R; de los Rios, C; Bartolini, M; Andrisano, V; Iriepa, I; Moraleda, I; Galvez, E; Garcia, M; Egea, J; Samadi, A; Chioua, M; Marco-Contelles, J University of Lisbon http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50357947 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50357947&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56934051 136961971 CHEMBL1916927 ZINC73160939 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703355 Nc1c2CCCCCc2nc2oc(cc12)-c1ccc(Cl)cc1 InChI=1S/C18H17ClN2O/c19-12-8-6-11(7-9-12)16-10-14-17(20)13-4-2-1-3-5-15(13)21-18(14)22-16/h6-10H,1-5H2,(H2,20,21) UFUWYVATVCSJEP-UHFFFAOYSA-N 50357948 CHEMBL1916928 Cholinesterase 43000 ChEMBL 10.1016/j.ejmech.2011.09.038 10.7270/Q27M08BS 22000936 Martins, C; Carreiras, MC; Leon, R; de los Rios, C; Bartolini, M; Andrisano, V; Iriepa, I; Moraleda, I; Galvez, E; Garcia, M; Egea, J; Samadi, A; Chioua, M; Marco-Contelles, J University of Lisbon http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50357948 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50357948&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56934052 136961972 CHEMBL1916928 ZINC73196089 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703356 Nc1c2CCCCc2nc2oc(c(C#N)c12)-c1ccc(Cl)cc1 InChI=1S/C18H14ClN3O/c19-11-7-5-10(6-8-11)17-13(9-20)15-16(21)12-3-1-2-4-14(12)22-18(15)23-17/h5-8H,1-4H2,(H2,21,22) UOYVNQPKSGWCET-UHFFFAOYSA-N 50357949 CHEMBL1916929 Cholinesterase 32400 ChEMBL 10.1016/j.ejmech.2011.09.038 10.7270/Q27M08BS 22000936 Martins, C; Carreiras, MC; Leon, R; de los Rios, C; Bartolini, M; Andrisano, V; Iriepa, I; Moraleda, I; Galvez, E; Garcia, M; Egea, J; Samadi, A; Chioua, M; Marco-Contelles, J University of Lisbon http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50357949 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50357949&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56934056 136961973 CHEMBL1916929 ZINC73168250 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703357 Nc1c2CCCCc2nc2n(c(cc12)-c1ccc(Cl)cc1)-c1ccccc1 InChI=1S/C23H20ClN3/c24-16-12-10-15(11-13-16)21-14-19-22(25)18-8-4-5-9-20(18)26-23(19)27(21)17-6-2-1-3-7-17/h1-3,6-7,10-14H,4-5,8-9H2,(H2,25,26) IXVKGSLDYZAHMJ-UHFFFAOYSA-N 50357950 CHEMBL1916930 Cholinesterase 15000 ChEMBL 10.1016/j.ejmech.2011.09.038 10.7270/Q27M08BS 22000936 Martins, C; Carreiras, MC; Leon, R; de los Rios, C; Bartolini, M; Andrisano, V; Iriepa, I; Moraleda, I; Galvez, E; Garcia, M; Egea, J; Samadi, A; Chioua, M; Marco-Contelles, J University of Lisbon http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50357950 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50357950&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56934199 136961974 CHEMBL1916930 ZINC73168252 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703358 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 5.2 ChEMBL 10.1016/j.ejmech.2011.09.038 10.7270/Q27M08BS 22000936 Martins, C; Carreiras, MC; Leon, R; de los Rios, C; Bartolini, M; Andrisano, V; Iriepa, I; Moraleda, I; Galvez, E; Garcia, M; Egea, J; Samadi, A; Chioua, M; Marco-Contelles, J University of Lisbon http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703621 COc1ccc2cc3-c4cc5OCOc5cc4CCn3cc2\c1=[NH+]\CCCN(C)C InChI=1S/C24H27N3O3/c1-26(2)9-4-8-25-24-19-14-27-10-7-17-12-22-23(30-15-29-22)13-18(17)20(27)11-16(19)5-6-21(24)28-3/h5-6,11-14H,4,7-10,15H2,1-3H3/p+1/b25-24- MCTLRZKRNHQSQB-IZHYLOQSSA-O 50358079 CHEMBL539374 Cholinesterase 6323 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358079 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358079&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 25069762 136962103 CHEMBL539374 ZINC40976487 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703622 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OC InChI=1S/C20H18NO4/c1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2/h3-4,7-10H,5-6,11H2,1-2H3/q+1 YBHILYKTIRIUTE-UHFFFAOYSA-N 50203126 3,4-dimethoxy-6,7-dihydro-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinolin-5-ylium::9,10-Dimethoxy-5,6-dihydro-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ylium::9,10-Dimethoxy-5,6-dihydro-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ylium chloride::9,10-dimethoxy-5,6-dihydro-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ylium; chloride::BERBERINE::Berberinechloride::CHEMBL12089::berberine dimer::cid_12456 Cholinesterase 18200 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50203126 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50203126&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search BER 7A3Y,1JUM,6JWD,3R6R,3VW2,4DBK,3BTI,7MSV,7X8M,3NP6,3D6Y,7X32,5Y0V,2QVD,7C34,7N7D,7N7E 12456 104082463 16118 CHEMBL12089 DB04115 C00757 ZINC03779067 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703623 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 41 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703644 COc1ccc2cc3-c4cc5OCOc5cc4CCn3cc2\c1=[NH+]\CCOc1ccccc1 InChI=1S/C27H24N2O4/c1-30-24-8-7-18-13-23-21-15-26-25(32-17-33-26)14-19(21)9-11-29(23)16-22(18)27(24)28-10-12-31-20-5-3-2-4-6-20/h2-8,13-16H,9-12,17H2,1H3/p+1/b28-27- CQZHFCBDTXVFQL-DQSJHHFOSA-O 50358073 CHEMBL1915190 Cholinesterase 727 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358073 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358073&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56935340 136962097 CHEMBL1915190 ZINC73196013 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703645 COc1ccc2cc3-c4cc5OCOc5cc4CCn3cc2\c1=[NH+]\CCCOc1ccccc1 InChI=1S/C28H26N2O4/c1-31-25-9-8-19-14-24-22-16-27-26(33-18-34-27)15-20(22)10-12-30(24)17-23(19)28(25)29-11-5-13-32-21-6-3-2-4-7-21/h2-4,6-9,14-17H,5,10-13,18H2,1H3/p+1/b29-28- DGAFJUHJQSFWIQ-ZIADKAODSA-O 50358074 CHEMBL1915191 Cholinesterase 216 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358074 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358074&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56935342 136962098 CHEMBL1915191 ZINC73196014 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703646 COc1ccc2cc3-c4cc5OCOc5cc4CCn3cc2\c1=[NH+]\CCCCOc1ccccc1 InChI=1S/C29H28N2O4/c1-32-26-10-9-20-15-25-23-17-28-27(34-19-35-28)16-21(23)11-13-31(25)18-24(20)29(26)30-12-5-6-14-33-22-7-3-2-4-8-22/h2-4,7-10,15-18H,5-6,11-14,19H2,1H3/p+1/b30-29- VVYPEHKLHKAJMX-FLWNBWAVSA-O 50358075 CHEMBL1915192 Cholinesterase 1201 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358075 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358075&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56935344 136962099 CHEMBL1915192 ZINC73169762 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703647 COc1ccc2cc3-c4cc5OCOc5cc4CCn3cc2\c1=[NH+]\CCCCCOc1ccccc1 InChI=1S/C30H30N2O4/c1-33-27-11-10-21-16-26-24-18-29-28(35-20-36-29)17-22(24)12-14-32(26)19-25(21)30(27)31-13-6-3-7-15-34-23-8-4-2-5-9-23/h2,4-5,8-11,16-19H,3,6-7,12-15,20H2,1H3/p+1/b31-30- RSSKLNMOXVZXSO-KTMFPKCZSA-O 50358076 CHEMBL1915193 Cholinesterase 1556 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358076 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358076&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56935346 136962100 CHEMBL1915193 ZINC73169764 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703648 COc1ccc2cc3-c4cc5OCOc5cc4CCn3cc2\c1=[NH+]\CCCCCCOc1ccccc1 InChI=1S/C31H32N2O4/c1-34-28-12-11-22-17-27-25-19-30-29(36-21-37-30)18-23(25)13-15-33(27)20-26(22)31(28)32-14-7-2-3-8-16-35-24-9-5-4-6-10-24/h4-6,9-12,17-20H,2-3,7-8,13-16,21H2,1H3/p+1/b32-31- ZDKSCWMCFCJDIV-MVJHLKBCSA-O 50358077 CHEMBL1915194 Cholinesterase 1300 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358077 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358077&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56935348 136962101 CHEMBL1915194 ZINC73169767 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703649 COc1ccc2cc3-c4cc5OCOc5cc4CCn3cc2\c1=[NH+]\Cc1ccccc1 InChI=1S/C26H22N2O3/c1-29-23-8-7-18-11-22-20-13-25-24(30-16-31-25)12-19(20)9-10-28(22)15-21(18)26(23)27-14-17-5-3-2-4-6-17/h2-8,11-13,15H,9-10,14,16H2,1H3/p+1/b27-26- XEDNRGSTIPLFLT-RQZHXJHFSA-O 50358078 CHEMBL1915195 Cholinesterase 2282 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358078 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358078&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12275633 136962102 CHEMBL1915195 ZINC73168943 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703650 COc1ccc2cc3-c4cc5OCOc5cc4CCn3cc2\c1=[NH+]\CCc1ccccc1 InChI=1S/C27H24N2O3/c1-30-24-8-7-19-13-23-21-15-26-25(31-17-32-26)14-20(21)10-12-29(23)16-22(19)27(24)28-11-9-18-5-3-2-4-6-18/h2-8,13-16H,9-12,17H2,1H3/p+1/b28-27- IRGVZRZAIBKCNU-DQSJHHFOSA-O 50358081 CHEMBL541672 Cholinesterase 406 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358081 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358081&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 25022426 136962105 CHEMBL541672 ZINC40424722 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703651 COc1ccc2cc3-c4cc5OCOc5cc4CCn3cc2\c1=[NH+]\CCCc1ccccc1 InChI=1S/C28H26N2O3/c1-31-25-10-9-20-14-24-22-16-27-26(32-18-33-27)15-21(22)11-13-30(24)17-23(20)28(25)29-12-5-8-19-6-3-2-4-7-19/h2-4,6-7,9-10,14-17H,5,8,11-13,18H2,1H3/p+1/b29-28- QVPJDIBOBIFSBR-ZIADKAODSA-O 50358082 CHEMBL1915196 Cholinesterase 785 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358082 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358082&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56935470 136962106 CHEMBL1915196 ZINC73142160 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703652 COc1ccc2[nH]cc(CC\[NH+]=c3/c(OC)ccc4cc5-c6cc7OCOc7cc6CCn5cc34)c2c1 InChI=1S/C30H27N3O4/c1-34-21-4-5-25-22(13-21)20(15-32-25)7-9-31-30-24-16-33-10-8-19-12-28-29(37-17-36-28)14-23(19)26(33)11-18(24)3-6-27(30)35-2/h3-6,11-16,32H,7-10,17H2,1-2H3/p+1/b31-30- HDVGLGILCKUTDV-KTMFPKCZSA-O 50358083 CHEMBL1915197 Cholinesterase 1391 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358083 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358083&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56935472 136962107 CHEMBL1915197 ZINC73142162 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703653 COc1ccc2cc3-c4cc5OCOc5cc4CCn3cc2\c1=[NH+]\CCc1cccs1 InChI=1S/C25H22N2O3S/c1-28-22-5-4-16-11-21-19-13-24-23(29-15-30-24)12-17(19)7-9-27(21)14-20(16)25(22)26-8-6-18-3-2-10-31-18/h2-5,10-14H,6-9,15H2,1H3/p+1/b26-25- SCWBZBOPKVMFSD-QPLCGJKRSA-O 50358084 CHEMBL1915198 Cholinesterase 555 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358084 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358084&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56935474 136962108 CHEMBL1915198 ZINC73142165 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703654 COc1ccc2cc3-c4cc5OCOc5cc4CCn3cc2\c1=[NH+]\CCc1ccccn1 InChI=1S/C26H23N3O3/c1-30-23-6-5-17-12-22-20-14-25-24(31-16-32-25)13-18(20)8-11-29(22)15-21(17)26(23)28-10-7-19-4-2-3-9-27-19/h2-6,9,12-15H,7-8,10-11,16H2,1H3/p+1/b28-26- KDAZSEKFBFUCER-SGEDCAFJSA-O 50358085 CHEMBL1915199 Cholinesterase 2495 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358085 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358085&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56935476 136962109 CHEMBL1915199 ZINC73142169 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703655 COc1ccc(CC\[NH+]=c2/c(OC)ccc3cc4-c5cc6OCOc6cc5CCn4cc23)cc1 InChI=1S/C28H26N2O4/c1-31-21-6-3-18(4-7-21)9-11-29-28-23-16-30-12-10-20-14-26-27(34-17-33-26)15-22(20)24(30)13-19(23)5-8-25(28)32-2/h3-8,13-16H,9-12,17H2,1-2H3/p+1/b29-28- QREKFCCCAYRZFJ-ZIADKAODSA-O 50358086 CHEMBL1915200 Cholinesterase 2885 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358086 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358086&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56933487 136962110 CHEMBL1915200 ZINC73142171 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703656 COc1ccc2cc3-c4cc5OCOc5cc4CCn3cc2\c1=[NH+]\CCc1ccc(F)cc1 InChI=1S/C27H23FN2O3/c1-31-24-7-4-18-12-23-21-14-26-25(32-16-33-26)13-19(21)9-11-30(23)15-22(18)27(24)29-10-8-17-2-5-20(28)6-3-17/h2-7,12-15H,8-11,16H2,1H3/p+1/b29-27- FTAXNKBQHSEZFA-OHYPFYFLSA-O 50358087 CHEMBL1915201 Cholinesterase 445 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358087 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358087&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56933489 136962111 CHEMBL1915201 ZINC73157206 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703657 COc1ccc2cc3-c4cc5OCOc5cc4CCn3cc2\c1=[NH+]\CCc1ccc(cc1)[N+]([O-])=O InChI=1S/C27H23N3O5/c1-33-24-7-4-18-12-23-21-14-26-25(34-16-35-26)13-19(21)9-11-29(23)15-22(18)27(24)28-10-8-17-2-5-20(6-3-17)30(31)32/h2-7,12-15H,8-11,16H2,1H3/p+1/b28-27- RNYPFNPXZQOOJY-DQSJHHFOSA-O 50358088 CHEMBL1915202 Cholinesterase 841 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358088 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358088&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56933491 136962112 CHEMBL1915202 ZINC73167426 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703658 COc1ccc2cc3-c4cc5OCOc5cc4CCn3cc2\c1=[NH+]\CCc1ccccc1C InChI=1S/C28H26N2O3/c1-18-5-3-4-6-19(18)9-11-29-28-23-16-30-12-10-21-14-26-27(33-17-32-26)15-22(21)24(30)13-20(23)7-8-25(28)31-2/h3-8,13-16H,9-12,17H2,1-2H3/p+1/b29-28- MEWJVJBNENDBHO-ZIADKAODSA-O 50358089 CHEMBL1915203 Cholinesterase 713 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358089 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358089&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56649536 136962113 CHEMBL1915203 ZINC73167429 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703659 COc1ccc2cc3-c4cc5OCOc5cc4CCn3cc2\c1=[NH+]\CCc1cccc(C)c1 InChI=1S/C28H26N2O3/c1-18-4-3-5-19(12-18)8-10-29-28-23-16-30-11-9-21-14-26-27(33-17-32-26)15-22(21)24(30)13-20(23)6-7-25(28)31-2/h3-7,12-16H,8-11,17H2,1-2H3/p+1/b29-28- DZIXCHQYNSLQFL-ZIADKAODSA-O 50358090 CHEMBL1915204 Cholinesterase 674 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358090 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358090&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56933493 136962114 CHEMBL1915204 ZINC73165068 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703660 COc1ccc2cc3-c4cc5OCOc5cc4CCn3cc2\c1=[NH+]\CCc1ccc(C)cc1 InChI=1S/C28H26N2O3/c1-18-3-5-19(6-4-18)9-11-29-28-23-16-30-12-10-21-14-26-27(33-17-32-26)15-22(21)24(30)13-20(23)7-8-25(28)31-2/h3-8,13-16H,9-12,17H2,1-2H3/p+1/b29-28- DDDWZFGIZOSWPU-ZIADKAODSA-O 50358091 CHEMBL1915205 Cholinesterase 821 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358091 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358091&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56933495 136962115 CHEMBL1915205 ZINC73166241 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703661 COc1ccc(CC\[NH+]=c2/c(OC)ccc3cc4-c5cc6OCOc6cc5CCn4cc23)cc1OC InChI=1S/C29H28N2O5/c1-32-24-6-4-18(12-26(24)34-3)8-10-30-29-22-16-31-11-9-20-14-27-28(36-17-35-27)15-21(20)23(31)13-19(22)5-7-25(29)33-2/h4-7,12-16H,8-11,17H2,1-3H3/p+1/b30-29- NTEAWPVEFUUGMH-FLWNBWAVSA-O 50358092 CHEMBL1915206 Cholinesterase 5818 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358092 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358092&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56933623 136962116 CHEMBL1915206 ZINC73166243 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703662 COc1ccc2cc3-c4cc5OCOc5cc4CCn3cc2\c1=[NH+]\CCc1ccc(Cl)cc1Cl InChI=1S/C27H22Cl2N2O3/c1-32-24-5-3-17-10-23-20-13-26-25(33-15-34-26)11-18(20)7-9-31(23)14-21(17)27(24)30-8-6-16-2-4-19(28)12-22(16)29/h2-5,10-14H,6-9,15H2,1H3/p+1/b30-27- PBBXRVDYZTTYNZ-IKPAITLHSA-O 50358093 CHEMBL1915207 Cholinesterase 424 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358093 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358093&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56933625 136962117 CHEMBL1915207 ZINC73166246 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703663 COc1ccc2cc3-c4cc5OCOc5cc4CCn3cc2\c1=[NH+]\CCCCOc1cccc2ccccc12 InChI=1S/C33H30N2O4/c1-36-30-12-11-23-17-28-26-19-32-31(38-21-39-32)18-24(26)13-15-35(28)20-27(23)33(30)34-14-4-5-16-37-29-10-6-8-22-7-2-3-9-25(22)29/h2-3,6-12,17-20H,4-5,13-16,21H2,1H3/p+1/b34-33- PAVVTHHAIUGRQZ-YHZPTAEISA-O 50358094 CHEMBL1915208 Cholinesterase 511 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358094 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358094&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56933627 136962118 CHEMBL1915208 ZINC73196925 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703664 COc1ccc2cc3-c4cc5OCOc5cc4CCn3cc2\c1=[NH+]\CCCCOc1cccnc1 InChI=1S/C28H27N3O4/c1-32-25-7-6-19-13-24-22-15-27-26(34-18-35-27)14-20(22)8-11-31(24)17-23(19)28(25)30-10-2-3-12-33-21-5-4-9-29-16-21/h4-7,9,13-17H,2-3,8,10-12,18H2,1H3/p+1/b30-28- MRFANPAKFKPOJX-HYOGKJQXSA-O 50358095 CHEMBL1915209 Cholinesterase 2936 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358095 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358095&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56933629 136962119 CHEMBL1915209 ZINC73196926 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703665 COc1ccc2cc3-c4cc5OCOc5cc4CCn3cc2\c1=[NH+]\C(C)c1ccccc1 InChI=1S/C27H24N2O3/c1-17(18-6-4-3-5-7-18)28-27-22-15-29-11-10-20-13-25-26(32-16-31-25)14-21(20)23(29)12-19(22)8-9-24(27)30-2/h3-9,12-15,17H,10-11,16H2,1-2H3/p+1/b28-27- FYJTVIQVVVTNEN-DQSJHHFOSA-O 50358096 CHEMBL1915210 Cholinesterase 3280 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358096 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358096&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56933631 136962120 CHEMBL1915210 ZINC73166031 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50703666 COc1ccc2cc3-c4cc5OCOc5cc4CCn3cc2\c1=[NH+]\CC(C)C InChI=1S/C23H24N2O3/c1-14(2)11-24-23-18-12-25-7-6-16-9-21-22(28-13-27-21)10-17(16)19(25)8-15(18)4-5-20(23)26-3/h4-5,8-10,12,14H,6-7,11,13H2,1-3H3/p+1/b24-23- LOFORVTYXWSUNI-VHXPQNKSSA-O 50358097 CHEMBL1915211 Cholinesterase 2016 ChEMBL 10.1016/j.ejmech.2011.09.051 10.7270/Q2Z60PGX 22019228 Shan, WJ; Huang, L; Zhou, Q; Meng, FC; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50358097 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50358097&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56933750 136962121 CHEMBL1915211 ZINC73166034 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50706638 CN(CC#C)Cc1cc2cc(OCCCN3CCN(Cc4ccccc4)CC3)ccc2n1C InChI=1S/C28H36N4O/c1-4-13-29(2)23-26-20-25-21-27(11-12-28(25)30(26)3)33-19-8-14-31-15-17-32(18-16-31)22-24-9-6-5-7-10-24/h1,5-7,9-12,20-21H,8,13-19,22-23H2,2-3H3 SLRSNCWUOFPURJ-UHFFFAOYSA-N 50359392 CHEMBL1929424::US8999994, 3 Cholinesterase 7600 ChEMBL 10.1021/jm200853t 10.7270/Q20P10G5 22023459 Bolea, I; Juarez-Jimenez, J; de Los Rios, C; Chioua, M; Pouplana, R; Luque, FJ; Unzeta, M; Marco-Contelles, J; Samadi, A Universitat Aut£noma de Barcelona http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50359392 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50359392&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56925339 136963416 CHEMBL1929424 ZINC73197576 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50706639 CN(CC#C)Cc1cc2cc(OCCCN3CCC(Cc4ccccc4)CC3)ccc2n1C InChI=1S/C29H37N3O/c1-4-15-30(2)23-27-21-26-22-28(11-12-29(26)31(27)3)33-19-8-16-32-17-13-25(14-18-32)20-24-9-6-5-7-10-24/h1,5-7,9-12,21-22,25H,8,13-20,23H2,2-3H3 ZOKJNFBIMVLFEW-UHFFFAOYSA-N 50359393 CHEMBL1926712::US8999994, 2 Cholinesterase 2200 ChEMBL 10.1021/jm200853t 10.7270/Q20P10G5 22023459 Bolea, I; Juarez-Jimenez, J; de Los Rios, C; Chioua, M; Pouplana, R; Luque, FJ; Unzeta, M; Marco-Contelles, J; Samadi, A Universitat Aut£noma de Barcelona http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50359393 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50359393&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53390337 136963417 CHEMBL1926712 ZINC73197575 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50706640 CN(CC#C)Cc1cc2cc(OCCN3CCC(Cc4ccccc4)CC3)ccc2n1C InChI=1S/C28H35N3O/c1-4-14-29(2)22-26-20-25-21-27(10-11-28(25)30(26)3)32-18-17-31-15-12-24(13-16-31)19-23-8-6-5-7-9-23/h1,5-11,20-21,24H,12-19,22H2,2-3H3 DPUKGNVEMIXJJV-UHFFFAOYSA-N 50359394 CHEMBL1929423::US8999994, 1 Cholinesterase 800 ChEMBL 10.1021/jm200853t 10.7270/Q20P10G5 22023459 Bolea, I; Juarez-Jimenez, J; de Los Rios, C; Chioua, M; Pouplana, R; Luque, FJ; Unzeta, M; Marco-Contelles, J; Samadi, A Universitat Aut£noma de Barcelona http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50359394 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50359394&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53390336 136963418 CHEMBL1929423 ZINC73197574 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50706641 CN(CC#C)Cc1cc2cc(OCCCCC3CCN(Cc4ccccc4)CC3)ccc2n1C InChI=1S/C30H39N3O/c1-4-17-31(2)24-28-21-27-22-29(13-14-30(27)32(28)3)34-20-9-8-10-25-15-18-33(19-16-25)23-26-11-6-5-7-12-26/h1,5-7,11-14,21-22,25H,8-10,15-20,23-24H2,2-3H3 FGYIUWXDEDSRJR-UHFFFAOYSA-N 50359395 CHEMBL1929422 Cholinesterase 990 ChEMBL 10.1021/jm200853t 10.7270/Q20P10G5 22023459 Bolea, I; Juarez-Jimenez, J; de Los Rios, C; Chioua, M; Pouplana, R; Luque, FJ; Unzeta, M; Marco-Contelles, J; Samadi, A Universitat Aut£noma de Barcelona http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50359395 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50359395&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53390423 136963419 CHEMBL1929422 ZINC72316995 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50706642 CN(CC#C)Cc1cc2cc(OCCCC3CCN(Cc4ccccc4)CC3)ccc2n1C InChI=1S/C29H37N3O/c1-4-16-30(2)23-27-20-26-21-28(12-13-29(26)31(27)3)33-19-8-11-24-14-17-32(18-15-24)22-25-9-6-5-7-10-25/h1,5-7,9-10,12-13,20-21,24H,8,11,14-19,22-23H2,2-3H3 ADCBAOTWERXLAP-UHFFFAOYSA-N 50359391 CHEMBL1929421 Cholinesterase 460 ChEMBL 10.1021/jm200853t 10.7270/Q20P10G5 22023459 Bolea, I; Juarez-Jimenez, J; de Los Rios, C; Chioua, M; Pouplana, R; Luque, FJ; Unzeta, M; Marco-Contelles, J; Samadi, A Universitat Aut£noma de Barcelona http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50359391 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50359391&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53378764 136963415 CHEMBL1929421 ZINC72316998 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50706643 CN(CC#C)Cc1cc2cc(OCCC3CCN(Cc4ccccc4)CC3)ccc2n1C InChI=1S/C28H35N3O/c1-4-15-29(2)22-26-19-25-20-27(10-11-28(25)30(26)3)32-18-14-23-12-16-31(17-13-23)21-24-8-6-5-7-9-24/h1,5-11,19-20,23H,12-18,21-22H2,2-3H3 MDLQDZAGZXYYJT-UHFFFAOYSA-N 50359396 CHEMBL1929420::US8999994, 5 Cholinesterase 2100 ChEMBL 10.1021/jm200853t 10.7270/Q20P10G5 22023459 Bolea, I; Juarez-Jimenez, J; de Los Rios, C; Chioua, M; Pouplana, R; Luque, FJ; Unzeta, M; Marco-Contelles, J; Samadi, A Universitat Aut£noma de Barcelona http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50359396 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50359396&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53390424 136963420 CHEMBL1929420 ZINC72316997 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50706644 CN(CC#C)Cc1cc2cc(OCC3CCN(Cc4ccccc4)CC3)ccc2n1C InChI=1S/C27H33N3O/c1-4-14-28(2)20-25-17-24-18-26(10-11-27(24)29(25)3)31-21-23-12-15-30(16-13-23)19-22-8-6-5-7-9-22/h1,5-11,17-18,23H,12-16,19-21H2,2-3H3 BWQUMDSADVOLFZ-UHFFFAOYSA-N 50359397 CHEMBL1929419::US8999994, 4 Cholinesterase 1100 ChEMBL 10.1021/jm200853t 10.7270/Q20P10G5 22023459 Bolea, I; Juarez-Jimenez, J; de Los Rios, C; Chioua, M; Pouplana, R; Luque, FJ; Unzeta, M; Marco-Contelles, J; Samadi, A Universitat Aut£noma de Barcelona http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50359397 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50359397&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53390425 136963421 CHEMBL1929419 ZINC72316996 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50706645 CN(CC#C)Cc1cc2cc(OCc3ccccc3)ccc2n1C InChI=1S/C21H22N2O/c1-4-12-22(2)15-19-13-18-14-20(10-11-21(18)23(19)3)24-16-17-8-6-5-7-9-17/h1,5-11,13-14H,12,15-16H2,2-3H3 YASPBSWTXDWFLF-UHFFFAOYSA-N 50359390 CHEMBL1929418::CHEMBL2022924 Cholinesterase >100000 ChEMBL 10.1021/jm200853t 10.7270/Q20P10G5 22023459 Bolea, I; Juarez-Jimenez, J; de Los Rios, C; Chioua, M; Pouplana, R; Luque, FJ; Unzeta, M; Marco-Contelles, J; Samadi, A Universitat Aut£noma de Barcelona http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50359390 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50359390&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 195646 136963414 CHEMBL1929418CHEMBL2022924 ZINC31542753 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50706646 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 7400 ChEMBL 10.1021/jm200853t 10.7270/Q20P10G5 22023459 Bolea, I; Juarez-Jimenez, J; de Los Rios, C; Chioua, M; Pouplana, R; Luque, FJ; Unzeta, M; Marco-Contelles, J; Samadi, A Universitat Aut£noma de Barcelona http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50721366 Clc1ccc2C(=O)c3cccc4ccnc(-c2c1)c34 InChI=1S/C16H8ClNO/c17-10-4-5-11-13(8-10)15-14-9(6-7-18-15)2-1-3-12(14)16(11)19/h1-8H WCPSATPCTGEOOA-UHFFFAOYSA-N 50365769 CHEMBL1956548 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2012.01.090 10.7270/Q2HH6KJX 22341944 Tang, H; Zhao, HT; Zhong, SM; Wang, ZY; Chen, ZF; Liang, H School of Chemistry & Chemical Engineering of Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50365769 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50365769&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57400975 136969831 CHEMBL1956548 ZINC73312733 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50721367 CN(C)CCNc1ccc2C(=O)c3cccc4ccnc(-c2c1)c34 InChI=1S/C20H19N3O/c1-23(2)11-10-21-14-6-7-15-17(12-14)19-18-13(8-9-22-19)4-3-5-16(18)20(15)24/h3-9,12,21H,10-11H2,1-2H3 VIWITDOAELVDJV-UHFFFAOYSA-N 50365770 CHEMBL1956549 Cholinesterase 1890 ChEMBL 10.1016/j.bmcl.2012.01.090 10.7270/Q2HH6KJX 22341944 Tang, H; Zhao, HT; Zhong, SM; Wang, ZY; Chen, ZF; Liang, H School of Chemistry & Chemical Engineering of Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50365770 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50365770&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57390455 136969832 CHEMBL1956549 ZINC73312736 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50721368 CN(C)CCCNc1ccc2C(=O)c3cccc4ccnc(-c2c1)c34 InChI=1S/C21H21N3O/c1-24(2)12-4-10-22-15-7-8-16-18(13-15)20-19-14(9-11-23-20)5-3-6-17(19)21(16)25/h3,5-9,11,13,22H,4,10,12H2,1-2H3 TWUSFVAUFFQXIK-UHFFFAOYSA-N 50365771 CHEMBL1956550 Cholinesterase 1190 ChEMBL 10.1016/j.bmcl.2012.01.090 10.7270/Q2HH6KJX 22341944 Tang, H; Zhao, HT; Zhong, SM; Wang, ZY; Chen, ZF; Liang, H School of Chemistry & Chemical Engineering of Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50365771 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50365771&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57345522 136969833 CHEMBL1956550 ZINC73312740 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50721369 CCN(CC)CCNc1ccc2C(=O)c3cccc4ccnc(-c2c1)c34 InChI=1S/C22H23N3O/c1-3-25(4-2)13-12-23-16-8-9-17-19(14-16)21-20-15(10-11-24-21)6-5-7-18(20)22(17)26/h5-11,14,23H,3-4,12-13H2,1-2H3 LMQYQUSRKVTVDW-UHFFFAOYSA-N 50365772 CHEMBL1956551 Cholinesterase 1130 ChEMBL 10.1016/j.bmcl.2012.01.090 10.7270/Q2HH6KJX 22341944 Tang, H; Zhao, HT; Zhong, SM; Wang, ZY; Chen, ZF; Liang, H School of Chemistry & Chemical Engineering of Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50365772 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50365772&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57345523 136969834 CHEMBL1956551 ZINC73336877 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50721370 CCN(CC)CCCNc1ccc2C(=O)c3cccc4ccnc(-c2c1)c34 InChI=1S/C23H25N3O/c1-3-26(4-2)14-6-12-24-17-9-10-18-20(15-17)22-21-16(11-13-25-22)7-5-8-19(21)23(18)27/h5,7-11,13,15,24H,3-4,6,12,14H2,1-2H3 XNETYORDRXPMRM-UHFFFAOYSA-N 50365773 CHEMBL1956552 Cholinesterase 2810 ChEMBL 10.1016/j.bmcl.2012.01.090 10.7270/Q2HH6KJX 22341944 Tang, H; Zhao, HT; Zhong, SM; Wang, ZY; Chen, ZF; Liang, H School of Chemistry & Chemical Engineering of Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50365773 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50365773&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57345524 136969835 CHEMBL1956552 ZINC73351179 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50721371 O=C1c2ccc(NCCN3CCOCC3)cc2-c2nccc3cccc1c23 InChI=1S/C22H21N3O2/c26-22-17-5-4-16(23-8-9-25-10-12-27-13-11-25)14-19(17)21-20-15(6-7-24-21)2-1-3-18(20)22/h1-7,14,23H,8-13H2 TXVNKMVOZYSYBG-UHFFFAOYSA-N 50365774 CHEMBL1956553 Cholinesterase 25900 ChEMBL 10.1016/j.bmcl.2012.01.090 10.7270/Q2HH6KJX 22341944 Tang, H; Zhao, HT; Zhong, SM; Wang, ZY; Chen, ZF; Liang, H School of Chemistry & Chemical Engineering of Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50365774 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50365774&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57402733 136969836 CHEMBL1956553 ZINC73351180 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50721372 O=C1c2ccc(NCCCN3CCOCC3)cc2-c2nccc3cccc1c23 InChI=1S/C23H23N3O2/c27-23-18-6-5-17(24-8-2-10-26-11-13-28-14-12-26)15-20(18)22-21-16(7-9-25-22)3-1-4-19(21)23/h1,3-7,9,15,24H,2,8,10-14H2 INKMUDWQXKENFA-UHFFFAOYSA-N 50365775 CHEMBL1956554 Cholinesterase 6940 ChEMBL 10.1016/j.bmcl.2012.01.090 10.7270/Q2HH6KJX 22341944 Tang, H; Zhao, HT; Zhong, SM; Wang, ZY; Chen, ZF; Liang, H School of Chemistry & Chemical Engineering of Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50365775 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50365775&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57345525 136969837 CHEMBL1956554 ZINC73311219 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50721373 OCCNc1ccc2C(=O)c3cccc4ccnc(-c2c1)c34 InChI=1S/C18H14N2O2/c21-9-8-19-12-4-5-13-15(10-12)17-16-11(6-7-20-17)2-1-3-14(16)18(13)22/h1-7,10,19,21H,8-9H2 RTMFWOSACWVCPW-UHFFFAOYSA-N 50365776 CHEMBL1956555 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2012.01.090 10.7270/Q2HH6KJX 22341944 Tang, H; Zhao, HT; Zhong, SM; Wang, ZY; Chen, ZF; Liang, H School of Chemistry & Chemical Engineering of Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50365776 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50365776&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57397533 136969838 CHEMBL1956555 ZINC73311222 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50721374 OCCCNc1ccc2C(=O)c3cccc4ccnc(-c2c1)c34 InChI=1S/C19H16N2O2/c22-10-2-8-20-13-5-6-14-16(11-13)18-17-12(7-9-21-18)3-1-4-15(17)19(14)23/h1,3-7,9,11,20,22H,2,8,10H2 NTMYINMRVGBDLC-UHFFFAOYSA-N 50365777 CHEMBL1956556 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2012.01.090 10.7270/Q2HH6KJX 22341944 Tang, H; Zhao, HT; Zhong, SM; Wang, ZY; Chen, ZF; Liang, H School of Chemistry & Chemical Engineering of Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50365777 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50365777&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57392241 136969839 CHEMBL1956556 ZINC73311224 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50721375 O=C1c2ccc(NCCN3CCCC3)cc2-c2nccc3cccc1c23 InChI=1S/C22H21N3O/c26-22-17-7-6-16(23-10-13-25-11-1-2-12-25)14-19(17)21-20-15(8-9-24-21)4-3-5-18(20)22/h3-9,14,23H,1-2,10-13H2 JRWKFHNYNRFFOO-UHFFFAOYSA-N 50365778 CHEMBL1956557 Cholinesterase 2780 ChEMBL 10.1016/j.bmcl.2012.01.090 10.7270/Q2HH6KJX 22341944 Tang, H; Zhao, HT; Zhong, SM; Wang, ZY; Chen, ZF; Liang, H School of Chemistry & Chemical Engineering of Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50365778 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50365778&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57397534 136969840 CHEMBL1956557 ZINC73311227 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50721376 O=C1c2ccc(NCCCN3CCCC3)cc2-c2nccc3cccc1c23 InChI=1S/C23H23N3O/c27-23-18-8-7-17(24-10-4-14-26-12-1-2-13-26)15-20(18)22-21-16(9-11-25-22)5-3-6-19(21)23/h3,5-9,11,15,24H,1-2,4,10,12-14H2 AROJOJHHBFSORT-UHFFFAOYSA-N 50365779 CHEMBL1956558 Cholinesterase 4970 ChEMBL 10.1016/j.bmcl.2012.01.090 10.7270/Q2HH6KJX 22341944 Tang, H; Zhao, HT; Zhong, SM; Wang, ZY; Chen, ZF; Liang, H School of Chemistry & Chemical Engineering of Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50365779 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50365779&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57345526 136969841 CHEMBL1956558 ZINC73311228 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50721377 O=C1c2ccc(NCCN3CCCCC3)cc2-c2nccc3cccc1c23 InChI=1S/C23H23N3O/c27-23-18-8-7-17(24-11-14-26-12-2-1-3-13-26)15-20(18)22-21-16(9-10-25-22)5-4-6-19(21)23/h4-10,15,24H,1-3,11-14H2 WWEVQCRCBCKZQS-UHFFFAOYSA-N 50365780 CHEMBL1956559 Cholinesterase 1420 ChEMBL 10.1016/j.bmcl.2012.01.090 10.7270/Q2HH6KJX 22341944 Tang, H; Zhao, HT; Zhong, SM; Wang, ZY; Chen, ZF; Liang, H School of Chemistry & Chemical Engineering of Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50365780 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50365780&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57345527 136969842 CHEMBL1956559 ZINC73311890 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50721378 O=C1c2ccc(NCCCN3CCCCC3)cc2-c2nccc3cccc1c23 InChI=1S/C24H25N3O/c28-24-19-9-8-18(25-11-5-15-27-13-2-1-3-14-27)16-21(19)23-22-17(10-12-26-23)6-4-7-20(22)24/h4,6-10,12,16,25H,1-3,5,11,13-15H2 CSINCOBQFMDGAE-UHFFFAOYSA-N 50365781 CHEMBL1956560 Cholinesterase 1540 ChEMBL 10.1016/j.bmcl.2012.01.090 10.7270/Q2HH6KJX 22341944 Tang, H; Zhao, HT; Zhong, SM; Wang, ZY; Chen, ZF; Liang, H School of Chemistry & Chemical Engineering of Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50365781 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50365781&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57345528 136969843 CHEMBL1956560 ZINC73314911 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50721379 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 21 ChEMBL 10.1016/j.bmcl.2012.01.090 10.7270/Q2HH6KJX 22341944 Tang, H; Zhao, HT; Zhong, SM; Wang, ZY; Chen, ZF; Liang, H School of Chemistry & Chemical Engineering of Guangxi Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50870808 O=Cc1ccc(O[C@@H]2OC[C@@H](OC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)cc1 InChI=1S/C33H26O9/c34-20-22-16-18-26(19-17-22)39-33-29(42-32(37)25-14-8-3-9-15-25)28(41-31(36)24-12-6-2-7-13-24)27(21-38-33)40-30(35)23-10-4-1-5-11-23/h1-20,27-29,33H,21H2/t27-,28-,29-,33+/m1/s1 GDJGTLPDNQADLM-LNHQPZRBSA-N 50245885 (2S,3R,4R,5R)-4,5-bis(benzoyloxy)-2-(4-formylphenoxy)oxan-3-yl benzoate::4-Formylphenyl (2,3,4-tri-O-benzoyl)-beta-D-ribopyranoside::CHEMBL450898 Cholinesterase 64270 ChEMBL 10.1016/j.ejmech.2007.03.018 10.7270/Q2DF6S3Z 17574306 Wen, H; Lin, C; Que, L; Ge, H; Ma, L; Cao, R; Wan, Y; Peng, W; Wang, Z; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50245885 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50245885&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 24796131 104101442 CHEMBL450898 ZINC42833924 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50870809 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 15240 ChEMBL 10.1016/j.ejmech.2007.03.018 10.7270/Q2DF6S3Z 17574306 Wen, H; Lin, C; Que, L; Ge, H; Ma, L; Cao, R; Wan, Y; Peng, W; Wang, Z; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50870810 CO\N=C/c1ccc(O[C@@H]2OC[C@@H](OC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)cc1 InChI=1S/C34H29NO9/c1-39-35-21-23-17-19-27(20-18-23)41-34-30(44-33(38)26-15-9-4-10-16-26)29(43-32(37)25-13-7-3-8-14-25)28(22-40-34)42-31(36)24-11-5-2-6-12-24/h2-21,28-30,34H,22H2,1H3/b35-21-/t28-,29-,30-,34+/m1/s1 HITZNFPIXVOIKB-AEUSAGJUSA-N 50251191 1-(4-(2,3,4-Tri-O-benzoyl-beta-D-ribopyranosyl) benzylidene)methoxyamine::CHEMBL452742 Cholinesterase 45830 ChEMBL 10.1016/j.ejmech.2007.03.018 10.7270/Q2DF6S3Z 17574306 Wen, H; Lin, C; Que, L; Ge, H; Ma, L; Cao, R; Wan, Y; Peng, W; Wang, Z; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50251191 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50251191&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44567496 104104458 CHEMBL452742 ZINC44351470 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50870811 O=NCc1ccc(O[C@@H]2OC[C@@H](OC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)cc1 InChI=1S/C33H27NO9/c35-30(23-10-4-1-5-11-23)41-27-21-39-33(40-26-18-16-22(17-19-26)20-34-38)29(43-32(37)25-14-8-3-9-15-25)28(27)42-31(36)24-12-6-2-7-13-24/h1-19,27-29,33H,20-21H2/t27-,28-,29-,33+/m1/s1 CWMIGHQGHAIIEI-LNHQPZRBSA-N 50251190 1-(4-(2,3,4-Tri-O-benzoyl-beta-D-ribopyranosyl) benzylidene)hydroxylamine::CHEMBL500712 Cholinesterase 39600 ChEMBL 10.1016/j.ejmech.2007.03.018 10.7270/Q2DF6S3Z 17574306 Wen, H; Lin, C; Que, L; Ge, H; Ma, L; Cao, R; Wan, Y; Peng, W; Wang, Z; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50251190 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50251190&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91935886 104104457 CHEMBL500712 ZINC42804454 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50870812 NC(=O)NN=Cc1ccc(O[C@@H]2OC[C@@H](OC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)cc1 InChI=1S/C34H29N3O9/c35-34(41)37-36-20-22-16-18-26(19-17-22)43-33-29(46-32(40)25-14-8-3-9-15-25)28(45-31(39)24-12-6-2-7-13-24)27(21-42-33)44-30(38)23-10-4-1-5-11-23/h1-20,27-29,33H,21H2,(H3,35,37,41)/t27-,28-,29-,33+/m1/s1 NFCXGXMRZPBKKT-LNHQPZRBSA-N 50251189 1-(4-(2,3,4-Tri-O-benzoyl-beta-D-ribopyranosyl) benzylidene)semicarbazide::CHEMBL442866 Cholinesterase 48720 ChEMBL 10.1016/j.ejmech.2007.03.018 10.7270/Q2DF6S3Z 17574306 Wen, H; Lin, C; Que, L; Ge, H; Ma, L; Cao, R; Wan, Y; Peng, W; Wang, Z; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50251189 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50251189&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 24795992 104104456 CHEMBL442866 ZINC44280779 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50870813 NC(=S)NN=Cc1ccc(O[C@@H]2OC[C@@H](OC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)cc1 InChI=1S/C34H29N3O8S/c35-34(46)37-36-20-22-16-18-26(19-17-22)42-33-29(45-32(40)25-14-8-3-9-15-25)28(44-31(39)24-12-6-2-7-13-24)27(21-41-33)43-30(38)23-10-4-1-5-11-23/h1-20,27-29,33H,21H2,(H3,35,37,46)/t27-,28-,29-,33+/m1/s1 HTXSWHOZQNLKBQ-LNHQPZRBSA-N 50251188 1-(4-(2,3,4-Tri-O-benzoyl-beta-D-ribopyranosyl) benzylidene)thiosemicarbazide::CHEMBL503053 Cholinesterase 71830 ChEMBL 10.1016/j.ejmech.2007.03.018 10.7270/Q2DF6S3Z 17574306 Wen, H; Lin, C; Que, L; Ge, H; Ma, L; Cao, R; Wan, Y; Peng, W; Wang, Z; Song, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50251188 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50251188&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 24796252 104104455 CHEMBL503053 ZINC49889291 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50872262 COc1ccc2c3c1oc(=O)c1c(CCN(C)C)cc(OC)c(oc2=O)c31 InChI=1S/C20H19NO6/c1-21(2)8-7-10-9-13(25-4)18-16-14(10)20(23)27-17-12(24-3)6-5-11(15(16)17)19(22)26-18/h5-6,9H,7-8H2,1-4H3 MTAWKURMWOXCEO-UHFFFAOYSA-N 50241808 CHEMBL470867::taspine::{1-(2-dimethylaminoethyl)-3,8-dimethoxychromeno[5,4,3-cde]chromene-5,10-dione} Cholinesterase >100000 ChEMBL 10.1021/np060268p 10.7270/Q2G161QD 16989531 Rollinger, JM; Schuster, D; Baier, E; Ellmerer, EP; Langer, T; Stuppner, H Leopold-Franzens-Universit£t http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50241808 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50241808&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 215159 104098872 CHEMBL470867 ZINC01702514 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50872268 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 40 ChEMBL 10.1021/np060268p 10.7270/Q2G161QD 16989531 Rollinger, JM; Schuster, D; Baier, E; Ellmerer, EP; Langer, T; Stuppner, H Leopold-Franzens-Universit£t http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50872269 COc1c(O)cc2CCN[C@@H]3Cc4ccccc4-c1c23 InChI=1S/C17H17NO2/c1-20-17-14(19)9-11-6-7-18-13-8-10-4-2-3-5-12(10)16(17)15(11)13/h2-5,9,13,18-19H,6-8H2,1H3/t13-/m1/s1 NBDNEUOVIJYCGZ-CYBMUJFWSA-N 50241809 (-)-asimilobine::CHEMBL469423::[1-methoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-2-ol (6aR)] Cholinesterase >100000 ChEMBL 10.1021/np060268p 10.7270/Q2G161QD 16989531 Rollinger, JM; Schuster, D; Baier, E; Ellmerer, EP; Langer, T; Stuppner, H Leopold-Franzens-Universit£t http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50241809 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50241809&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 160875 104098873 70637 CHEMBL469423 ZINC31166315 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50871646 C(CCCNc1c2CCCCc2nc2ccccc12)CCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C33H40N4/c1(2-12-22-34-32-24-14-4-8-18-28(24)36-29-19-9-5-15-25(29)32)3-13-23-35-33-26-16-6-10-20-30(26)37-31-21-11-7-17-27(31)33/h4,6,8,10,14,16,18,20H,1-3,5,7,9,11-13,15,17,19,21-23H2,(H,34,36)(H,35,37) ITZOKHKOFJOBFS-UHFFFAOYSA-N 8963 CHEMBL32823::Homodimeric Tacrine Analog 3b::N-[7-(1,2,3,4-tetrahydroacridin-9-ylamino)heptyl]-1,2,3,4-tetrahydroacridin-9-amine::Tacrine Dimer 3b::Tacrine-Based Inhibitor 2f::tacrine homobivalent compound 3a Cholinesterase 2.00 ChEMBL 10.1021/jm701253t 10.7270/Q22Z16D4 18479118 Butini, S; Campiani, G; Borriello, M; Gemma, S; Panico, A; Persico, M; Catalanotti, B; Ros, S; Brindisi, M; Agnusdei, M; Fiorini, I; Nacci, V; Novellino, E; Belinskaya, T; Saxena, A; Fattorusso, C Universit£ di Siena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8963 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8963&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search AA7 2CKM,5EI5 9549196 46509739 CHEMBL32823 ZINC01893945 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50871648 CN(CCCNc1c2CCCCc2nc2ccccc12)CCCSc1c2CCCCc2nc2ccccc12 InChI=1S/C33H40N4S/c1-37(21-10-20-34-32-24-12-2-6-16-28(24)35-29-17-7-3-13-25(29)32)22-11-23-38-33-26-14-4-8-18-30(26)36-31-19-9-5-15-27(31)33/h2,4,6,8,12,14,16,18H,3,5,7,9-11,13,15,17,19-23H2,1H3,(H,34,35) IIQODJRESHGVGO-UHFFFAOYSA-N 8974 CHEMBL367067::N-Methyl-N-(1,2,3,4-tetrahydroacridin-9-yl)-N-[3-(1,2,3,4-tetrahydroacridin-9-ylsulfanyl)propyl]-1,3-propanediamine::Tacrine Dimer 4j::methyl[3-(1,2,3,4-tetrahydroacridin-9-ylamino)propyl][3-(1,2,3,4-tetrahydroacridin-9-ylsulfanyl)propyl]amine Cholinesterase 4.20 ChEMBL 10.1021/jm701253t 10.7270/Q22Z16D4 18479118 Butini, S; Campiani, G; Borriello, M; Gemma, S; Panico, A; Persico, M; Catalanotti, B; Ros, S; Brindisi, M; Agnusdei, M; Fiorini, I; Nacci, V; Novellino, E; Belinskaya, T; Saxena, A; Fattorusso, C Universit£ di Siena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8974 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8974&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11477998 46509750 CHEMBL367067 ZINC13612214 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50912063 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 8400 ChEMBL 10.1016/j.bmcl.2010.03.011 10.7270/Q22808KX 20350808 Schulze, M; Siol, O; Decker, M; Lehmann, J Friedrich-Schiller-Universit£t Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50912064 COc1ccc2C3N(CCc4ccccc34)CCc2c1 InChI=1S/C18H19NO/c1-20-15-6-7-17-14(12-15)9-11-19-10-8-13-4-2-3-5-16(13)18(17)19/h2-7,12,18H,8-11H2,1H3 WJXQBRZOHAKKTH-UHFFFAOYSA-N 50304394 3-methoxy-5,8,9,13b-tetrahydro-6H-isoquino-[1,2-a]isoquinoline::3-methoxy-6,8,9,13b-tetrahydro-5H-isoquinolino[1,2-a]isoquinoline::CHEMBL593395 Cholinesterase >10000000 ChEMBL 10.1016/j.bmcl.2010.03.011 10.7270/Q22808KX 20350808 Schulze, M; Siol, O; Decker, M; Lehmann, J Friedrich-Schiller-Universit£t Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50304394 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50304394&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12301195 104158755 CHEMBL593395 ZINC45349310 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50912065 COc1ccc2C3c4ccccc4CC[N+]3(C)CCc2c1 InChI=1S/C19H22NO/c1-20-11-9-14-5-3-4-6-17(14)19(20)18-8-7-16(21-2)13-15(18)10-12-20/h3-8,13,19H,9-12H2,1-2H3/q+1 ICPCBSSZIHJQET-UHFFFAOYSA-N 50317082 3-methoxy-7-methyl-5,6,7,8,9,13b-hexahydroisoquinolino[1,2-a]isoquinolinium iodide::CHEMBL1099375 Cholinesterase 6400 ChEMBL 10.1016/j.bmcl.2010.03.011 10.7270/Q22808KX 20350808 Schulze, M; Siol, O; Decker, M; Lehmann, J Friedrich-Schiller-Universit£t Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317082 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317082&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11718417 104151443 CHEMBL1099375 ZINC34641926 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50912066 COc1ccc2Cc3ccccc3CCN(C)CCc2c1 InChI=1S/C19H23NO/c1-20-11-9-15-5-3-4-6-16(15)13-17-7-8-19(21-2)14-18(17)10-12-20/h3-8,14H,9-13H2,1-2H3 ATCJEKKXEJVYOB-UHFFFAOYSA-N 50184429 16-methoxy-11-methyl-11-aza-tricyclo[12.4.0.03,8]octadeca-1(18),3(8),4,6,14,16-hexaene::3-methoxy-7-methyl-5,6,7,8,9,14-hexahydrodibenzo[d,g]azecine::6-methoxy-11-methyl-11-aza-tricyclo[12.4.0.0.3,8]octadeca-1(18),3(8),4,6,14,16-hexaene::CHEMBL380330 Cholinesterase >10000000 ChEMBL 10.1016/j.bmcl.2010.03.011 10.7270/Q22808KX 20350808 Schulze, M; Siol, O; Decker, M; Lehmann, J Friedrich-Schiller-Universit£t Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50184429 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50184429&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44408818 104068789 CHEMBL380330 ZINC13684083 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50912067 C(COc1ccc2C3N(CCc4ccccc34)CCc2c1)COc1ccc2C3N(CCc4ccccc34)CCc2c1 InChI=1S/C37H38N2O2/c1-3-8-32-26(6-1)14-18-38-20-16-28-24-30(10-12-34(28)36(32)38)40-22-5-23-41-31-11-13-35-29(25-31)17-21-39-19-15-27-7-2-4-9-33(27)37(35)39/h1-4,6-13,24-25,36-37H,5,14-23H2 DNCGWEOXZZUXOR-UHFFFAOYSA-N 50317083 3-[3-(5,8,9,13b-tetrahydro-6H-isoquino[1,2-a]isoquinolin-3-yloxy)propoxy]-5,8,9,13b-tetrahydro-6H-isoquino[1,2-a]isoquinoline::CHEMBL1099376 Cholinesterase 146 ChEMBL 10.1016/j.bmcl.2010.03.011 10.7270/Q22808KX 20350808 Schulze, M; Siol, O; Decker, M; Lehmann, J Friedrich-Schiller-Universit£t Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317083 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317083&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46889182 104151444 CHEMBL1099376 ZINC49792789 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50912068 C(CCOc1ccc2C3N(CCc4ccccc34)CCc2c1)COc1ccc2C3N(CCc4ccccc34)CCc2c1 InChI=1S/C38H40N2O2/c1-3-9-33-27(7-1)15-19-39-21-17-29-25-31(11-13-35(29)37(33)39)41-23-5-6-24-42-32-12-14-36-30(26-32)18-22-40-20-16-28-8-2-4-10-34(28)38(36)40/h1-4,7-14,25-26,37-38H,5-6,15-24H2 YFPJWCABOINEPJ-UHFFFAOYSA-N 50317081 3-[4-(5,8,9,13b-tetrahydro-6H-isoquino[1,2-a]isoquinolin-3-yloxy)butoxy]-5,8,9,13b-tetrahydro-6H-isoquino[1,2-a]isoquinoline::CHEMBL1095960 Cholinesterase 17 ChEMBL 10.1016/j.bmcl.2010.03.011 10.7270/Q22808KX 20350808 Schulze, M; Siol, O; Decker, M; Lehmann, J Friedrich-Schiller-Universit£t Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317081 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317081&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46861863 104151442 CHEMBL1095960 ZINC49783928 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50912069 C(CCOc1ccc2C3N(CCc4ccccc34)CCc2c1)CCOc1ccc2C3N(CCc4ccccc34)CCc2c1 InChI=1S/C39H42N2O2/c1(6-24-42-32-12-14-36-30(26-32)18-22-40-20-16-28-8-2-4-10-34(28)38(36)40)7-25-43-33-13-15-37-31(27-33)19-23-41-21-17-29-9-3-5-11-35(29)39(37)41/h2-5,8-15,26-27,38-39H,1,6-7,16-25H2 GQLRVZUEFPBQLU-UHFFFAOYSA-N 50317079 3-{[5-(5,8,9,13b-tetrahydro-6H-isoquino[1,2-a]isoquinolin-3-yloxy)pentyl]oxy}-5,8,9,13b-tetrahydro-6H-isoquino[1,2-a]isoquinoline::CHEMBL1099377 Cholinesterase 17 ChEMBL 10.1016/j.bmcl.2010.03.011 10.7270/Q22808KX 20350808 Schulze, M; Siol, O; Decker, M; Lehmann, J Friedrich-Schiller-Universit£t Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317079 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317079&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46861864 104151440 CHEMBL1099377 ZINC49792791 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50912070 C(CCCOc1ccc2C3N(CCc4ccccc34)CCc2c1)CCOc1ccc2C3N(CCc4ccccc34)CCc2c1 InChI=1S/C40H44N2O2/c1(7-25-43-33-13-15-37-31(27-33)19-23-41-21-17-29-9-3-5-11-35(29)39(37)41)2-8-26-44-34-14-16-38-32(28-34)20-24-42-22-18-30-10-4-6-12-36(30)40(38)42/h3-6,9-16,27-28,39-40H,1-2,7-8,17-26H2 WLXOCNXXBZJGFO-UHFFFAOYSA-N 50317084 3-{[6-(5,8,9,13b-tetrahydro-6H-isoquino[1,2-a]isoquinolin-3-yloxy)hexyl]oxy}-5,8,9,13b-tetrahydro-6H-isoquino[1,2-a]isoquinoline::CHEMBL1099378 Cholinesterase 14 ChEMBL 10.1016/j.bmcl.2010.03.011 10.7270/Q22808KX 20350808 Schulze, M; Siol, O; Decker, M; Lehmann, J Friedrich-Schiller-Universit£t Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317084 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317084&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46861874 104151445 CHEMBL1099378 ZINC49784297 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50912071 C(CCCCOc1ccc2C3N(CCc4ccccc34)CCc2c1)CCCOc1ccc2C3N(CCc4ccccc34)CCc2c1 InChI=1S/C42H48N2O2/c1(3-9-27-45-35-15-17-39-33(29-35)21-25-43-23-19-31-11-5-7-13-37(31)41(39)43)2-4-10-28-46-36-16-18-40-34(30-36)22-26-44-24-20-32-12-6-8-14-38(32)42(40)44/h5-8,11-18,29-30,41-42H,1-4,9-10,19-28H2 XIWZJWVJYRBFBA-UHFFFAOYSA-N 50317085 3-{[8-(5,8,9,13b-tetrahydro-6H-isoquino[1,2-a]isoquinolin-3-yloxy)octyl]oxy}-5,8,9,13b-tetrahydro-6H-isoquino[1,2-a]isoquinoline::CHEMBL1099379 Cholinesterase 680 ChEMBL 10.1016/j.bmcl.2010.03.011 10.7270/Q22808KX 20350808 Schulze, M; Siol, O; Decker, M; Lehmann, J Friedrich-Schiller-Universit£t Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317085 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317085&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46889183 104151446 CHEMBL1099379 ZINC49783988 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50912072 C(CCCCCCOc1ccc2C3N(CCc4ccccc34)CCc2c1)CCCCCOc1ccc2C3N(CCc4ccccc34)CCc2c1 InChI=1S/C46H56N2O2/c1(3-5-7-13-31-49-39-19-21-43-37(33-39)25-29-47-27-23-35-15-9-11-17-41(35)45(43)47)2-4-6-8-14-32-50-40-20-22-44-38(34-40)26-30-48-28-24-36-16-10-12-18-42(36)46(44)48/h9-12,15-22,33-34,45-46H,1-8,13-14,23-32H2 DPSGNUCYQIFAFM-UHFFFAOYSA-N 50317086 3-{[12-(5,8,9,13b-tetrahydro-6H-isoquino[1,2-a]isoquinolin-3-yloxy)dodecyl]oxy}-5,8,9,13b-tetrahydro-6H-isoquino[1,2-a]isoquinoline::CHEMBL1099380 Cholinesterase 920 ChEMBL 10.1016/j.bmcl.2010.03.011 10.7270/Q22808KX 20350808 Schulze, M; Siol, O; Decker, M; Lehmann, J Friedrich-Schiller-Universit£t Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317086 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317086&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46889184 104151447 CHEMBL1099380 ZINC49792793 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50912073 C[N+]12CCc3ccccc3C1c1ccc(OCCCOc3ccc4C5c6ccccc6CC[N+]5(C)CCc4c3)cc1CC2 InChI=1S/C39H44N2O2/c1-40-20-16-28-8-3-5-10-34(28)38(40)36-14-12-32(26-30(36)18-22-40)42-24-7-25-43-33-13-15-37-31(27-33)19-23-41(2)21-17-29-9-4-6-11-35(29)39(37)41/h3-6,8-15,26-27,38-39H,7,16-25H2,1-2H3/q+2 OFVCLEVYGVDROK-UHFFFAOYSA-N 50378775 CHEMBL1202342 Cholinesterase 156 ChEMBL 10.1016/j.bmcl.2010.03.011 10.7270/Q22808KX 20350808 Schulze, M; Siol, O; Decker, M; Lehmann, J Friedrich-Schiller-Universit£t Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50378775 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50378775&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46889186 160857858 CHEMBL1202342 ZINC49783950 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50912074 C[N+]12CCc3ccccc3C1c1ccc(OCCCCOc3ccc4C5c6ccccc6CC[N+]5(C)CCc4c3)cc1CC2 InChI=1S/C40H46N2O2/c1-41-21-17-29-9-3-5-11-35(29)39(41)37-15-13-33(27-31(37)19-23-41)43-25-7-8-26-44-34-14-16-38-32(28-34)20-24-42(2)22-18-30-10-4-6-12-36(30)40(38)42/h3-6,9-16,27-28,39-40H,7-8,17-26H2,1-2H3/q+2 GSNBFVUNURCXIQ-UHFFFAOYSA-N 50317087 7-methyl-3-{4-[(7-methyl-5,8,9,13b-tetrahydro-6H-isoquino[1,2-a]isoquinolinium-3-yl)oxy]butoxy}-5,8,9,13b-tetrahydro-6H-isoquino[1,2-a]isoquinolinium diiodide::CHEMBL1099382 Cholinesterase 51 ChEMBL 10.1016/j.bmcl.2010.03.011 10.7270/Q22808KX 20350808 Schulze, M; Siol, O; Decker, M; Lehmann, J Friedrich-Schiller-Universit£t Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317087 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317087&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46889187 104151448 CHEMBL1099382 ZINC49792795 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50912075 C[N+]12CCc3ccccc3C1c1ccc(OCCCCCOc3ccc4C5c6ccccc6CC[N+]5(C)CCc4c3)cc1CC2 InChI=1S/C41H48N2O2/c1-42-22-18-30-10-4-6-12-36(30)40(42)38-16-14-34(28-32(38)20-24-42)44-26-8-3-9-27-45-35-15-17-39-33(29-35)21-25-43(2)23-19-31-11-5-7-13-37(31)41(39)43/h4-7,10-17,28-29,40-41H,3,8-9,18-27H2,1-2H3/q+2 SMOUFAGGAGLPGE-UHFFFAOYSA-N 50317088 7-methyl-3-({5-[(7-methyl-5,8,9,13b-tetrahydro-6H-isoquino[1,2-a]isoquinolinium-3-yl)oxy]pentyl}oxy)-5,8,9,13b-tetrahydro-6H-isoquino[1,2-a]isoquinolinium diiodide::CHEMBL1099383 Cholinesterase 47 ChEMBL 10.1016/j.bmcl.2010.03.011 10.7270/Q22808KX 20350808 Schulze, M; Siol, O; Decker, M; Lehmann, J Friedrich-Schiller-Universit£t Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317088 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317088&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46889189 104151449 CHEMBL1099383 ZINC49783764 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50912076 C[N+]12CCc3ccccc3C1c1ccc(OCCCCCCOc3ccc4C5c6ccccc6CC[N+]5(C)CCc4c3)cc1CC2 InChI=1S/C42H50N2O2/c1-43-23-19-31-11-5-7-13-37(31)41(43)39-17-15-35(29-33(39)21-25-43)45-27-9-3-4-10-28-46-36-16-18-40-34(30-36)22-26-44(2)24-20-32-12-6-8-14-38(32)42(40)44/h5-8,11-18,29-30,41-42H,3-4,9-10,19-28H2,1-2H3/q+2 IDKSCGSLZJPHGN-UHFFFAOYSA-N 50317080 7-methyl-3-({6-[(7-methyl-5,8,9,13b-tetrahydro-6H-isoquino[1,2-a]isoquinolinium-3-yl)oxy]hexyl}oxy)-5,8,9,13b-tetrahydro-6H-isoquino[1,2-a]isoquinolinium diiodide::CHEMBL1099384 Cholinesterase 27 ChEMBL 10.1016/j.bmcl.2010.03.011 10.7270/Q22808KX 20350808 Schulze, M; Siol, O; Decker, M; Lehmann, J Friedrich-Schiller-Universit£t Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317080 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317080&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46889191 104151441 CHEMBL1099384 ZINC49784093 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50912077 C[N+]12CCc3ccccc3C1c1ccc(OCCCCCCCCOc3ccc4C5c6ccccc6CC[N+]5(C)CCc4c3)cc1CC2 InChI=1S/C44H54N2O2/c1-45-25-21-33-13-7-9-15-39(33)43(45)41-19-17-37(31-35(41)23-27-45)47-29-11-5-3-4-6-12-30-48-38-18-20-42-36(32-38)24-28-46(2)26-22-34-14-8-10-16-40(34)44(42)46/h7-10,13-20,31-32,43-44H,3-6,11-12,21-30H2,1-2H3/q+2 SCZOPTBMQBAZQB-UHFFFAOYSA-N 50317077 7-methyl-3-({8-[(7-methyl-5,8,9,13b-tetrahydro-6H-isoquino[1,2-a]isoquinolinium-3-yl)oxy]octyl}oxy)-5,8,9,13b-tetrahydro-6H-isoquino[1,2-a]isoquinolinium diiodide::CHEMBL1099385 Cholinesterase 110 ChEMBL 10.1016/j.bmcl.2010.03.011 10.7270/Q22808KX 20350808 Schulze, M; Siol, O; Decker, M; Lehmann, J Friedrich-Schiller-Universit£t Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317077 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317077&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46889193 104151438 CHEMBL1099385 ZINC49780212 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50912078 C[N+]12CCc3ccccc3C1c1ccc(OCCCCCCCCCCCCOc3ccc4C5c6ccccc6CC[N+]5(C)CCc4c3)cc1CC2 InChI=1S/C48H62N2O2/c1-49-29-25-37-17-11-13-19-43(37)47(49)45-23-21-41(35-39(45)27-31-49)51-33-15-9-7-5-3-4-6-8-10-16-34-52-42-22-24-46-40(36-42)28-32-50(2)30-26-38-18-12-14-20-44(38)48(46)50/h11-14,17-24,35-36,47-48H,3-10,15-16,25-34H2,1-2H3/q+2 MRILNLAGSIYBMM-UHFFFAOYSA-N 50317089 7-methyl-3-({12-[(7-methyl-5,8,9,13b-tetrahydro-6H-isoquino[1,2-a]isoquinolinium-3-yl)oxy]dodecyl}oxy)-5,8,9,13b-tetrahydro-6H-isoquino[1,2-a]isoquinolinium diiodide::CHEMBL1099386 Cholinesterase 36 ChEMBL 10.1016/j.bmcl.2010.03.011 10.7270/Q22808KX 20350808 Schulze, M; Siol, O; Decker, M; Lehmann, J Friedrich-Schiller-Universit£t Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317089 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317089&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46889195 104151450 CHEMBL1099386 ZINC49792797 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50912079 CN1CCc2ccccc2Cc2ccc(OCCCOc3ccc4Cc5ccccc5CCN(C)CCc4c3)cc2CC1 InChI=1S/C39H46N2O2/c1-40-20-16-30-8-3-5-10-32(30)26-34-12-14-38(28-36(34)18-22-40)42-24-7-25-43-39-15-13-35-27-33-11-6-4-9-31(33)17-21-41(2)23-19-37(35)29-39/h3-6,8-15,28-29H,7,16-27H2,1-2H3 OGFANFTYHBKIPN-UHFFFAOYSA-N 50317090 7-methyl-3-{4-[(7-methyl-5,6,7,8,9,14-hexahydrodibenzo[d,g]azecin-3-yl)oxy]butoxy}-5,6,7,8,9,14-hexahydrodibenzo[d,g]azecine::CHEMBL1099387 Cholinesterase 140 ChEMBL 10.1016/j.bmcl.2010.03.011 10.7270/Q22808KX 20350808 Schulze, M; Siol, O; Decker, M; Lehmann, J Friedrich-Schiller-Universit£t Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317090 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317090&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46889197 104151451 CHEMBL1099387 ZINC49803067 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50912080 CN1CCc2ccccc2Cc2ccc(OCCCCCCCCOc3ccc4Cc5ccccc5CCN(C)CCc4c3)cc2CC1 InChI=1S/C44H56N2O2/c1-45-25-21-35-13-7-9-15-37(35)31-39-17-19-43(33-41(39)23-27-45)47-29-11-5-3-4-6-12-30-48-44-20-18-40-32-38-16-10-8-14-36(38)22-26-46(2)28-24-42(40)34-44/h7-10,13-20,33-34H,3-6,11-12,21-32H2,1-2H3 XUHIMIGMTWKPCU-UHFFFAOYSA-N 50317091 7-methyl-3-{4-[(7-methyl-5,6,7,8,9,14-hexahydrodibenzo[d,g]azecin-3-yl)oxy]octyl}-5,6,7,8,9,14-hexahydrodibenzo[d,g]azecine::CHEMBL1099388 Cholinesterase 210 ChEMBL 10.1016/j.bmcl.2010.03.011 10.7270/Q22808KX 20350808 Schulze, M; Siol, O; Decker, M; Lehmann, J Friedrich-Schiller-Universit£t Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317091 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317091&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46889198 104151452 CHEMBL1099388 ZINC49780213 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50913359 CCOC(=O)c1cc2c(N)c3CCCc3nc2nc1C InChI=1S/C15H17N3O2/c1-3-20-15(19)10-7-11-13(16)9-5-4-6-12(9)18-14(11)17-8(10)2/h7H,3-6H2,1-2H3,(H2,16,17,18) KEQYWVWFPKVEHO-UHFFFAOYSA-N 50318702 CHEMBL1084518::Ethyl 5-Amino-2-methyl-7,8-dihydro-6H-cyclopenta[b][1,8]-naphthyridine-3-carboxylate Cholinesterase 39000 ChEMBL 10.1021/jm901902w 10.7270/Q25T3MFV 20575555 de Los Rios, C; Egea, J; Marco-Contelles, J; Leon, R; Samadi, A; Iriepa, I; Moraleda, I; Galvez, E; Garcia, AG; Lopez, MG; Villarroya, M; Romero, A Universidad Autonoma de Madrid http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50318702 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50318702&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46867382 104153063 CHEMBL1084518 ZINC49111578 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50913361 CCOC(=O)c1cc2c(N)c3CCCCc3nc2nc1C InChI=1S/C16H19N3O2/c1-3-21-16(20)11-8-12-14(17)10-6-4-5-7-13(10)19-15(12)18-9(11)2/h8H,3-7H2,1-2H3,(H2,17,18,19) XGQUEKANWWMGAJ-UHFFFAOYSA-N 50317074 CHEMBL1087194::ethyl 5-amino-2-methyl-6,7,8,9-tetrahydrobenzo[b][1,8]naphthyridine-3-carboxylate Cholinesterase 12000 ChEMBL 10.1021/jm901902w 10.7270/Q25T3MFV 20575555 de Los Rios, C; Egea, J; Marco-Contelles, J; Leon, R; Samadi, A; Iriepa, I; Moraleda, I; Galvez, E; Garcia, AG; Lopez, MG; Villarroya, M; Romero, A Universidad Autonoma de Madrid http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50317074 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50317074&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46861819 104151435 CHEMBL1087194 ZINC49053372 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50913362 COC(=O)c1cc2c(N)c3CCCc3nc2nc1C InChI=1S/C14H15N3O2/c1-7-9(14(18)19-2)6-10-12(15)8-4-3-5-11(8)17-13(10)16-7/h6H,3-5H2,1-2H3,(H2,15,16,17) MQPBTVIMKAUQQC-UHFFFAOYSA-N 50318703 CHEMBL1083972::Methyl 5-Amino-2-methyl-7,8-dihydro-6H-cyclopenta-[b][1,8]naphthyridine-3-carboxylate Cholinesterase 5000 ChEMBL 10.1021/jm901902w 10.7270/Q25T3MFV 20575555 de Los Rios, C; Egea, J; Marco-Contelles, J; Leon, R; Samadi, A; Iriepa, I; Moraleda, I; Galvez, E; Garcia, AG; Lopez, MG; Villarroya, M; Romero, A Universidad Autonoma de Madrid http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50318703 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50318703&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46867253 104153064 CHEMBL1083972 ZINC49089981 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50913363 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 12000 ChEMBL 10.1021/jm901902w 10.7270/Q25T3MFV 20575555 de Los Rios, C; Egea, J; Marco-Contelles, J; Leon, R; Samadi, A; Iriepa, I; Moraleda, I; Galvez, E; Garcia, AG; Lopez, MG; Villarroya, M; Romero, A Universidad Autonoma de Madrid http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50913364 CCOC(=O)c1c(C)nc2nc3CCCCc3c(N)c2c1-c1ccccc1 InChI=1S/C22H23N3O2/c1-3-27-22(26)17-13(2)24-21-19(18(17)14-9-5-4-6-10-14)20(23)15-11-7-8-12-16(15)25-21/h4-6,9-10H,3,7-8,11-12H2,1-2H3,(H2,23,24,25) UNCWLZOGXZCOJG-UHFFFAOYSA-N 50241350 5-Amino-2-methyl-4-phenyl-6,7,8,9-tetrahydro-benzo[b][1,8]naphthyridine-3-carboxylic acid ethyl ester::CHEMBL253386::ethyl 5-amino-2-methyl-4-phenyl-6,7,8,9-tetrahydrobenzo[b][1,8]naphthyridine-3-carboxylate Cholinesterase 5000 ChEMBL 10.1021/jm901902w 10.7270/Q25T3MFV 20575555 de Los Rios, C; Egea, J; Marco-Contelles, J; Leon, R; Samadi, A; Iriepa, I; Moraleda, I; Galvez, E; Garcia, AG; Lopez, MG; Villarroya, M; Romero, A Universidad Autonoma de Madrid http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50241350 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50241350&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 6918662 104098734 CHEMBL253386 ZINC28968810 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50913365 CCOC(=O)c1cc2c(N)c3CCCCCCc3nc2nc1C InChI=1S/C18H23N3O2/c1-3-23-18(22)13-10-14-16(19)12-8-6-4-5-7-9-15(12)21-17(14)20-11(13)2/h10H,3-9H2,1-2H3,(H2,19,20,21) LQZDBOQHVFTGOE-UHFFFAOYSA-N 50318704 CHEMBL1084519::Ethyl 5-Amino-2-methyl-6,7,8,9,10,11-hexahydrocycloocta-[b][1,8]naphthyridine-3-carboxylate Cholinesterase 5300 ChEMBL 10.1021/jm901902w 10.7270/Q25T3MFV 20575555 de Los Rios, C; Egea, J; Marco-Contelles, J; Leon, R; Samadi, A; Iriepa, I; Moraleda, I; Galvez, E; Garcia, AG; Lopez, MG; Villarroya, M; Romero, A Universidad Autonoma de Madrid http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50318704 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50318704&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46867384 104153065 CHEMBL1084519 ZINC49035928 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50913366 COC(=O)c1cc2c(N)c3CCCCc3nc2nc1C InChI=1S/C15H17N3O2/c1-8-10(15(19)20-2)7-11-13(16)9-5-3-4-6-12(9)18-14(11)17-8/h7H,3-6H2,1-2H3,(H2,16,17,18) FQFLQQWHOCNXQY-UHFFFAOYSA-N 50318705 CHEMBL1086184::Methyl 5-Amino-2-methyl-6,7,8,9-tetrahydrobenzo[b][1,8]naphthyridine-3-carboxylate Cholinesterase 3400 ChEMBL 10.1021/jm901902w 10.7270/Q25T3MFV 20575555 de Los Rios, C; Egea, J; Marco-Contelles, J; Leon, R; Samadi, A; Iriepa, I; Moraleda, I; Galvez, E; Garcia, AG; Lopez, MG; Villarroya, M; Romero, A Universidad Autonoma de Madrid http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50318705 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50318705&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46867254 104153066 CHEMBL1086184 ZINC49048778 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50913369 CCOC(=O)c1cc2c(N)c3CCCCCc3nc2nc1C InChI=1S/C17H21N3O2/c1-3-22-17(21)12-9-13-15(18)11-7-5-4-6-8-14(11)20-16(13)19-10(12)2/h9H,3-8H2,1-2H3,(H2,18,19,20) KTSROZJJBCCRGO-UHFFFAOYSA-N 50318706 CHEMBL1083973::Ethyl 5-Amino-2-methyl-7,8,9,10-tetrahydro-6H-cyclohepta-[b][1,8]naphthyridine-3-carboxylate Cholinesterase 2100 ChEMBL 10.1021/jm901902w 10.7270/Q25T3MFV 20575555 de Los Rios, C; Egea, J; Marco-Contelles, J; Leon, R; Samadi, A; Iriepa, I; Moraleda, I; Galvez, E; Garcia, AG; Lopez, MG; Villarroya, M; Romero, A Universidad Autonoma de Madrid http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50318706 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50318706&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46867383 104153067 CHEMBL1083973 ZINC49036817 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50913378 COC(=O)c1cc2c(N)c3CCCCCCc3nc2nc1C InChI=1S/C17H21N3O2/c1-10-12(17(21)22-2)9-13-15(18)11-7-5-3-4-6-8-14(11)20-16(13)19-10/h9H,3-8H2,1-2H3,(H2,18,19,20) MJNRKJNEVQCSGU-UHFFFAOYSA-N 50318708 CHEMBL1084517::Methyl 5-Amino-2-methyl-6,7,8,9,10,11-hexahydrocycloocta-[b][1,8]naphthyridine-3-carboxylate Cholinesterase 4070 ChEMBL 10.1021/jm901902w 10.7270/Q25T3MFV 20575555 de Los Rios, C; Egea, J; Marco-Contelles, J; Leon, R; Samadi, A; Iriepa, I; Moraleda, I; Galvez, E; Garcia, AG; Lopez, MG; Villarroya, M; Romero, A Universidad Autonoma de Madrid http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50318708 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50318708&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46867256 104153069 CHEMBL1084517 ZINC49035610 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50913381 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 840 ChEMBL 10.1021/jm901902w 10.7270/Q25T3MFV 20575555 de Los Rios, C; Egea, J; Marco-Contelles, J; Leon, R; Samadi, A; Iriepa, I; Moraleda, I; Galvez, E; Garcia, AG; Lopez, MG; Villarroya, M; Romero, A Universidad Autonoma de Madrid http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50913386 COC(=O)c1cc2c(N)c3CCCCCc3nc2nc1C InChI=1S/C16H19N3O2/c1-9-11(16(20)21-2)8-12-14(17)10-6-4-3-5-7-13(10)19-15(12)18-9/h8H,3-7H2,1-2H3,(H2,17,18,19) BMMDNFSOYOPLJH-UHFFFAOYSA-N 50318707 CHEMBL1084250::Methyl 5-Amino-2-methyl-7,8,9,10-tetrahydro-6H-cyclohepta-[b][1,8]naphthyridine-3-carboxylate Cholinesterase 490 ChEMBL 10.1021/jm901902w 10.7270/Q25T3MFV 20575555 de Los Rios, C; Egea, J; Marco-Contelles, J; Leon, R; Samadi, A; Iriepa, I; Moraleda, I; Galvez, E; Garcia, AG; Lopez, MG; Villarroya, M; Romero, A Universidad Autonoma de Madrid http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50318707 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50318707&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46867255 104153068 CHEMBL1084250 ZINC49036187 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50913403 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 5.2 ChEMBL 10.1021/jm901902w 10.7270/Q25T3MFV 20575555 de Los Rios, C; Egea, J; Marco-Contelles, J; Leon, R; Samadi, A; Iriepa, I; Moraleda, I; Galvez, E; Garcia, AG; Lopez, MG; Villarroya, M; Romero, A Universidad Autonoma de Madrid http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50908507 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 24400 ChEMBL 10.1016/j.bmc.2010.01.074 10.7270/Q2R78G5X 20176490 Geissler, T; Brandt, W; Porzel, A; Schlenzig, D; Kehlen, A; Wessjohann, L; Arnold, N Institute of Plant Biochemistry http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50908508 CNC(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1 InChI=1S/C15H21N3O2/c1-15-7-8-17(3)13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2/h5-6,9,13H,7-8H2,1-4H3,(H,16,19)/t13-,15+/m1/s1 PIJVFDBKTWXHHD-HIFRSBDPSA-N 50004000 (3aS,8aR)-1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol-5-yl methylcarbamate::Antilirium::CHEMBL94::Eserine::Physostol::physostigmine Cholinesterase 1340 ChEMBL 10.1016/j.bmc.2010.01.074 10.7270/Q2R78G5X 20176490 Geissler, T; Brandt, W; Porzel, A; Schlenzig, D; Kehlen, A; Wessjohann, L; Arnold, N Institute of Plant Biochemistry http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50004000 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50004000&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5983 103917788 27953 CHEMBL94 DB00981 6598 C06535 ZINC33971762 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50908509 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 10 ChEMBL 10.1016/j.bmc.2010.01.074 10.7270/Q2R78G5X 20176490 Geissler, T; Brandt, W; Porzel, A; Schlenzig, D; Kehlen, A; Wessjohann, L; Arnold, N Institute of Plant Biochemistry http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928245 COc1cc2oc(cc(=O)c2cc1OC)C(=O)NCCCCCCCCCCNc1c2CCCCc2nc2cc(Cl)ccc12 InChI=1S/C35H42ClN3O5/c1-42-31-20-26-29(40)21-33(44-30(26)22-32(31)43-2)35(41)38-18-12-8-6-4-3-5-7-11-17-37-34-24-13-9-10-14-27(24)39-28-19-23(36)15-16-25(28)34/h15-16,19-22H,3-14,17-18H2,1-2H3,(H,37,39)(H,38,41) KBYFEQRBOAAMSZ-UHFFFAOYSA-N 50380550 CHEMBL2019041 Cholinesterase 0.85 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380550 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380550&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56955097 160859633 CHEMBL2019041 ZINC84632034 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50930774 C(CCOc1ccc(cc1)-c1nc2ccccc2o1)CNc1c2CCCCc2nc2ccccc12 InChI=1S/C30H29N3O2/c1-3-11-25-23(9-1)29(24-10-2-4-12-26(24)32-25)31-19-7-8-20-34-22-17-15-21(16-18-22)30-33-27-13-5-6-14-28(27)35-30/h1,3,5-6,9,11,13-18H,2,4,7-8,10,12,19-20H2,(H,31,32) YHCYQLHQCIGVDK-UHFFFAOYSA-N 50381836 CHEMBL2022048 Cholinesterase 207 ChEMBL 10.1016/j.bmc.2012.02.059 10.7270/Q2G161V6 22472046 Huang, L; Su, T; Shan, W; Luo, Z; Sun, Y; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50381836 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50381836&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70685526 160860919 CHEMBL2022048 ZINC84602823 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50930794 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OC InChI=1S/C20H18NO4/c1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2/h3-4,7-10H,5-6,11H2,1-2H3/q+1 YBHILYKTIRIUTE-UHFFFAOYSA-N 50203126 3,4-dimethoxy-6,7-dihydro-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinolin-5-ylium::9,10-Dimethoxy-5,6-dihydro-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ylium::9,10-Dimethoxy-5,6-dihydro-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ylium chloride::9,10-dimethoxy-5,6-dihydro-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ylium; chloride::BERBERINE::Berberinechloride::CHEMBL12089::berberine dimer::cid_12456 Cholinesterase 18200 ChEMBL 10.1016/j.bmc.2012.02.059 10.7270/Q2G161V6 22472046 Huang, L; Su, T; Shan, W; Luo, Z; Sun, Y; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50203126 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50203126&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search BER 7A3Y,1JUM,6JWD,3R6R,3VW2,4DBK,3BTI,7MSV,7X8M,3NP6,3D6Y,7X32,5Y0V,2QVD,7C34,7N7D,7N7E 12456 104082463 16118 CHEMBL12089 DB04115 C00757 ZINC03779067 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50930795 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCOc1ccc(cc1)-c1cc2ccccc2o1 InChI=1S/C35H28NO6/c1-37-31-11-8-23-16-29-27-19-34-33(40-21-41-34)17-24(27)12-13-36(29)20-28(23)35(31)39-15-14-38-26-9-6-22(7-10-26)32-18-25-4-2-3-5-30(25)42-32/h2-11,16-20H,12-15,21H2,1H3/q+1 UVVUDKUDTQSDGP-UHFFFAOYSA-N 50381837 CHEMBL2024053 Cholinesterase 688 ChEMBL 10.1016/j.bmc.2012.02.059 10.7270/Q2G161V6 22472046 Huang, L; Su, T; Shan, W; Luo, Z; Sun, Y; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50381837 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50381837&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70692001 160860920 CHEMBL2024053 ZINC84596571 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50930796 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCOc1ccc(cc1)-c1cc2ccccc2o1 InChI=1S/C36H30NO6/c1-38-32-12-9-24-17-30-28-20-35-34(41-22-42-35)18-25(28)13-14-37(30)21-29(24)36(32)40-16-4-15-39-27-10-7-23(8-11-27)33-19-26-5-2-3-6-31(26)43-33/h2-3,5-12,17-21H,4,13-16,22H2,1H3/q+1 GCHQCIMIQVSYSE-UHFFFAOYSA-N 50381838 CHEMBL2024054 Cholinesterase 990 ChEMBL 10.1016/j.bmc.2012.02.059 10.7270/Q2G161V6 22472046 Huang, L; Su, T; Shan, W; Luo, Z; Sun, Y; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50381838 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50381838&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70689846 160860921 CHEMBL2024054 ZINC84616777 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50930797 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCOc1ccc(cc1)-c1cc2ccccc2[nH]1 InChI=1S/C35H29N2O5/c1-38-32-11-8-23-17-31-27-19-34-33(41-21-42-34)18-24(27)12-13-37(31)20-28(23)35(32)40-15-14-39-26-9-6-22(7-10-26)30-16-25-4-2-3-5-29(25)36-30/h2-11,16-20,36H,12-15,21H2,1H3/q+1 TXENCERHUHLVCL-UHFFFAOYSA-N 50381839 CHEMBL2024055 Cholinesterase 421 ChEMBL 10.1016/j.bmc.2012.02.059 10.7270/Q2G161V6 22472046 Huang, L; Su, T; Shan, W; Luo, Z; Sun, Y; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50381839 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50381839&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70689848 160860922 CHEMBL2024055 ZINC84616780 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50930798 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCOc1ccc(cc1)-c1cc2ccccc2[nH]1 InChI=1S/C36H31N2O5/c1-39-33-12-9-24-18-32-28-20-35-34(42-22-43-35)19-25(28)13-14-38(32)21-29(24)36(33)41-16-4-15-40-27-10-7-23(8-11-27)31-17-26-5-2-3-6-30(26)37-31/h2-3,5-12,17-21,37H,4,13-16,22H2,1H3/q+1 PEVGGKJDMNPGDS-UHFFFAOYSA-N 50381840 CHEMBL2024056 Cholinesterase 711 ChEMBL 10.1016/j.bmc.2012.02.059 10.7270/Q2G161V6 22472046 Huang, L; Su, T; Shan, W; Luo, Z; Sun, Y; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50381840 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50381840&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70694033 160860923 CHEMBL2024056 ZINC84619775 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50930799 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCOc1ccc(cc1)-c1nc2ccccc2s1 InChI=1S/C34H27N2O5S/c1-37-29-11-8-22-16-28-25-18-31-30(40-20-41-31)17-23(25)12-13-36(28)19-26(22)33(29)39-15-14-38-24-9-6-21(7-10-24)34-35-27-4-2-3-5-32(27)42-34/h2-11,16-19H,12-15,20H2,1H3/q+1 ATHHBZPCKLUBMD-UHFFFAOYSA-N 50381841 CHEMBL2024057 Cholinesterase 175 ChEMBL 10.1016/j.bmc.2012.02.059 10.7270/Q2G161V6 22472046 Huang, L; Su, T; Shan, W; Luo, Z; Sun, Y; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50381841 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50381841&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70685657 160860924 CHEMBL2024057 ZINC84619778 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50930800 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCOc1ccc(cc1)-c1nc2ccccc2s1 InChI=1S/C35H29N2O5S/c1-38-30-12-9-23-17-29-26-19-32-31(41-21-42-32)18-24(26)13-14-37(29)20-27(23)34(30)40-16-4-15-39-25-10-7-22(8-11-25)35-36-28-5-2-3-6-33(28)43-35/h2-3,5-12,17-20H,4,13-16,21H2,1H3/q+1 CDXCQCNVSRRUCF-UHFFFAOYSA-N 50381842 CHEMBL2024058 Cholinesterase 587 ChEMBL 10.1016/j.bmc.2012.02.059 10.7270/Q2G161V6 22472046 Huang, L; Su, T; Shan, W; Luo, Z; Sun, Y; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50381842 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50381842&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70696164 160860925 CHEMBL2024058 ZINC84596572 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50930801 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCOc1ccc(cc1)-c1nc2ccccc2o1 InChI=1S/C34H27N2O6/c1-37-30-11-8-22-16-28-25-18-32-31(40-20-41-32)17-23(25)12-13-36(28)19-26(22)33(30)39-15-14-38-24-9-6-21(7-10-24)34-35-27-4-2-3-5-29(27)42-34/h2-11,16-19H,12-15,20H2,1H3/q+1 DQZVPTNJOCBERV-UHFFFAOYSA-N 50381843 CHEMBL2024059 Cholinesterase 346 ChEMBL 10.1016/j.bmc.2012.02.059 10.7270/Q2G161V6 22472046 Huang, L; Su, T; Shan, W; Luo, Z; Sun, Y; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50381843 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50381843&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70683553 160860926 CHEMBL2024059 ZINC84617659 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50930802 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCOc1ccc(cc1)-c1nc2ccccc2o1 InChI=1S/C35H29N2O6/c1-38-31-12-9-23-17-29-26-19-33-32(41-21-42-33)18-24(26)13-14-37(29)20-27(23)34(31)40-16-4-15-39-25-10-7-22(8-11-25)35-36-28-5-2-3-6-30(28)43-35/h2-3,5-12,17-20H,4,13-16,21H2,1H3/q+1 RXYYOMFBFZYPJM-UHFFFAOYSA-N 50381844 CHEMBL2022040 Cholinesterase 639 ChEMBL 10.1016/j.bmc.2012.02.059 10.7270/Q2G161V6 22472046 Huang, L; Su, T; Shan, W; Luo, Z; Sun, Y; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50381844 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50381844&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70696040 160860927 CHEMBL2022040 ZINC84617789 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50930803 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCNC(=O)c1cc2ccccc2[nH]1 InChI=1S/C31H27N3O5/c1-36-27-8-7-19-14-26-22-16-29-28(38-18-39-29)15-20(22)9-11-34(26)17-23(19)30(27)37-12-4-10-32-31(35)25-13-21-5-2-3-6-24(21)33-25/h2-3,5-8,13-17H,4,9-12,18H2,1H3,(H-,32,33,35)/p+1 HOXNYQNSOJGJFW-UHFFFAOYSA-O 50381845 CHEMBL2022041 Cholinesterase 2190 ChEMBL 10.1016/j.bmc.2012.02.059 10.7270/Q2G161V6 22472046 Huang, L; Su, T; Shan, W; Luo, Z; Sun, Y; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50381845 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50381845&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70683425 160860928 CHEMBL2022041 ZINC84617403 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50930804 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCNC(=O)c1cc2ccccc2o1 InChI=1S/C31H26N2O6/c1-35-26-8-7-19-13-24-22-16-28-27(37-18-38-28)14-20(22)9-11-33(24)17-23(19)30(26)36-12-4-10-32-31(34)29-15-21-5-2-3-6-25(21)39-29/h2-3,5-8,13-17H,4,9-12,18H2,1H3/p+1 OADNPODGBVAEKS-UHFFFAOYSA-O 50381846 CHEMBL2022042 Cholinesterase 1540 ChEMBL 10.1016/j.bmc.2012.02.059 10.7270/Q2G161V6 22472046 Huang, L; Su, T; Shan, W; Luo, Z; Sun, Y; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50381846 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50381846&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70687678 160860929 CHEMBL2022042 ZINC84603632 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50930805 C(CNc1c2CCCCc2nc2ccccc12)COc1ccc(cc1)-c1nc2ccccc2s1 InChI=1S/C29H27N3OS/c1-3-10-24-22(8-1)28(23-9-2-4-11-25(23)31-24)30-18-7-19-33-21-16-14-20(15-17-21)29-32-26-12-5-6-13-27(26)34-29/h1,3,5-6,8,10,12-17H,2,4,7,9,11,18-19H2,(H,30,31) BJQCJAULYUZFRK-UHFFFAOYSA-N 50381847 CHEMBL2022043 Cholinesterase 122 ChEMBL 10.1016/j.bmc.2012.02.059 10.7270/Q2G161V6 22472046 Huang, L; Su, T; Shan, W; Luo, Z; Sun, Y; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50381847 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50381847&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70687679 160860930 CHEMBL2022043 ZINC84603634 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50930806 C(CCOc1ccc(cc1)-c1nc2ccccc2s1)CNc1c2CCCCc2nc2ccccc12 InChI=1S/C30H29N3OS/c1-3-11-25-23(9-1)29(24-10-2-4-12-26(24)32-25)31-19-7-8-20-34-22-17-15-21(16-18-22)30-33-27-13-5-6-14-28(27)35-30/h1,3,5-6,9,11,13-18H,2,4,7-8,10,12,19-20H2,(H,31,32) YXWVBFKCXKOMOU-UHFFFAOYSA-N 50381848 CHEMBL2022044 Cholinesterase 186 ChEMBL 10.1016/j.bmc.2012.02.059 10.7270/Q2G161V6 22472046 Huang, L; Su, T; Shan, W; Luo, Z; Sun, Y; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50381848 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50381848&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 60150405 160860931 CHEMBL2022044 ZINC84603638 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50930807 C(CCNc1c2CCCCc2nc2ccccc12)CCOc1ccc(cc1)-c1nc2ccccc2s1 InChI=1S/C31H31N3OS/c1(8-20-32-30-24-10-2-4-12-26(24)33-27-13-5-3-11-25(27)30)9-21-35-23-18-16-22(17-19-23)31-34-28-14-6-7-15-29(28)36-31/h2,4,6-7,10,12,14-19H,1,3,5,8-9,11,13,20-21H2,(H,32,33) XLZHVECYNBOUAN-UHFFFAOYSA-N 50381849 CHEMBL2022045 Cholinesterase 171 ChEMBL 10.1016/j.bmc.2012.02.059 10.7270/Q2G161V6 22472046 Huang, L; Su, T; Shan, W; Luo, Z; Sun, Y; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50381849 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50381849&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70696041 160860932 CHEMBL2022045 ZINC84616505 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50930808 C(CCCOc1ccc(cc1)-c1nc2ccccc2s1)CCNc1c2CCCCc2nc2ccccc12 InChI=1S/C32H33N3OS/c1(9-21-33-31-25-11-3-5-13-27(25)34-28-14-6-4-12-26(28)31)2-10-22-36-24-19-17-23(18-20-24)32-35-29-15-7-8-16-30(29)37-32/h3,5,7-8,11,13,15-20H,1-2,4,6,9-10,12,14,21-22H2,(H,33,34) JWYPYYYWTOWHTP-UHFFFAOYSA-N 50381850 CHEMBL2022046 Cholinesterase 82 ChEMBL 10.1016/j.bmc.2012.02.059 10.7270/Q2G161V6 22472046 Huang, L; Su, T; Shan, W; Luo, Z; Sun, Y; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50381850 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50381850&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70696042 160860933 CHEMBL2022046 ZINC84616507 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50930809 C(CNc1c2CCCCc2nc2ccccc12)COc1ccc(cc1)-c1nc2ccccc2o1 InChI=1S/C29H27N3O2/c1-3-10-24-22(8-1)28(23-9-2-4-11-25(23)31-24)30-18-7-19-33-21-16-14-20(15-17-21)29-32-26-12-5-6-13-27(26)34-29/h1,3,5-6,8,10,12-17H,2,4,7,9,11,18-19H2,(H,30,31) NKOMTERCWGMQCG-UHFFFAOYSA-N 50381851 CHEMBL2022047 Cholinesterase 352 ChEMBL 10.1016/j.bmc.2012.02.059 10.7270/Q2G161V6 22472046 Huang, L; Su, T; Shan, W; Luo, Z; Sun, Y; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50381851 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50381851&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70696043 160860934 CHEMBL2022047 ZINC84616509 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50930810 C(CNc1c2CCCCc2nc2ccccc12)COc1ccc(cc1)-c1cc2ccccc2o1 InChI=1S/C30H28N2O2/c1-6-13-28-22(8-1)20-29(34-28)21-14-16-23(17-15-21)33-19-7-18-31-30-24-9-2-4-11-26(24)32-27-12-5-3-10-25(27)30/h1-2,4,6,8-9,11,13-17,20H,3,5,7,10,12,18-19H2,(H,31,32) JAXROAFWCPTPKQ-UHFFFAOYSA-N 50381835 CHEMBL2022049 Cholinesterase 156 ChEMBL 10.1016/j.bmc.2012.02.059 10.7270/Q2G161V6 22472046 Huang, L; Su, T; Shan, W; Luo, Z; Sun, Y; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50381835 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50381835&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70691877 160860918 CHEMBL2022049 ZINC84602825 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50930811 C(CCOc1ccc(cc1)-c1cc2ccccc2o1)CNc1c2CCCCc2nc2ccccc12 InChI=1S/C31H30N2O2/c1-6-14-29-23(9-1)21-30(35-29)22-15-17-24(18-16-22)34-20-8-7-19-32-31-25-10-2-4-12-27(25)33-28-13-5-3-11-26(28)31/h1-2,4,6,9-10,12,14-18,21H,3,5,7-8,11,13,19-20H2,(H,32,33) RHYMVIZTSVCCBT-UHFFFAOYSA-N 50381852 CHEMBL2022050 Cholinesterase 238 ChEMBL 10.1016/j.bmc.2012.02.059 10.7270/Q2G161V6 22472046 Huang, L; Su, T; Shan, W; Luo, Z; Sun, Y; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50381852 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50381852&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70691878 160860935 CHEMBL2022050 ZINC84603927 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50930812 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 41 ChEMBL 10.1016/j.bmc.2012.02.059 10.7270/Q2G161V6 22472046 Huang, L; Su, T; Shan, W; Luo, Z; Sun, Y; He, F; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50937487 CC(=O)Nc1nn(C)c2nc3nc4CCCCc4c(N)c3c(-c3ccccc3)c12 InChI=1S/C22H22N6O/c1-12(29)24-21-18-16(13-8-4-3-5-9-13)17-19(23)14-10-6-7-11-15(14)25-20(17)26-22(18)28(2)27-21/h3-5,8-9H,6-7,10-11H2,1-2H3,(H2,23,25,26)(H,24,27,29) PZSHLPQCHOCYHD-UHFFFAOYSA-N 50384792 CHEMBL2037385 Cholinesterase 9000 ChEMBL 10.1016/j.ejmech.2011.05.068 10.7270/Q24T6KDT 21715067 Silva, D; Chioua, M; Samadi, A; Carmo Carreiras, M; Jimeno, ML; Mendes, E; Rios, Cde L; Romero, A; Villarroya, M; Lopez, MG; Marco-Contelles, J University of Lisbon http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50384792 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50384792&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54771189 160863875 CHEMBL2037385 ZINC84706532 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50937488 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 5.2 ChEMBL 10.1016/j.ejmech.2011.05.068 10.7270/Q24T6KDT 21715067 Silva, D; Chioua, M; Samadi, A; Carmo Carreiras, M; Jimeno, ML; Mendes, E; Rios, Cde L; Romero, A; Villarroya, M; Lopez, MG; Marco-Contelles, J University of Lisbon http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50937497 Cn1nc2nc3CCCCc3c(N)c2c1C#N InChI=1S/C12H13N5/c1-17-9(6-13)10-11(14)7-4-2-3-5-8(7)15-12(10)16-17/h2-5,14H2,1H3 NBUJCQAOSFFRTN-UHFFFAOYSA-N 50384794 CHEMBL2037380 Cholinesterase 100000 ChEMBL 10.1016/j.ejmech.2011.05.068 10.7270/Q24T6KDT 21715067 Silva, D; Chioua, M; Samadi, A; Carmo Carreiras, M; Jimeno, ML; Mendes, E; Rios, Cde L; Romero, A; Villarroya, M; Lopez, MG; Marco-Contelles, J University of Lisbon http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50384794 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50384794&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54770956 160863877 CHEMBL2037380 ZINC84704602 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50937498 Cn1nc(C#N)c2c(N)c3CCCCc3nc12 InChI=1S/C12H13N5/c1-17-12-10(9(6-13)16-17)11(14)7-4-2-3-5-8(7)15-12/h2-5H2,1H3,(H2,14,15) CGKXGJMAXAJZKA-UHFFFAOYSA-N 50384795 CHEMBL2037381 Cholinesterase 6300 ChEMBL 10.1016/j.ejmech.2011.05.068 10.7270/Q24T6KDT 21715067 Silva, D; Chioua, M; Samadi, A; Carmo Carreiras, M; Jimeno, ML; Mendes, E; Rios, Cde L; Romero, A; Villarroya, M; Lopez, MG; Marco-Contelles, J University of Lisbon http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50384795 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50384795&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54770957 160863878 CHEMBL2037381 ZINC84652101 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50937499 Cn1nc2nc3CCCCc3c(N)c2c1C(N)=O InChI=1S/C12H15N5O/c1-17-10(11(14)18)8-9(13)6-4-2-3-5-7(6)15-12(8)16-17/h2-5,13H2,1H3,(H2,14,18) ASCKNMABNCOUMH-UHFFFAOYSA-N 50384796 CHEMBL2037382 Cholinesterase 5400 ChEMBL 10.1016/j.ejmech.2011.05.068 10.7270/Q24T6KDT 21715067 Silva, D; Chioua, M; Samadi, A; Carmo Carreiras, M; Jimeno, ML; Mendes, E; Rios, Cde L; Romero, A; Villarroya, M; Lopez, MG; Marco-Contelles, J University of Lisbon http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50384796 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50384796&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54770958 160863879 CHEMBL2037382 ZINC84652102 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50937500 Cn1nc(C(N)=O)c2c(NCCCCCCOc3ccccc3)c3CCCCc3nc12 InChI=1S/C24H31N5O2/c1-29-24-20(22(28-29)23(25)30)21(18-13-7-8-14-19(18)27-24)26-15-9-2-3-10-16-31-17-11-5-4-6-12-17/h4-6,11-12H,2-3,7-10,13-16H2,1H3,(H2,25,30)(H,26,27) RUJVXQCLRQRNOX-UHFFFAOYSA-N 50384797 CHEMBL2037383 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2011.05.068 10.7270/Q24T6KDT 21715067 Silva, D; Chioua, M; Samadi, A; Carmo Carreiras, M; Jimeno, ML; Mendes, E; Rios, Cde L; Romero, A; Villarroya, M; Lopez, MG; Marco-Contelles, J University of Lisbon http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50384797 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50384797&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54770959 160863880 CHEMBL2037383 ZINC84714613 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50937501 CC(=O)Nc1nn(C)c2nc3nc4CCCCc4c(N)c3cc12 InChI=1S/C16H18N6O/c1-8(23)18-15-11-7-10-13(17)9-5-3-4-6-12(9)19-14(10)20-16(11)22(2)21-15/h7H,3-6H2,1-2H3,(H2,17,19,20)(H,18,21,23) HAYPUYGNEIACAV-UHFFFAOYSA-N 50384793 CHEMBL2037384 Cholinesterase 6300 ChEMBL 10.1016/j.ejmech.2011.05.068 10.7270/Q24T6KDT 21715067 Silva, D; Chioua, M; Samadi, A; Carmo Carreiras, M; Jimeno, ML; Mendes, E; Rios, Cde L; Romero, A; Villarroya, M; Lopez, MG; Marco-Contelles, J University of Lisbon http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50384793 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50384793&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54576738 160863876 CHEMBL2037384 ZINC84705250 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50937805 SCCC(=O)NCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C19H25N3OS/c23-18(10-13-24)20-11-5-12-21-19-14-6-1-3-8-16(14)22-17-9-4-2-7-15(17)19/h1,3,6,8,24H,2,4-5,7,9-13H2,(H,20,23)(H,21,22) IVYWWAJPFURBOQ-UHFFFAOYSA-N 50384895 CHEMBL2036259 Cholinesterase 181.97 ChEMBL 10.1021/jm300124p 10.7270/Q2QJ7JBD 22420827 Wang, Y; Guan, XL; Wu, PF; Wang, CM; Cao, H; Li, L; Guo, XJ; Wang, F; Xie, N; Jiang, FC; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50384895 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50384895&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57386337 160863978 CHEMBL2036259 ZINC84712060 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50937806 CC(=O)SCCC(=O)NCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C22H29N3O2S/c1-16(26)28-15-12-21(27)23-13-6-7-14-24-22-17-8-2-4-10-19(17)25-20-11-5-3-9-18(20)22/h2,4,8,10H,3,5-7,9,11-15H2,1H3,(H,23,27)(H,24,25) ODNHORRQJLFLLT-UHFFFAOYSA-N 50384892 CHEMBL2036260 Cholinesterase 154.88 ChEMBL 10.1021/jm300124p 10.7270/Q2QJ7JBD 22420827 Wang, Y; Guan, XL; Wu, PF; Wang, CM; Cao, H; Li, L; Guo, XJ; Wang, F; Xie, N; Jiang, FC; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50384892 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50384892&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57386338 160863975 CHEMBL2036260 C04334 ZINC84727291 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50937807 SCCC(=O)NCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C20H27N3OS/c24-19(11-14-25)21-12-5-6-13-22-20-15-7-1-3-9-17(15)23-18-10-4-2-8-16(18)20/h1,3,7,9,25H,2,4-6,8,10-14H2,(H,21,24)(H,22,23) SZVUDZPZHZYKKJ-UHFFFAOYSA-N 50384893 CHEMBL2036261 Cholinesterase 128.82 ChEMBL 10.1021/jm300124p 10.7270/Q2QJ7JBD 22420827 Wang, Y; Guan, XL; Wu, PF; Wang, CM; Cao, H; Li, L; Guo, XJ; Wang, F; Xie, N; Jiang, FC; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50384893 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50384893&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57386339 160863976 CHEMBL2036261 ZINC84725878 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50937808 CC(=O)SCCC(=O)NCCCCCCNc1c2CCCCc2nc2cc(Cl)ccc12 InChI=1S/C24H32ClN3O2S/c1-17(29)31-15-12-23(30)26-13-6-2-3-7-14-27-24-19-8-4-5-9-21(19)28-22-16-18(25)10-11-20(22)24/h10-11,16H,2-9,12-15H2,1H3,(H,26,30)(H,27,28) DBUIIUVPFUGTNS-UHFFFAOYSA-N 50384894 CHEMBL2036262 Cholinesterase 91.2 ChEMBL 10.1021/jm300124p 10.7270/Q2QJ7JBD 22420827 Wang, Y; Guan, XL; Wu, PF; Wang, CM; Cao, H; Li, L; Guo, XJ; Wang, F; Xie, N; Jiang, FC; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50384894 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50384894&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57386592 160863977 CHEMBL2036262 C04334 ZINC84725881 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50937809 SCCC(=O)NCCCCCCNc1c2CCCCc2nc2cc(Cl)ccc12 InChI=1S/C22H30ClN3OS/c23-16-9-10-18-20(15-16)26-19-8-4-3-7-17(19)22(18)25-13-6-2-1-5-12-24-21(27)11-14-28/h9-10,15,28H,1-8,11-14H2,(H,24,27)(H,25,26) KNYZLSNPSSAHIF-UHFFFAOYSA-N 50384890 CHEMBL2036263 Cholinesterase 177.83 ChEMBL 10.1021/jm300124p 10.7270/Q2QJ7JBD 22420827 Wang, Y; Guan, XL; Wu, PF; Wang, CM; Cao, H; Li, L; Guo, XJ; Wang, F; Xie, N; Jiang, FC; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50384890 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50384890&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57386593 160863973 CHEMBL2036263 ZINC84725886 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50937811 CC(=O)SCCC(=O)NCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C21H27N3O2S/c1-15(25)27-14-11-20(26)22-12-6-13-23-21-16-7-2-4-9-18(16)24-19-10-5-3-8-17(19)21/h2,4,7,9H,3,5-6,8,10-14H2,1H3,(H,22,26)(H,23,24) PGJQQPKQOLUVLK-UHFFFAOYSA-N 50384891 CHEMBL2036258 Cholinesterase 229.09 ChEMBL 10.1021/jm300124p 10.7270/Q2QJ7JBD 22420827 Wang, Y; Guan, XL; Wu, PF; Wang, CM; Cao, H; Li, L; Guo, XJ; Wang, F; Xie, N; Jiang, FC; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50384891 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50384891&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57386336 160863974 CHEMBL2036258 C04334 ZINC84670341 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50937812 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 3.8 ChEMBL 10.1021/jm300124p 10.7270/Q2QJ7JBD 22420827 Wang, Y; Guan, XL; Wu, PF; Wang, CM; Cao, H; Li, L; Guo, XJ; Wang, F; Xie, N; Jiang, FC; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50927063 Clc1ccc2c(c1)nc1\C(CCCn1c2=O)=C\c1ccc(cc1)C(=O)NCCCN1CCCC1 InChI=1S/C27H29ClN4O2/c28-22-10-11-23-24(18-22)30-25-21(5-3-16-32(25)27(23)34)17-19-6-8-20(9-7-19)26(33)29-12-4-15-31-13-1-2-14-31/h6-11,17-18H,1-5,12-16H2,(H,29,33)/b21-17+ LICIIBRYGLAGDN-HEHNFIMWSA-N 50380189 CHEMBL2011205 Cholinesterase 500 ChEMBL 10.1016/j.bmc.2012.02.061 10.7270/Q26111B3 22444876 Yan, JW; Li, YP; Ye, WJ; Chen, SB; Hou, JQ; Tan, JH; Ou, TM; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380189 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380189&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70693597 160859272 CHEMBL2011205 ZINC84604951 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50927064 Clc1ccc2c(c1)nc1\C(CCCn1c2=O)=C\c1ccc(NC(=O)CCN2CCCCC2)cc1 InChI=1S/C27H29ClN4O2/c28-21-8-11-23-24(18-21)30-26-20(5-4-15-32(26)27(23)34)17-19-6-9-22(10-7-19)29-25(33)12-16-31-13-2-1-3-14-31/h6-11,17-18H,1-5,12-16H2,(H,29,33)/b20-17+ AWXLOHJUUYWTKE-LVZFUZTISA-N 50380183 CHEMBL2011201 Cholinesterase 5990 ChEMBL 10.1016/j.bmc.2012.02.061 10.7270/Q26111B3 22444876 Yan, JW; Li, YP; Ye, WJ; Chen, SB; Hou, JQ; Tan, JH; Ou, TM; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380183 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380183&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70693596 160859266 CHEMBL2011201 ZINC84619843 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50927065 Clc1ccc2c(c1)nc1\C(CCn1c2=O)=C\c1ccc(cc1)C(=O)NCCCN1CCCC1 InChI=1S/C26H27ClN4O2/c27-21-8-9-22-23(17-21)29-24-20(10-15-31(24)26(22)33)16-18-4-6-19(7-5-18)25(32)28-11-3-14-30-12-1-2-13-30/h4-9,16-17H,1-3,10-15H2,(H,28,32)/b20-16+ NCGYVVOFFRIIKN-CAPFRKAQSA-N 50380190 CHEMBL2011203 Cholinesterase 610 ChEMBL 10.1016/j.bmc.2012.02.061 10.7270/Q26111B3 22444876 Yan, JW; Li, YP; Ye, WJ; Chen, SB; Hou, JQ; Tan, JH; Ou, TM; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380190 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380190&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70689400 160859273 CHEMBL2011203 ZINC84604947 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50927067 Clc1ccc2c(c1)nc1\C(CCn1c2=O)=C\c1ccc(NC(=O)CCN2CCCC2)cc1 InChI=1S/C25H25ClN4O2/c26-19-5-8-21-22(16-19)28-24-18(9-14-30(24)25(21)32)15-17-3-6-20(7-4-17)27-23(31)10-13-29-11-1-2-12-29/h3-8,15-16H,1-2,9-14H2,(H,27,31)/b18-15+ BGJBHDRKOSGGDU-OBGWFSINSA-N 50380187 CHEMBL2011196 Cholinesterase 3820 ChEMBL 10.1016/j.bmc.2012.02.061 10.7270/Q26111B3 22444876 Yan, JW; Li, YP; Ye, WJ; Chen, SB; Hou, JQ; Tan, JH; Ou, TM; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380187 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380187&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57521282 160859270 CHEMBL2011196 ZINC84633318 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50927068 CN(C)CCCNC(=O)c1ccc(\C=C2/CCn3c2nc2cc(Cl)ccc2c3=O)cc1 InChI=1S/C24H25ClN4O2/c1-28(2)12-3-11-26-23(30)17-6-4-16(5-7-17)14-18-10-13-29-22(18)27-21-15-19(25)8-9-20(21)24(29)31/h4-9,14-15H,3,10-13H2,1-2H3,(H,26,30)/b18-14+ LUSPDWONACCXEQ-NBVRZTHBSA-N 50380191 CHEMBL2011207 Cholinesterase 5180 ChEMBL 10.1016/j.bmc.2012.02.061 10.7270/Q26111B3 22444876 Yan, JW; Li, YP; Ye, WJ; Chen, SB; Hou, JQ; Tan, JH; Ou, TM; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380191 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380191&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70683105 160859274 CHEMBL2011207 ZINC84604178 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50927069 Clc1ccc2c(c1)nc1\C(CCCn1c2=O)=C\c1ccc(NC(=O)CC[n+]2ccccc2)cc1 InChI=1S/C27H23ClN4O2/c28-21-8-11-23-24(18-21)30-26-20(5-4-15-32(26)27(23)34)17-19-6-9-22(10-7-19)29-25(33)12-16-31-13-2-1-3-14-31/h1-3,6-11,13-14,17-18H,4-5,12,15-16H2/p+1 YWLVHLFPPHDHHZ-UHFFFAOYSA-O 50380192 CHEMBL2011195 Cholinesterase 3380 ChEMBL 10.1016/j.bmc.2012.02.061 10.7270/Q26111B3 22444876 Yan, JW; Li, YP; Ye, WJ; Chen, SB; Hou, JQ; Tan, JH; Ou, TM; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380192 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380192&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70683103 160859275 CHEMBL2011195 ZINC84596506 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50927072 Clc1ccc2c(c1)nc1\C(CCn1c2=O)=C\c1ccc(NC(=O)CCN2CCCCC2)cc1 InChI=1S/C26H27ClN4O2/c27-20-6-9-22-23(17-20)29-25-19(10-15-31(25)26(22)33)16-18-4-7-21(8-5-18)28-24(32)11-14-30-12-2-1-3-13-30/h4-9,16-17H,1-3,10-15H2,(H,28,32)/b19-16+ GTZPETIHTNXEIH-KNTRCKAVSA-N 50380184 CHEMBL2011200 Cholinesterase 2880 ChEMBL 10.1016/j.bmc.2012.02.061 10.7270/Q26111B3 22444876 Yan, JW; Li, YP; Ye, WJ; Chen, SB; Hou, JQ; Tan, JH; Ou, TM; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380184 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380184&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70691505 160859267 CHEMBL2011200 ZINC84619841 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50927074 Clc1ccc2c(c1)nc1\C(CCn1c2=O)=C\c1ccc(NC(=O)CC[n+]2ccccc2)cc1 InChI=1S/C26H21ClN4O2/c27-20-6-9-22-23(17-20)29-25-19(10-15-31(25)26(22)33)16-18-4-7-21(8-5-18)28-24(32)11-14-30-12-2-1-3-13-30/h1-9,12-13,16-17H,10-11,14-15H2/p+1 YGXYWXUZHFBMHN-UHFFFAOYSA-O 50380185 CHEMBL2011194 Cholinesterase 1700 ChEMBL 10.1016/j.bmc.2012.02.061 10.7270/Q26111B3 22444876 Yan, JW; Li, YP; Ye, WJ; Chen, SB; Hou, JQ; Tan, JH; Ou, TM; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380185 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380185&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70695717 160859268 CHEMBL2011194 ZINC84604585 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50927076 Clc1ccc2c(c1)nc1\C(CCCn1c2=O)=C\c1ccc(NC(=O)CCN2CCCC2)cc1 InChI=1S/C26H27ClN4O2/c27-20-7-10-22-23(17-20)29-25-19(4-3-14-31(25)26(22)33)16-18-5-8-21(9-6-18)28-24(32)11-15-30-12-1-2-13-30/h5-10,16-17H,1-4,11-15H2,(H,28,32)/b19-16+ XNZMJVDLEUCILY-KNTRCKAVSA-N 50380195 CHEMBL2011197 Cholinesterase 6450 ChEMBL 10.1016/j.bmc.2012.02.061 10.7270/Q26111B3 22444876 Yan, JW; Li, YP; Ye, WJ; Chen, SB; Hou, JQ; Tan, JH; Ou, TM; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380195 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380195&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70685186 160859278 CHEMBL2011197 ZINC84633320 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50927078 CN(C)CCCNC(=O)c1ccc(\C=C2/CCCn3c2nc2cc(Cl)ccc2c3=O)cc1 InChI=1S/C25H27ClN4O2/c1-29(2)13-4-12-27-24(31)18-8-6-17(7-9-18)15-19-5-3-14-30-23(19)28-22-16-20(26)10-11-21(22)25(30)32/h6-11,15-16H,3-5,12-14H2,1-2H3,(H,27,31)/b19-15+ NMRYLUNXMFNUHV-XDJHFCHBSA-N 50380193 CHEMBL2011209 Cholinesterase 6640 ChEMBL 10.1016/j.bmc.2012.02.061 10.7270/Q26111B3 22444876 Yan, JW; Li, YP; Ye, WJ; Chen, SB; Hou, JQ; Tan, JH; Ou, TM; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380193 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380193&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70689401 160859276 CHEMBL2011209 ZINC84633870 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50927079 Clc1ccc2c(c1)nc1\C(CCn1c2=O)=C\c1ccc(cc1)C(=O)NCCN1CCCC1 InChI=1S/C25H25ClN4O2/c26-20-7-8-21-22(16-20)28-23-19(9-13-30(23)25(21)32)15-17-3-5-18(6-4-17)24(31)27-10-14-29-11-1-2-12-29/h3-8,15-16H,1-2,9-14H2,(H,27,31)/b19-15+ PSOGAWHFIYVNRZ-XDJHFCHBSA-N 50380186 CHEMBL2011202 Cholinesterase 11060 ChEMBL 10.1016/j.bmc.2012.02.061 10.7270/Q26111B3 22444876 Yan, JW; Li, YP; Ye, WJ; Chen, SB; Hou, JQ; Tan, JH; Ou, TM; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380186 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380186&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70680980 160859269 CHEMBL2011202 ZINC84604945 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50927080 CCN(CC)CCC(=O)Nc1ccc(\C=C2/CCn3c2nc2cc(Cl)ccc2c3=O)cc1 InChI=1S/C25H27ClN4O2/c1-3-29(4-2)13-12-23(31)27-20-8-5-17(6-9-20)15-18-11-14-30-24(18)28-22-16-19(26)7-10-21(22)25(30)32/h5-10,15-16H,3-4,11-14H2,1-2H3,(H,27,31)/b18-15+ HLBUIUFXJNHMOH-OBGWFSINSA-N 50380182 CHEMBL2011198 Cholinesterase 6440 ChEMBL 10.1016/j.bmc.2012.02.061 10.7270/Q26111B3 22444876 Yan, JW; Li, YP; Ye, WJ; Chen, SB; Hou, JQ; Tan, JH; Ou, TM; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380182 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380182&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70685187 160859265 CHEMBL2011198 ZINC84633322 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50927081 Clc1ccc2c(c1)nc1\C(CCCn1c2=O)=C\c1ccc(cc1)C(=O)NCCN1CCCC1 InChI=1S/C26H27ClN4O2/c27-21-9-10-22-23(17-21)29-24-20(4-3-14-31(24)26(22)33)16-18-5-7-19(8-6-18)25(32)28-11-15-30-12-1-2-13-30/h5-10,16-17H,1-4,11-15H2,(H,28,32)/b20-16+ CEKRPIFFZAROMV-CAPFRKAQSA-N 50380194 CHEMBL2011204 Cholinesterase 6750 ChEMBL 10.1016/j.bmc.2012.02.061 10.7270/Q26111B3 22444876 Yan, JW; Li, YP; Ye, WJ; Chen, SB; Hou, JQ; Tan, JH; Ou, TM; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380194 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380194&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70687343 160859277 CHEMBL2011204 ZINC84604949 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50927084 CN(C)CCNC(=O)c1ccc(\C=C2/CCn3c2nc2cc(Cl)ccc2c3=O)cc1 InChI=1S/C23H23ClN4O2/c1-27(2)12-10-25-22(29)16-5-3-15(4-6-16)13-17-9-11-28-21(17)26-20-14-18(24)7-8-19(20)23(28)30/h3-8,13-14H,9-12H2,1-2H3,(H,25,29)/b17-13+ KKNNIFIADQSFMQ-GHRIWEEISA-N 50380181 CHEMBL2011206 Cholinesterase >20000 ChEMBL 10.1016/j.bmc.2012.02.061 10.7270/Q26111B3 22444876 Yan, JW; Li, YP; Ye, WJ; Chen, SB; Hou, JQ; Tan, JH; Ou, TM; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380181 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380181&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70691506 160859264 CHEMBL2011206 ZINC84604953 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50927085 CN(C)CCNC(=O)c1ccc(\C=C2/CCCn3c2nc2cc(Cl)ccc2c3=O)cc1 InChI=1S/C24H25ClN4O2/c1-28(2)13-11-26-23(30)17-7-5-16(6-8-17)14-18-4-3-12-29-22(18)27-21-15-19(25)9-10-20(21)24(29)31/h5-10,14-15H,3-4,11-13H2,1-2H3,(H,26,30)/b18-14+ JHZXMBYVFUBTGO-NBVRZTHBSA-N 50380188 CHEMBL2011208 Cholinesterase >40000 ChEMBL 10.1016/j.bmc.2012.02.061 10.7270/Q26111B3 22444876 Yan, JW; Li, YP; Ye, WJ; Chen, SB; Hou, JQ; Tan, JH; Ou, TM; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380188 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380188&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70687344 160859271 CHEMBL2011208 ZINC84633324 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50927086 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 14 ChEMBL 10.1016/j.bmc.2012.02.061 10.7270/Q26111B3 22444876 Yan, JW; Li, YP; Ye, WJ; Chen, SB; Hou, JQ; Tan, JH; Ou, TM; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50927087 CCN(CC)CCC(=O)Nc1ccc(\C=C2/CCCn3c2nc2cc(Cl)ccc2c3=O)cc1 InChI=1S/C26H29ClN4O2/c1-3-30(4-2)15-13-24(32)28-21-10-7-18(8-11-21)16-19-6-5-14-31-25(19)29-23-17-20(27)9-12-22(23)26(31)33/h7-12,16-17H,3-6,13-15H2,1-2H3,(H,28,32)/b19-16+ DPAZLRGOSVJXEJ-KNTRCKAVSA-N 50380196 CHEMBL2011199 Cholinesterase 2340 ChEMBL 10.1016/j.bmc.2012.02.061 10.7270/Q26111B3 22444876 Yan, JW; Li, YP; Ye, WJ; Chen, SB; Hou, JQ; Tan, JH; Ou, TM; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380196 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380196&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70683104 160859279 CHEMBL2011199 ZINC84619840 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928195 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 10 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928196 Oc1cc2oc(cc(=O)c2cc1O)C(=O)NCCCCCCCCCCNc1c2CCCCc2nc2cc(Cl)cc(Cl)c12 InChI=1S/C33H37Cl2N3O5/c34-20-15-23(35)31-25(16-20)38-24-12-8-7-11-21(24)32(31)36-13-9-5-3-1-2-4-6-10-14-37-33(42)30-18-26(39)22-17-27(40)28(41)19-29(22)43-30/h15-19,40-41H,1-14H2,(H,36,38)(H,37,42) CHOPUPNENHIZKQ-UHFFFAOYSA-N 50380554 CHEMBL2019054 Cholinesterase 88 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380554 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380554&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56954990 160859637 CHEMBL2019054 ZINC84618919 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928197 Oc1cc2oc(cc(=O)c2cc1O)C(=O)NCCCCCCCCCCNc1c2CCCCc2nc2cc(Cl)ccc12 InChI=1S/C33H38ClN3O5/c34-21-13-14-23-26(17-21)37-25-12-8-7-11-22(25)32(23)35-15-9-5-3-1-2-4-6-10-16-36-33(41)31-19-27(38)24-18-28(39)29(40)20-30(24)42-31/h13-14,17-20,39-40H,1-12,15-16H2,(H,35,37)(H,36,41) VNWJCXLTKRADKP-UHFFFAOYSA-N 50380547 CHEMBL2019053 Cholinesterase 28 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380547 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380547&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56955293 160859630 CHEMBL2019053 ZINC84633300 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928198 Oc1cc2oc(cc(=O)c2cc1O)C(=O)NCCCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C33H39N3O5/c37-27-20-31(41-30-21-29(39)28(38)19-24(27)30)33(40)35-18-12-6-4-2-1-3-5-11-17-34-32-22-13-7-9-15-25(22)36-26-16-10-8-14-23(26)32/h7,9,13,15,19-21,38-39H,1-6,8,10-12,14,16-18H2,(H,34,36)(H,35,40) YMRPMJKWTYJBPC-UHFFFAOYSA-N 50380555 CHEMBL2019052 Cholinesterase 8 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380555 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380555&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56955292 160859638 CHEMBL2019052 ZINC84619167 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928199 Oc1cc(O)c2c(c1)oc(cc2=O)C(=O)NCCCCCCCCCCNc1c2CCCCc2nc2cc(Cl)cc(Cl)c12 InChI=1S/C33H37Cl2N3O5/c34-20-15-23(35)30-25(16-20)38-24-12-8-7-11-22(24)32(30)36-13-9-5-3-1-2-4-6-10-14-37-33(42)29-19-27(41)31-26(40)17-21(39)18-28(31)43-29/h15-19,39-40H,1-14H2,(H,36,38)(H,37,42) AWEIPXRUFDVNHO-UHFFFAOYSA-N 50380556 CHEMBL2019051 Cholinesterase 35 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380556 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380556&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56955209 160859639 CHEMBL2019051 ZINC84619667 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928200 COc1cc(O)c2c(c1)oc(cc2=O)C(=O)NCCCCCCCCCCNc1c2CCCCc2nc2cc(Cl)cc(Cl)c12 InChI=1S/C34H39Cl2N3O5/c1-43-22-18-27(40)32-28(41)20-30(44-29(32)19-22)34(42)38-15-11-7-5-3-2-4-6-10-14-37-33-23-12-8-9-13-25(23)39-26-17-21(35)16-24(36)31(26)33/h16-20,40H,2-15H2,1H3,(H,37,39)(H,38,42) BTFMFFRGSDLIRJ-UHFFFAOYSA-N 50380557 CHEMBL2019050 Cholinesterase 35 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380557 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380557&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56955207 160859640 CHEMBL2019050 ZINC84596599 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928201 Oc1cc(O)c2c(c1)oc(cc2=O)C(=O)NCCCCCCCCCCNc1c2CCCCc2nc2cc(Cl)ccc12 InChI=1S/C33H38ClN3O5/c34-21-13-14-24-26(17-21)37-25-12-8-7-11-23(25)32(24)35-15-9-5-3-1-2-4-6-10-16-36-33(41)30-20-28(40)31-27(39)18-22(38)19-29(31)42-30/h13-14,17-20,38-39H,1-12,15-16H2,(H,35,37)(H,36,41) FUYCPEKODNDZTA-UHFFFAOYSA-N 50380558 CHEMBL2019049 Cholinesterase 3 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380558 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380558&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56955199 160859641 CHEMBL2019049 ZINC84587878 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928202 COc1cc(O)c2c(c1)oc(cc2=O)C(=O)NCCCCCCCCCCNc1c2CCCCc2nc2cc(Cl)ccc12 InChI=1S/C34H40ClN3O5/c1-42-23-19-28(39)32-29(40)21-31(43-30(32)20-23)34(41)37-17-11-7-5-3-2-4-6-10-16-36-33-24-12-8-9-13-26(24)38-27-18-22(35)14-15-25(27)33/h14-15,18-21,39H,2-13,16-17H2,1H3,(H,36,38)(H,37,41) ZUULLQGMZOHIHX-UHFFFAOYSA-N 50380559 CHEMBL2019048 Cholinesterase 0.18 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380559 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380559&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56955198 160859642 CHEMBL2019048 ZINC84617328 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928203 Oc1cc(O)c2c(c1)oc(cc2=O)C(=O)NCCCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C33H39N3O5/c37-22-19-27(38)31-28(39)21-30(41-29(31)20-22)33(40)35-18-12-6-4-2-1-3-5-11-17-34-32-23-13-7-9-15-25(23)36-26-16-10-8-14-24(26)32/h7,9,13,15,19-21,37-38H,1-6,8,10-12,14,16-18H2,(H,34,36)(H,35,40) VXCQEWKLZIACMS-UHFFFAOYSA-N 50380546 CHEMBL2019047 Cholinesterase 0.35 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380546 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380546&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56955111 160859629 CHEMBL2019047 ZINC84617326 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928204 COc1cc(O)c2c(c1)oc(cc2=O)C(=O)NCCCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C34H41N3O5/c1-41-23-20-28(38)32-29(39)22-31(42-30(32)21-23)34(40)36-19-13-7-5-3-2-4-6-12-18-35-33-24-14-8-10-16-26(24)37-27-17-11-9-15-25(27)33/h8,10,14,16,20-22,38H,2-7,9,11-13,15,17-19H2,1H3,(H,35,37)(H,36,40) RRTQIJJHXQOLEO-UHFFFAOYSA-N 50380545 CHEMBL2019046 Cholinesterase 2 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380545 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380545&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56955109 160859628 CHEMBL2019046 ZINC84617324 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928205 Oc1ccc2oc(cc(=O)c2c1)C(=O)NCCCCCCCCCCNc1c2CCCCc2nc2cc(Cl)cc(Cl)c12 InChI=1S/C33H37Cl2N3O4/c34-21-17-25(35)31-27(18-21)38-26-12-8-7-11-23(26)32(31)36-15-9-5-3-1-2-4-6-10-16-37-33(41)30-20-28(40)24-19-22(39)13-14-29(24)42-30/h13-14,17-20,39H,1-12,15-16H2,(H,36,38)(H,37,41) AERQXLIGVZMSEX-UHFFFAOYSA-N 50380560 CHEMBL2019045 Cholinesterase 18 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380560 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380560&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56955107 160859643 CHEMBL2019045 ZINC84619161 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928206 Oc1ccc2oc(cc(=O)c2c1)C(=O)NCCCCCCCCCCNc1c2CCCCc2nc2cc(Cl)ccc12 InChI=1S/C33H38ClN3O4/c34-22-13-15-25-28(19-22)37-27-12-8-7-11-24(27)32(25)35-17-9-5-3-1-2-4-6-10-18-36-33(40)31-21-29(39)26-20-23(38)14-16-30(26)41-31/h13-16,19-21,38H,1-12,17-18H2,(H,35,37)(H,36,40) DULLYLROEIJODI-UHFFFAOYSA-N 50380549 CHEMBL2019044 Cholinesterase 3.5 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380549 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380549&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56955100 160859632 CHEMBL2019044 ZINC84587128 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928207 Oc1ccc2oc(cc(=O)c2c1)C(=O)NCCCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C33H39N3O4/c37-23-17-18-30-26(21-23)29(38)22-31(40-30)33(39)35-20-12-6-4-2-1-3-5-11-19-34-32-24-13-7-9-15-27(24)36-28-16-10-8-14-25(28)32/h7,9,13,15,17-18,21-22,37H,1-6,8,10-12,14,16,19-20H2,(H,34,36)(H,35,39) GQYKIJZPMPGPIM-UHFFFAOYSA-N 50380544 CHEMBL2019043 Cholinesterase 1 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380544 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380544&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56955099 160859627 CHEMBL2019043 ZINC84619626 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928208 COc1cc2oc(cc(=O)c2cc1OC)C(=O)NCCCCCCCCCCNc1c2CCCCc2nc2cc(Cl)cc(Cl)c12 InChI=1S/C35H41Cl2N3O5/c1-43-30-19-24-28(41)20-32(45-29(24)21-31(30)44-2)35(42)39-16-12-8-6-4-3-5-7-11-15-38-34-23-13-9-10-14-26(23)40-27-18-22(36)17-25(37)33(27)34/h17-21H,3-16H2,1-2H3,(H,38,40)(H,39,42) RUIHUOCBRFKOJD-UHFFFAOYSA-N 50380561 CHEMBL2019042 Cholinesterase 100 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380561 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380561&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56955098 160859644 CHEMBL2019042 ZINC84587122 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928209 COc1cc2oc(cc(=O)c2cc1OC)C(=O)NCCCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C35H43N3O5/c1-41-31-21-26-29(39)22-33(43-30(26)23-32(31)42-2)35(40)37-20-14-8-6-4-3-5-7-13-19-36-34-24-15-9-11-17-27(24)38-28-18-12-10-16-25(28)34/h9,11,15,17,21-23H,3-8,10,12-14,16,18-20H2,1-2H3,(H,36,38)(H,37,40) QDCAJVSXNYAGPD-UHFFFAOYSA-N 50380543 CHEMBL2019040 Cholinesterase 0.55 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380543 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380543&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56954989 160859626 CHEMBL2019040 ZINC84617227 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928210 COc1cc(OC)c2c(c1)oc(cc2=O)C(=O)NCCCCCCCCCCNc1c2CCCCc2nc2cc(Cl)cc(Cl)c12 InChI=1S/C35H41Cl2N3O5/c1-43-23-19-29(44-2)33-28(41)21-31(45-30(33)20-23)35(42)39-16-12-8-6-4-3-5-7-11-15-38-34-24-13-9-10-14-26(24)40-27-18-22(36)17-25(37)32(27)34/h17-21H,3-16H2,1-2H3,(H,38,40)(H,39,42) ZBIJYSUQXYNZEQ-UHFFFAOYSA-N 50380562 CHEMBL2019039 Cholinesterase 0.75 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380562 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380562&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56954988 160859645 CHEMBL2019039 ZINC84596261 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928211 COc1cc(OC)c2c(c1)oc(cc2=O)C(=O)NCCCCCCCCCCNc1c2CCCCc2nc2cc(Cl)ccc12 InChI=1S/C35H42ClN3O5/c1-42-24-20-30(43-2)33-29(40)22-32(44-31(33)21-24)35(41)38-18-12-8-6-4-3-5-7-11-17-37-34-25-13-9-10-14-27(25)39-28-19-23(36)15-16-26(28)34/h15-16,19-22H,3-14,17-18H2,1-2H3,(H,37,39)(H,38,41) DWXXMYCVGFGBCQ-UHFFFAOYSA-N 50380551 CHEMBL2019038 Cholinesterase 1 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380551 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380551&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56954987 160859634 CHEMBL2019038 ZINC84596602 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928212 COc1cc(OC)c2c(c1)oc(cc2=O)C(=O)NCCCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C35H43N3O5/c1-41-24-21-30(42-2)33-29(39)23-32(43-31(33)22-24)35(40)37-20-14-8-6-4-3-5-7-13-19-36-34-25-15-9-11-17-27(25)38-28-18-12-10-16-26(28)34/h9,11,15,17,21-23H,3-8,10,12-14,16,18-20H2,1-2H3,(H,36,38)(H,37,40) ZGZSZRMYJSHPOQ-UHFFFAOYSA-N 50380542 CHEMBL2019037 Cholinesterase 0.33 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380542 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380542&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56954986 160859625 CHEMBL2019037 ZINC84596672 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928213 COc1ccc2oc(cc(=O)c2c1)C(=O)NCCCCCCCCCCNc1c2CCCCc2nc2cc(Cl)cc(Cl)c12 InChI=1S/C34H39Cl2N3O4/c1-42-23-14-15-30-25(20-23)29(40)21-31(43-30)34(41)38-17-11-7-5-3-2-4-6-10-16-37-33-24-12-8-9-13-27(24)39-28-19-22(35)18-26(36)32(28)33/h14-15,18-21H,2-13,16-17H2,1H3,(H,37,39)(H,38,41) JCCMPIZQHXQKSX-UHFFFAOYSA-N 50380563 CHEMBL2019036 Cholinesterase 7.5 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380563 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380563&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56954892 160859646 CHEMBL2019036 ZINC84587118 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928214 COc1ccc2oc(cc(=O)c2c1)C(=O)NCCCCCCCCCCNc1c2CCCCc2nc2cc(Cl)ccc12 InChI=1S/C34H40ClN3O4/c1-41-24-15-17-31-27(21-24)30(39)22-32(42-31)34(40)37-19-11-7-5-3-2-4-6-10-18-36-33-25-12-8-9-13-28(25)38-29-20-23(35)14-16-26(29)33/h14-17,20-22H,2-13,18-19H2,1H3,(H,36,38)(H,37,40) SXRQIJKFEIRDFT-UHFFFAOYSA-N 50380552 CHEMBL2019035 Cholinesterase 0.43 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380552 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380552&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56954891 160859635 CHEMBL2019035 ZINC84619770 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928215 COc1ccc2oc(cc(=O)c2c1)C(=O)NCCCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C34H41N3O4/c1-40-24-18-19-31-27(22-24)30(38)23-32(41-31)34(39)36-21-13-7-5-3-2-4-6-12-20-35-33-25-14-8-10-16-28(25)37-29-17-11-9-15-26(29)33/h8,10,14,16,18-19,22-23H,2-7,9,11-13,15,17,20-21H2,1H3,(H,35,37)(H,36,39) UTKKDZJOGSGJSU-UHFFFAOYSA-N 50380553 CHEMBL2019034 Cholinesterase 0.32 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380553 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380553&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56954890 160859636 CHEMBL2019034 ZINC84616907 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928216 Clc1cc(Cl)c2c(NCCCCCCCCCCNC(=O)c3cc(=O)c4ccccc4o3)c3CCCCc3nc2c1 InChI=1S/C33H37Cl2N3O3/c34-22-19-25(35)31-27(20-22)38-26-15-9-7-13-23(26)32(31)36-17-11-5-3-1-2-4-6-12-18-37-33(40)30-21-28(39)24-14-8-10-16-29(24)41-30/h8,10,14,16,19-21H,1-7,9,11-13,15,17-18H2,(H,36,38)(H,37,40) RVYTZEYREJXPSV-UHFFFAOYSA-N 50380535 CHEMBL2019033 Cholinesterase 100 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380535 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380535&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56954889 160859618 CHEMBL2019033 ZINC84632499 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928217 Clc1ccc2c(NCCCCCCCCCCNC(=O)c3cc(=O)c4ccccc4o3)c3CCCCc3nc2c1 InChI=1S/C33H38ClN3O3/c34-23-17-18-25-28(21-23)37-27-15-9-7-13-24(27)32(25)35-19-11-5-3-1-2-4-6-12-20-36-33(39)31-22-29(38)26-14-8-10-16-30(26)40-31/h8,10,14,16-18,21-22H,1-7,9,11-13,15,19-20H2,(H,35,37)(H,36,39) PLKUANBZKFHKND-UHFFFAOYSA-N 50380541 CHEMBL2019032 Cholinesterase 0.18 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380541 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380541&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56954888 160859624 CHEMBL2019032 ZINC84631954 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928218 O=C(NCCCCCCCCCCCCNc1c2CCCCc2nc2ccccc12)c1cc(=O)c2ccccc2o1 InChI=1S/C35H43N3O3/c39-31-25-33(41-32-22-14-11-19-28(31)32)35(40)37-24-16-8-6-4-2-1-3-5-7-15-23-36-34-26-17-9-12-20-29(26)38-30-21-13-10-18-27(30)34/h9,11-12,14,17,19-20,22,25H,1-8,10,13,15-16,18,21,23-24H2,(H,36,38)(H,37,40) HLLTYAHEUKVLCF-UHFFFAOYSA-N 50380536 CHEMBL2019031 Cholinesterase 0.25 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380536 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380536&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56954998 160859619 CHEMBL2019031 ZINC84632496 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928219 O=C(NCCCCCCCCCCNc1c2CCCCc2nc2ccccc12)c1cc(=O)c2ccccc2o1 InChI=1S/C33H39N3O3/c37-29-23-31(39-30-20-12-9-17-26(29)30)33(38)35-22-14-6-4-2-1-3-5-13-21-34-32-24-15-7-10-18-27(24)36-28-19-11-8-16-25(28)32/h7,9-10,12,15,17-18,20,23H,1-6,8,11,13-14,16,19,21-22H2,(H,34,36)(H,35,38) RDTFFLFEGIKFDL-UHFFFAOYSA-N 50380537 CHEMBL2019030 Cholinesterase 0.18 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380537 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380537&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56954996 160859620 CHEMBL2019030 ZINC84632874 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928220 O=C(NCCCCCCCCCNc1c2CCCCc2nc2ccccc12)c1cc(=O)c2ccccc2o1 InChI=1S/C32H37N3O3/c36-28-22-30(38-29-19-11-8-16-25(28)29)32(37)34-21-13-5-3-1-2-4-12-20-33-31-23-14-6-9-17-26(23)35-27-18-10-7-15-24(27)31/h6,8-9,11,14,16-17,19,22H,1-5,7,10,12-13,15,18,20-21H2,(H,33,35)(H,34,37) QPKOVCUUEVVGKK-UHFFFAOYSA-N 50380538 CHEMBL2019029 Cholinesterase 0.58 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380538 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380538&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56954994 160859621 CHEMBL2019029 ZINC84619164 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928221 O=C(NCCCCCCCCNc1c2CCCCc2nc2ccccc12)c1cc(=O)c2ccccc2o1 InChI=1S/C31H35N3O3/c35-27-21-29(37-28-18-10-7-15-24(27)28)31(36)33-20-12-4-2-1-3-11-19-32-30-22-13-5-8-16-25(22)34-26-17-9-6-14-23(26)30/h5,7-8,10,13,15-16,18,21H,1-4,6,9,11-12,14,17,19-20H2,(H,32,34)(H,33,36) UNUCEOJHNSJBBG-UHFFFAOYSA-N 50380539 CHEMBL2019028 Cholinesterase 0.50 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380539 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380539&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56954992 160859622 CHEMBL2019028 ZINC84618916 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50928222 O=C(NCCCCCCCNc1c2CCCCc2nc2ccccc12)c1cc(=O)c2ccccc2o1 InChI=1S/C30H33N3O3/c34-26-20-28(36-27-17-9-6-14-23(26)27)30(35)32-19-11-3-1-2-10-18-31-29-21-12-4-7-15-24(21)33-25-16-8-5-13-22(25)29/h4,6-7,9,12,14-15,17,20H,1-3,5,8,10-11,13,16,18-19H2,(H,31,33)(H,32,35) XJZVPSPGEBTTOD-UHFFFAOYSA-N 50380540 CHEMBL2019027 Cholinesterase 1.8 ChEMBL 10.1021/jm201460y 10.7270/Q2M32WS2 22243648 Fernandez-Bachiller, MI; Perez, C; Monjas, L; Rademann, J; Rodriguez-Franco, MI Instituto de Qu£mica M£dica http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50380540 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50380540&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56955291 160859623 CHEMBL2019027 ZINC84596601 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50943884 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 12600 ChEMBL 10.1016/j.bmcl.2012.05.077 10.7270/Q27S7PSZ 22704921 Mohamed, T; Yeung, JC; Vasefi, MS; Beazely, MA; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50943885 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 3600 ChEMBL 10.1016/j.bmcl.2012.05.077 10.7270/Q27S7PSZ 22704921 Mohamed, T; Yeung, JC; Vasefi, MS; Beazely, MA; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50943886 C(Nc1ccnc(NC2CCN(Cc3ccccc3)CC2)n1)c1ccc2OCOc2c1 InChI=1S/C24H27N5O2/c1-2-4-18(5-3-1)16-29-12-9-20(10-13-29)27-24-25-11-8-23(28-24)26-15-19-6-7-21-22(14-19)31-17-30-21/h1-8,11,14,20H,9-10,12-13,15-17H2,(H2,25,26,27,28) PCQQLSGOOJZBEN-UHFFFAOYSA-N 50387088 CHEMBL2047375 Cholinesterase 3900 ChEMBL 10.1016/j.bmcl.2012.05.077 10.7270/Q27S7PSZ 22704921 Mohamed, T; Yeung, JC; Vasefi, MS; Beazely, MA; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50387088 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50387088&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70694577 160866171 CHEMBL2047375 ZINC84759509 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50943887 COc1cc(CNc2ccnc(NC3CCN(Cc4ccccc4)CC3)n2)cc(OC)c1OC InChI=1S/C26H33N5O3/c1-32-22-15-20(16-23(33-2)25(22)34-3)17-28-24-9-12-27-26(30-24)29-21-10-13-31(14-11-21)18-19-7-5-4-6-8-19/h4-9,12,15-16,21H,10-11,13-14,17-18H2,1-3H3,(H2,27,28,29,30) HRNBEQMXRSPNKX-UHFFFAOYSA-N 50387089 CHEMBL2047231 Cholinesterase 7700 ChEMBL 10.1016/j.bmcl.2012.05.077 10.7270/Q27S7PSZ 22704921 Mohamed, T; Yeung, JC; Vasefi, MS; Beazely, MA; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50387089 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50387089&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70681952 160866172 CHEMBL2047231 ZINC84758034 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50943888 COc1ccc(CNc2ccnc(NC3CCN(Cc4ccccc4)CC3)n2)cc1OC InChI=1S/C25H31N5O2/c1-31-22-9-8-20(16-23(22)32-2)17-27-24-10-13-26-25(29-24)28-21-11-14-30(15-12-21)18-19-6-4-3-5-7-19/h3-10,13,16,21H,11-12,14-15,17-18H2,1-2H3,(H2,26,27,28,29) RSFRMMSXJWXLBM-UHFFFAOYSA-N 50387096 CHEMBL2047230 Cholinesterase 11400 ChEMBL 10.1016/j.bmcl.2012.05.077 10.7270/Q27S7PSZ 22704921 Mohamed, T; Yeung, JC; Vasefi, MS; Beazely, MA; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50387096 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50387096&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70688334 160866179 CHEMBL2047230 ZINC84758032 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50943889 COc1ccc(CNc2ccnc(NC3CCN(Cc4ccccc4)CC3)n2)cc1 InChI=1S/C24H29N5O/c1-30-22-9-7-19(8-10-22)17-26-23-11-14-25-24(28-23)27-21-12-15-29(16-13-21)18-20-5-3-2-4-6-20/h2-11,14,21H,12-13,15-18H2,1H3,(H2,25,26,27,28) JCSHNHCWHQCGHC-UHFFFAOYSA-N 50387090 CHEMBL2047229 Cholinesterase 4900 ChEMBL 10.1016/j.bmcl.2012.05.077 10.7270/Q27S7PSZ 22704921 Mohamed, T; Yeung, JC; Vasefi, MS; Beazely, MA; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50387090 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50387090&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70696614 160866173 CHEMBL2047229 ZINC84654854 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50943890 Cc1ccc(CNc2ccnc(NC3CCN(Cc4ccccc4)CC3)n2)cc1 InChI=1S/C24H29N5/c1-19-7-9-20(10-8-19)17-26-23-11-14-25-24(28-23)27-22-12-15-29(16-13-22)18-21-5-3-2-4-6-21/h2-11,14,22H,12-13,15-18H2,1H3,(H2,25,26,27,28) WPGWJDQGLFQPSF-UHFFFAOYSA-N 50387091 CHEMBL2047228 Cholinesterase 2500 ChEMBL 10.1016/j.bmcl.2012.05.077 10.7270/Q27S7PSZ 22704921 Mohamed, T; Yeung, JC; Vasefi, MS; Beazely, MA; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50387091 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50387091&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70684068 160866174 CHEMBL2047228 ZINC84758030 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50943891 Fc1ccc(CNc2ccnc(NC3CCN(Cc4ccccc4)CC3)n2)cc1 InChI=1S/C23H26FN5/c24-20-8-6-18(7-9-20)16-26-22-10-13-25-23(28-22)27-21-11-14-29(15-12-21)17-19-4-2-1-3-5-19/h1-10,13,21H,11-12,14-17H2,(H2,25,26,27,28) FFPGDISVVGINKZ-UHFFFAOYSA-N 50387092 CHEMBL2047227 Cholinesterase 2200 ChEMBL 10.1016/j.bmcl.2012.05.077 10.7270/Q27S7PSZ 22704921 Mohamed, T; Yeung, JC; Vasefi, MS; Beazely, MA; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50387092 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50387092&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 56935716 160866175 CHEMBL2047227 ZINC84758028 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50943892 Brc1ccc(CNc2ccnc(NC3CCN(Cc4ccccc4)CC3)n2)cc1 InChI=1S/C23H26BrN5/c24-20-8-6-18(7-9-20)16-26-22-10-13-25-23(28-22)27-21-11-14-29(15-12-21)17-19-4-2-1-3-5-19/h1-10,13,21H,11-12,14-17H2,(H2,25,26,27,28) WOAVNWHCIXCOIZ-UHFFFAOYSA-N 50387097 CHEMBL2047226 Cholinesterase 4100 ChEMBL 10.1016/j.bmcl.2012.05.077 10.7270/Q27S7PSZ 22704921 Mohamed, T; Yeung, JC; Vasefi, MS; Beazely, MA; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50387097 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50387097&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70690352 160866180 CHEMBL2047226 ZINC84652488 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50943893 Clc1ccc(CNc2ccnc(NC3CCN(Cc4ccccc4)CC3)n2)cc1 InChI=1S/C23H26ClN5/c24-20-8-6-18(7-9-20)16-26-22-10-13-25-23(28-22)27-21-11-14-29(15-12-21)17-19-4-2-1-3-5-19/h1-10,13,21H,11-12,14-17H2,(H2,25,26,27,28) OODPIPSSGLSZPL-UHFFFAOYSA-N 50387093 CHEMBL2047225 Cholinesterase 2800 ChEMBL 10.1016/j.bmcl.2012.05.077 10.7270/Q27S7PSZ 22704921 Mohamed, T; Yeung, JC; Vasefi, MS; Beazely, MA; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50387093 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50387093&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70694566 160866176 CHEMBL2047225 ZINC84652487 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50943894 Clc1cccc(CNc2ccnc(NC3CCN(Cc4ccccc4)CC3)n2)c1 InChI=1S/C23H26ClN5/c24-20-8-4-7-19(15-20)16-26-22-9-12-25-23(28-22)27-21-10-13-29(14-11-21)17-18-5-2-1-3-6-18/h1-9,12,15,21H,10-11,13-14,16-17H2,(H2,25,26,27,28) KEOHOXIMLALKHI-UHFFFAOYSA-N 50387094 CHEMBL2047224 Cholinesterase 2500 ChEMBL 10.1016/j.bmcl.2012.05.077 10.7270/Q27S7PSZ 22704921 Mohamed, T; Yeung, JC; Vasefi, MS; Beazely, MA; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50387094 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50387094&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70686213 160866177 CHEMBL2047224 ZINC84652486 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50943895 Clc1ccccc1CNc1ccnc(NC2CCN(Cc3ccccc3)CC2)n1 InChI=1S/C23H26ClN5/c24-21-9-5-4-8-19(21)16-26-22-10-13-25-23(28-22)27-20-11-14-29(15-12-20)17-18-6-2-1-3-7-18/h1-10,13,20H,11-12,14-17H2,(H2,25,26,27,28) PWXHGWMZTWHEKM-UHFFFAOYSA-N 50387095 CHEMBL2047223 Cholinesterase 2400 ChEMBL 10.1016/j.bmcl.2012.05.077 10.7270/Q27S7PSZ 22704921 Mohamed, T; Yeung, JC; Vasefi, MS; Beazely, MA; Rao, PP University of Waterloo http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50387095 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50387095&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70690351 160866178 CHEMBL2047223 ZINC84652485 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50953152 Nc1nc(N2CCCC2)c(cc1C#N)C#N InChI=1S/C11H11N5/c12-6-8-5-9(7-13)11(15-10(8)14)16-3-1-2-4-16/h5H,1-4H2,(H2,14,15) SDLSAJBSFZJZJF-UHFFFAOYSA-N 50324049 2-Amino-6-(pyrrolidin-1'-yl)pyridine-3,5-dicarbonitrile::CHEMBL1214890 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2012.09.030 10.7270/Q2MP54CK 23078965 Samadi, A; Estrada, M; Perez, C; Rodriguez-Franco, MI; Iriepa, I; Moraleda, I; Chioua, M; Marco-Contelles, J Instituto de Qu£mica Org£nica General (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50324049 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50324049&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10059066 117645370 CHEMBL1214890 ZINC34145987 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50941539 COc1cc2C\C(=C\c3ccncc3)C(=O)c2cc1OCCCCCN1CCCCC1 InChI=1S/C26H32N2O3/c1-30-24-18-21-17-22(16-20-8-10-27-11-9-20)26(29)23(21)19-25(24)31-15-7-3-6-14-28-12-4-2-5-13-28/h8-11,16,18-19H,2-7,12-15,17H2,1H3/b22-16- LZPFKEYHRMTWRF-JWGURIENSA-N 50386056 CHEMBL2043055 Cholinesterase 9150 ChEMBL 10.1016/j.bmcl.2012.04.029 10.7270/Q2PC33DC 22633691 Meng, FC; Mao, F; Shan, WJ; Qin, F; Huang, L; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50386056 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50386056&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70688277 160865139 CHEMBL2043055 ZINC84714242 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50941540 COc1cc2C\C(=C\c3ccncc3)C(=O)c2cc1OCCCCCCN1CCCCC1 InChI=1S/C27H34N2O3/c1-31-25-19-22-18-23(17-21-9-11-28-12-10-21)27(30)24(22)20-26(25)32-16-8-3-2-5-13-29-14-6-4-7-15-29/h9-12,17,19-20H,2-8,13-16,18H2,1H3/b23-17- FDRDMTUUHLPPGY-QJOMJCCJSA-N 50386057 CHEMBL2043056 Cholinesterase 4470 ChEMBL 10.1016/j.bmcl.2012.04.029 10.7270/Q2PC33DC 22633691 Meng, FC; Mao, F; Shan, WJ; Qin, F; Huang, L; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50386057 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50386057&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70688278 160865140 CHEMBL2043056 ZINC84714246 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50941541 COc1cc2C\C(=C\c3ccncc3)C(=O)c2cc1OCCCCCCCCCN1CCCCC1 InChI=1S/C30H40N2O3/c1-34-28-22-25-21-26(20-24-12-14-31-15-13-24)30(33)27(25)23-29(28)35-19-11-6-4-2-3-5-8-16-32-17-9-7-10-18-32/h12-15,20,22-23H,2-11,16-19,21H2,1H3/b26-20- JMPWXBFNZNNWEP-QOMWVZHYSA-N 50386058 CHEMBL2043057 Cholinesterase 1240 ChEMBL 10.1016/j.bmcl.2012.04.029 10.7270/Q2PC33DC 22633691 Meng, FC; Mao, F; Shan, WJ; Qin, F; Huang, L; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50386058 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50386058&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70681888 160865141 CHEMBL2043057 ZINC84739371 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50941542 COc1cc2C\C(=C\c3ccncc3)C(=O)c2cc1OCCCCN1CCCC1 InChI=1S/C24H28N2O3/c1-28-22-16-19-15-20(14-18-6-8-25-9-7-18)24(27)21(19)17-23(22)29-13-5-4-12-26-10-2-3-11-26/h6-9,14,16-17H,2-5,10-13,15H2,1H3/b20-14- HSKVKKNWCNJPMX-ZHZULCJRSA-N 50386059 CHEMBL2043058 Cholinesterase 17480 ChEMBL 10.1016/j.bmcl.2012.04.029 10.7270/Q2PC33DC 22633691 Meng, FC; Mao, F; Shan, WJ; Qin, F; Huang, L; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50386059 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50386059&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70686139 160865142 CHEMBL2043058 ZINC84713325 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50941543 CCN(CC)CCCCOc1cc2C(=O)\C(Cc2cc1OC)=C/c1ccncc1 InChI=1S/C24H30N2O3/c1-4-26(5-2)12-6-7-13-29-23-17-21-19(16-22(23)28-3)15-20(24(21)27)14-18-8-10-25-11-9-18/h8-11,14,16-17H,4-7,12-13,15H2,1-3H3/b20-14- AAGGVYSSHNZWQJ-ZHZULCJRSA-N 50386060 CHEMBL2043059 Cholinesterase 28920 ChEMBL 10.1016/j.bmcl.2012.04.029 10.7270/Q2PC33DC 22633691 Meng, FC; Mao, F; Shan, WJ; Qin, F; Huang, L; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50386060 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50386060&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70686140 160865143 CHEMBL2043059 ZINC84713328 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50941544 COc1cc2C\C(=C\c3ccncc3)C(=O)c2cc1OCCCCCCn1ccnc1 InChI=1S/C25H27N3O3/c1-30-23-16-20-15-21(14-19-6-8-26-9-7-19)25(29)22(20)17-24(23)31-13-5-3-2-4-11-28-12-10-27-18-28/h6-10,12,14,16-18H,2-5,11,13,15H2,1H3/b21-14- BJTKHIVCKDJODM-STZFKDTASA-N 50386061 CHEMBL2043060 Cholinesterase 18500 ChEMBL 10.1016/j.bmcl.2012.04.029 10.7270/Q2PC33DC 22633691 Meng, FC; Mao, F; Shan, WJ; Qin, F; Huang, L; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50386061 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50386061&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70692452 160865144 CHEMBL2043060 ZINC84669290 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50941545 CCN(CC)CCCCCCOc1cc2C(=O)\C(Cc2cc1OC)=C/c1ccncc1 InChI=1S/C26H34N2O3/c1-4-28(5-2)14-8-6-7-9-15-31-25-19-23-21(18-24(25)30-3)17-22(26(23)29)16-20-10-12-27-13-11-20/h10-13,16,18-19H,4-9,14-15,17H2,1-3H3/b22-16- ROIHRCZLZCQLOF-JWGURIENSA-N 50386062 CHEMBL2043061 Cholinesterase 13360 ChEMBL 10.1016/j.bmcl.2012.04.029 10.7270/Q2PC33DC 22633691 Meng, FC; Mao, F; Shan, WJ; Qin, F; Huang, L; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50386062 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50386062&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70681889 160865145 CHEMBL2043061 ZINC84669291 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50941546 COc1cc2C\C(=C\c3ccccc3)C(=O)c2cc1OCCN1CCCCC1 InChI=1S/C24H27NO3/c1-27-22-16-19-15-20(14-18-8-4-2-5-9-18)24(26)21(19)17-23(22)28-13-12-25-10-6-3-7-11-25/h2,4-5,8-9,14,16-17H,3,6-7,10-13,15H2,1H3/b20-14- CLYNEIXYZJCSMD-ZHZULCJRSA-N 50386063 CHEMBL2043045 Cholinesterase 2240 ChEMBL 10.1016/j.bmcl.2012.04.029 10.7270/Q2PC33DC 22633691 Meng, FC; Mao, F; Shan, WJ; Qin, F; Huang, L; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50386063 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50386063&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70694503 160865146 CHEMBL2043045 ZINC84713255 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50941547 COc1cc2CC(Cc3ccccc3)C(=O)c2cc1OCCN1CCCCC1 InChI=1S/C24H29NO3/c1-27-22-16-19-15-20(14-18-8-4-2-5-9-18)24(26)21(19)17-23(22)28-13-12-25-10-6-3-7-11-25/h2,4-5,8-9,16-17,20H,3,6-7,10-15H2,1H3 OFTNVZBGWRGEGC-UHFFFAOYSA-N 50386064 CHEMBL2043046 Cholinesterase 9200 ChEMBL 10.1016/j.bmcl.2012.04.029 10.7270/Q2PC33DC 22633691 Meng, FC; Mao, F; Shan, WJ; Qin, F; Huang, L; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50386064 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50386064&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70686138 160865147 CHEMBL2043046 ZINC84713258 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50941548 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 13 ChEMBL 10.1016/j.bmcl.2012.04.029 10.7270/Q2PC33DC 22633691 Meng, FC; Mao, F; Shan, WJ; Qin, F; Huang, L; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50941549 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 4660 ChEMBL 10.1016/j.bmcl.2012.04.029 10.7270/Q2PC33DC 22633691 Meng, FC; Mao, F; Shan, WJ; Qin, F; Huang, L; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50941550 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 15700 ChEMBL 10.1016/j.bmcl.2012.04.029 10.7270/Q2PC33DC 22633691 Meng, FC; Mao, F; Shan, WJ; Qin, F; Huang, L; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50941551 COc1cc2C\C(=C\c3ccccn3)C(=O)c2cc1OCCN1CCCCC1 InChI=1S/C23H26N2O3/c1-27-21-15-17-13-18(14-19-7-3-4-8-24-19)23(26)20(17)16-22(21)28-12-11-25-9-5-2-6-10-25/h3-4,7-8,14-16H,2,5-6,9-13H2,1H3/b18-14- XCARREKMIQGPIC-JXAWBTAJSA-N 50386065 CHEMBL2043044 Cholinesterase 7480 ChEMBL 10.1016/j.bmcl.2012.04.029 10.7270/Q2PC33DC 22633691 Meng, FC; Mao, F; Shan, WJ; Qin, F; Huang, L; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50386065 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50386065&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70688274 160865148 CHEMBL2043044 ZINC84714172 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50941559 COc1cc2CCC(=O)c2cc1O InChI=1S/C10H10O3/c1-13-10-4-6-2-3-8(11)7(6)5-9(10)12/h4-5,12H,2-3H2,1H3 FEUMSMHGLKFCLZ-UHFFFAOYSA-N 50386066 CHEMBL2043047 Cholinesterase 258030 ChEMBL 10.1016/j.bmcl.2012.04.029 10.7270/Q2PC33DC 22633691 Meng, FC; Mao, F; Shan, WJ; Qin, F; Huang, L; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50386066 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50386066&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 233148 160865149 CHEMBL2043047 ZINC01865501 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50941560 COc1cc2C\C(=C\c3ccncc3)C(=O)c2cc1O InChI=1S/C16H13NO3/c1-20-15-8-11-7-12(6-10-2-4-17-5-3-10)16(19)13(11)9-14(15)18/h2-6,8-9,18H,7H2,1H3/b12-6- DVCZEPVABGCVNU-SDQBBNPISA-N 50386067 CHEMBL2043048 Cholinesterase 246800 ChEMBL 10.1016/j.bmcl.2012.04.029 10.7270/Q2PC33DC 22633691 Meng, FC; Mao, F; Shan, WJ; Qin, F; Huang, L; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50386067 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50386067&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 21814114 160865150 CHEMBL2043048 ZINC84726436 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50941561 COc1cc2CCC(=O)c2cc1OCCN1CCCCC1 InChI=1S/C17H23NO3/c1-20-16-11-13-5-6-15(19)14(13)12-17(16)21-10-9-18-7-3-2-4-8-18/h11-12H,2-10H2,1H3 BDQAXKXEEODUSX-UHFFFAOYSA-N 50386068 CHEMBL2043049 Cholinesterase 136500 ChEMBL 10.1016/j.bmcl.2012.04.029 10.7270/Q2PC33DC 22633691 Meng, FC; Mao, F; Shan, WJ; Qin, F; Huang, L; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50386068 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50386068&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 69201224 160865151 CHEMBL2043049 ZINC84668884 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50941562 COc1cc2CCC(=O)c2cc1OCCCN1CCCCC1 InChI=1S/C18H25NO3/c1-21-17-12-14-6-7-16(20)15(14)13-18(17)22-11-5-10-19-8-3-2-4-9-19/h12-13H,2-11H2,1H3 LRVRLQCYWIOPKT-UHFFFAOYSA-N 50386069 CHEMBL2043050 Cholinesterase 32950 ChEMBL 10.1016/j.bmcl.2012.04.029 10.7270/Q2PC33DC 22633691 Meng, FC; Mao, F; Shan, WJ; Qin, F; Huang, L; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50386069 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50386069&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70688275 160865152 CHEMBL2043050 ZINC84711999 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50941563 COc1cc2C\C(=C\c3ccncc3)C(=O)c2cc1OCCN1CCCCC1 InChI=1S/C23H26N2O3/c1-27-21-15-18-14-19(13-17-5-7-24-8-6-17)23(26)20(18)16-22(21)28-12-11-25-9-3-2-4-10-25/h5-8,13,15-16H,2-4,9-12,14H2,1H3/b19-13- FBYXBVYJGHCZDB-UYRXBGFRSA-N 50386070 CHEMBL2043052 Cholinesterase 9500 ChEMBL 10.1016/j.bmcl.2012.04.029 10.7270/Q2PC33DC 22633691 Meng, FC; Mao, F; Shan, WJ; Qin, F; Huang, L; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50386070 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50386070&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70696561 160865153 CHEMBL2043052 ZINC84668540 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50941578 COc1cc2CCC(=O)c2cc1OCCCCCN1CCCCC1 InChI=1S/C20H29NO3/c1-23-19-14-16-8-9-18(22)17(16)15-20(19)24-13-7-3-6-12-21-10-4-2-5-11-21/h14-15H,2-13H2,1H3 JJWSATBBRAKOQA-UHFFFAOYSA-N 50386071 CHEMBL2043051 Cholinesterase 114970 ChEMBL 10.1016/j.bmcl.2012.04.029 10.7270/Q2PC33DC 22633691 Meng, FC; Mao, F; Shan, WJ; Qin, F; Huang, L; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50386071 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50386071&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70696560 160865154 CHEMBL2043051 ZINC84690667 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50941537 COc1cc2C\C(=C\c3ccncc3)C(=O)c2cc1OCCCN1CCCCC1 InChI=1S/C24H28N2O3/c1-28-22-16-19-15-20(14-18-6-8-25-9-7-18)24(27)21(19)17-23(22)29-13-5-12-26-10-3-2-4-11-26/h6-9,14,16-17H,2-5,10-13,15H2,1H3/b20-14- NMJFZXKVBHMMRJ-ZHZULCJRSA-N 50386054 CHEMBL2043053 Cholinesterase 42720 ChEMBL 10.1016/j.bmcl.2012.04.029 10.7270/Q2PC33DC 22633691 Meng, FC; Mao, F; Shan, WJ; Qin, F; Huang, L; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50386054 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50386054&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70688276 160865137 CHEMBL2043053 ZINC84668541 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50941538 COc1cc2C\C(=C\c3ccncc3)C(=O)c2cc1OCCCCN1CCCCC1 InChI=1S/C25H30N2O3/c1-29-23-17-20-16-21(15-19-7-9-26-10-8-19)25(28)22(20)18-24(23)30-14-6-5-13-27-11-3-2-4-12-27/h7-10,15,17-18H,2-6,11-14,16H2,1H3/b21-15- CGHRJPHPMNKBOD-QNGOZBTKSA-N 50386055 CHEMBL2043054 Cholinesterase 13840 ChEMBL 10.1016/j.bmcl.2012.04.029 10.7270/Q2PC33DC 22633691 Meng, FC; Mao, F; Shan, WJ; Qin, F; Huang, L; Li, XS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50386055 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50386055&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70684009 160865138 CHEMBL2043054 ZINC84714238 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50956167 Oc1ccc(\C=C\C(=O)NCCNc2c3CCCCc3nc3ccccc23)cc1O InChI=1S/C24H25N3O3/c28-21-11-9-16(15-22(21)29)10-12-23(30)25-13-14-26-24-17-5-1-3-7-19(17)27-20-8-4-2-6-18(20)24/h1,3,5,7,9-12,15,28-29H,2,4,6,8,13-14H2,(H,25,30)(H,26,27)/b12-10+ NYPGWOUCPPWWJR-ZRDIBKRKSA-N 50392419 CHEMBL2151784 Cholinesterase 2300 ChEMBL 10.1016/j.bmcl.2012.08.036 10.7270/Q2Q52QQQ 22981331 Chao, X; He, X; Yang, Y; Zhou, X; Jin, M; Liu, S; Cheng, Z; Liu, P; Wang, Y; Yu, J; Tan, Y; Huang, Y; Qin, J; Rapposelli, S; Pi, R Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50392419 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50392419&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71461948 163341443 CHEMBL2151784 ZINC95572947 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50956168 Oc1ccc(\C=C\C(=O)NCCCNc2c3CCCCc3nc3ccccc23)cc1O InChI=1S/C25H27N3O3/c29-22-12-10-17(16-23(22)30)11-13-24(31)26-14-5-15-27-25-18-6-1-3-8-20(18)28-21-9-4-2-7-19(21)25/h1,3,6,8,10-13,16,29-30H,2,4-5,7,9,14-15H2,(H,26,31)(H,27,28)/b13-11+ AEMIQXVCZRZSRZ-ACCUITESSA-N 50392420 CHEMBL2151785 Cholinesterase 83.7 ChEMBL 10.1016/j.bmcl.2012.08.036 10.7270/Q2Q52QQQ 22981331 Chao, X; He, X; Yang, Y; Zhou, X; Jin, M; Liu, S; Cheng, Z; Liu, P; Wang, Y; Yu, J; Tan, Y; Huang, Y; Qin, J; Rapposelli, S; Pi, R Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50392420 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50392420&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71458388 163341444 CHEMBL2151785 ZINC95578864 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50956169 Oc1ccc(\C=C\C(=O)NCCCCCCNc2c3CCCCc3nc3ccccc23)cc1O InChI=1S/C28H33N3O3/c32-25-15-13-20(19-26(25)33)14-16-27(34)29-17-7-1-2-8-18-30-28-21-9-3-5-11-23(21)31-24-12-6-4-10-22(24)28/h3,5,9,11,13-16,19,32-33H,1-2,4,6-8,10,12,17-18H2,(H,29,34)(H,30,31)/b16-14+ GIWDJAVTRUSUSC-JQIJEIRASA-N 50392421 CHEMBL2151786 Cholinesterase 3900 ChEMBL 10.1016/j.bmcl.2012.08.036 10.7270/Q2Q52QQQ 22981331 Chao, X; He, X; Yang, Y; Zhou, X; Jin, M; Liu, S; Cheng, Z; Liu, P; Wang, Y; Yu, J; Tan, Y; Huang, Y; Qin, J; Rapposelli, S; Pi, R Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50392421 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50392421&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71454766 163341445 CHEMBL2151786 ZINC95578857 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50956170 Oc1ccc(\C=C\C(=O)NCCNc2c3CCCCc3nc3cc(Cl)ccc23)cc1O InChI=1S/C24H24ClN3O3/c25-16-7-8-18-20(14-16)28-19-4-2-1-3-17(19)24(18)27-12-11-26-23(31)10-6-15-5-9-21(29)22(30)13-15/h5-10,13-14,29-30H,1-4,11-12H2,(H,26,31)(H,27,28)/b10-6+ LSWZCBBLZDXUAT-UXBLZVDNSA-N 50392422 CHEMBL2151787 Cholinesterase 5500 ChEMBL 10.1016/j.bmcl.2012.08.036 10.7270/Q2Q52QQQ 22981331 Chao, X; He, X; Yang, Y; Zhou, X; Jin, M; Liu, S; Cheng, Z; Liu, P; Wang, Y; Yu, J; Tan, Y; Huang, Y; Qin, J; Rapposelli, S; Pi, R Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50392422 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50392422&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71461949 163341446 CHEMBL2151787 ZINC95572977 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50956171 Oc1ccc(\C=C\C(=O)NCCCNc2c3CCCCc3nc3cc(Cl)ccc23)cc1O InChI=1S/C25H26ClN3O3/c26-17-8-9-19-21(15-17)29-20-5-2-1-4-18(20)25(19)28-13-3-12-27-24(32)11-7-16-6-10-22(30)23(31)14-16/h6-11,14-15,30-31H,1-5,12-13H2,(H,27,32)(H,28,29)/b11-7+ ZWOYDSCDPFSNLK-YRNVUSSQSA-N 50392423 CHEMBL2151788 Cholinesterase 29500 ChEMBL 10.1016/j.bmcl.2012.08.036 10.7270/Q2Q52QQQ 22981331 Chao, X; He, X; Yang, Y; Zhou, X; Jin, M; Liu, S; Cheng, Z; Liu, P; Wang, Y; Yu, J; Tan, Y; Huang, Y; Qin, J; Rapposelli, S; Pi, R Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50392423 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50392423&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71456537 163341447 CHEMBL2151788 ZINC95576562 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50956172 Oc1ccc(\C=C\C(=O)NCCCCCCNc2c3CCCCc3nc3cc(Cl)ccc23)cc1O InChI=1S/C28H32ClN3O3/c29-20-11-12-22-24(18-20)32-23-8-4-3-7-21(23)28(22)31-16-6-2-1-5-15-30-27(35)14-10-19-9-13-25(33)26(34)17-19/h9-14,17-18,33-34H,1-8,15-16H2,(H,30,35)(H,31,32)/b14-10+ PBISLIYZMJMPKF-GXDHUFHOSA-N 50392424 CHEMBL2151789 Cholinesterase 3800 ChEMBL 10.1016/j.bmcl.2012.08.036 10.7270/Q2Q52QQQ 22981331 Chao, X; He, X; Yang, Y; Zhou, X; Jin, M; Liu, S; Cheng, Z; Liu, P; Wang, Y; Yu, J; Tan, Y; Huang, Y; Qin, J; Rapposelli, S; Pi, R Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50392424 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50392424&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71451207 163341448 CHEMBL2151789 ZINC95573537 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50956173 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 100 ChEMBL 10.1016/j.bmcl.2012.08.036 10.7270/Q2Q52QQQ 22981331 Chao, X; He, X; Yang, Y; Zhou, X; Jin, M; Liu, S; Cheng, Z; Liu, P; Wang, Y; Yu, J; Tan, Y; Huang, Y; Qin, J; Rapposelli, S; Pi, R Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50954087 Oc1ccccc1CNCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C22H25N3O/c26-21-12-6-1-7-16(21)15-23-13-14-24-22-17-8-2-4-10-19(17)25-20-11-5-3-9-18(20)22/h1-2,4,6-8,10,12,23,26H,3,5,9,11,13-15H2,(H,24,25) YZGYKMFGKGZXTR-UHFFFAOYSA-N 50391522 CHEMBL2147355 Cholinesterase 10 ChEMBL 10.1016/j.bmc.2012.07.045 10.7270/Q22R3SRB 22944335 Mao, F; Huang, L; Luo, Z; Liu, A; Lu, C; Xie, Z; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50391522 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50391522&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71456414 163340546 CHEMBL2147355 ZINC95560852 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50954088 Oc1ccccc1CNCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C23H27N3O/c27-22-13-6-1-8-17(22)16-24-14-7-15-25-23-18-9-2-4-11-20(18)26-21-12-5-3-10-19(21)23/h1-2,4,6,8-9,11,13,24,27H,3,5,7,10,12,14-16H2,(H,25,26) PXIRZFSARGCTPF-UHFFFAOYSA-N 50391523 CHEMBL2147356 Cholinesterase 46.13 ChEMBL 10.1016/j.bmc.2012.07.045 10.7270/Q22R3SRB 22944335 Mao, F; Huang, L; Luo, Z; Liu, A; Lu, C; Xie, Z; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50391523 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50391523&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71461834 163340547 CHEMBL2147356 ZINC95561592 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50954089 Oc1ccccc1CNCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C24H29N3O/c28-23-14-6-1-9-18(23)17-25-15-7-8-16-26-24-19-10-2-4-12-21(19)27-22-13-5-3-11-20(22)24/h1-2,4,6,9-10,12,14,25,28H,3,5,7-8,11,13,15-17H2,(H,26,27) OAZWZTVBEQJENH-UHFFFAOYSA-N 50391524 CHEMBL2147357 Cholinesterase 20.25 ChEMBL 10.1016/j.bmc.2012.07.045 10.7270/Q22R3SRB 22944335 Mao, F; Huang, L; Luo, Z; Liu, A; Lu, C; Xie, Z; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50391524 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50391524&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71458266 163340548 CHEMBL2147357 ZINC95562822 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50954090 Oc1ccccc1CNCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C26H33N3O/c30-25-16-8-3-11-20(25)19-27-17-9-1-2-10-18-28-26-21-12-4-6-14-23(21)29-24-15-7-5-13-22(24)26/h3-4,6,8,11-12,14,16,27,30H,1-2,5,7,9-10,13,15,17-19H2,(H,28,29) LQAGILIRBJKYDY-UHFFFAOYSA-N 50391525 CHEMBL2147358 Cholinesterase 9.65 ChEMBL 10.1016/j.bmc.2012.07.045 10.7270/Q22R3SRB 22944335 Mao, F; Huang, L; Luo, Z; Liu, A; Lu, C; Xie, Z; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50391525 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50391525&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71460116 163340549 CHEMBL2147358 ZINC95560871 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50954091 Oc1ccccc1CNCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C27H35N3O/c31-26-17-9-4-12-21(26)20-28-18-10-2-1-3-11-19-29-27-22-13-5-7-15-24(22)30-25-16-8-6-14-23(25)27/h4-5,7,9,12-13,15,17,28,31H,1-3,6,8,10-11,14,16,18-20H2,(H,29,30) ZYEZHQVZVSWGMV-UHFFFAOYSA-N 50391526 CHEMBL2147359 Cholinesterase 5.84 ChEMBL 10.1016/j.bmc.2012.07.045 10.7270/Q22R3SRB 22944335 Mao, F; Huang, L; Luo, Z; Liu, A; Lu, C; Xie, Z; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50391526 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50391526&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71452908 163340550 CHEMBL2147359 ZINC95559171 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50954092 Oc1ccccc1CNCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C28H37N3O/c32-27-18-10-5-13-22(27)21-29-19-11-3-1-2-4-12-20-30-28-23-14-6-8-16-25(23)31-26-17-9-7-15-24(26)28/h5-6,8,10,13-14,16,18,29,32H,1-4,7,9,11-12,15,17,19-21H2,(H,30,31) RGFFJLGDSFNWLQ-UHFFFAOYSA-N 50345203 2-((8-(1,2,3,4-Tetrahydroacridin-9-ylamino)octylamino)methyl)phenol::CHEMBL1783239 Cholinesterase 6.25 ChEMBL 10.1016/j.bmc.2012.07.045 10.7270/Q22R3SRB 22944335 Mao, F; Huang, L; Luo, Z; Liu, A; Lu, C; Xie, Z; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50345203 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50345203&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53304561 131348139 CHEMBL1783239 ZINC71295099 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50954093 Oc1ccccc1CNCCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C29H39N3O/c33-28-19-11-6-14-23(28)22-30-20-12-4-2-1-3-5-13-21-31-29-24-15-7-9-17-26(24)32-27-18-10-8-16-25(27)29/h6-7,9,11,14-15,17,19,30,33H,1-5,8,10,12-13,16,18,20-22H2,(H,31,32) DHSGJXAHIBZFFJ-UHFFFAOYSA-N 50391527 CHEMBL2147360 Cholinesterase 8.2 ChEMBL 10.1016/j.bmc.2012.07.045 10.7270/Q22R3SRB 22944335 Mao, F; Huang, L; Luo, Z; Liu, A; Lu, C; Xie, Z; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50391527 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50391527&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71460117 163340551 CHEMBL2147360 ZINC95560078 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50954094 Oc1ccccc1CNCCNc1c2CCCCc2nc2cc(Cl)ccc12 InChI=1S/C22H24ClN3O/c23-16-9-10-18-20(13-16)26-19-7-3-2-6-17(19)22(18)25-12-11-24-14-15-5-1-4-8-21(15)27/h1,4-5,8-10,13,24,27H,2-3,6-7,11-12,14H2,(H,25,26) HTFBKDDAHNIJIM-UHFFFAOYSA-N 50391528 CHEMBL2147361 Cholinesterase 9.97 ChEMBL 10.1016/j.bmc.2012.07.045 10.7270/Q22R3SRB 22944335 Mao, F; Huang, L; Luo, Z; Liu, A; Lu, C; Xie, Z; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50391528 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50391528&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71451088 163340552 CHEMBL2147361 ZINC95562446 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50954095 Oc1ccccc1CNCCCNc1c2CCCCc2nc2cc(Cl)ccc12 InChI=1S/C23H26ClN3O/c24-17-10-11-19-21(14-17)27-20-8-3-2-7-18(20)23(19)26-13-5-12-25-15-16-6-1-4-9-22(16)28/h1,4,6,9-11,14,25,28H,2-3,5,7-8,12-13,15H2,(H,26,27) IIJOMUMHOGODMP-UHFFFAOYSA-N 50391529 CHEMBL2147362 Cholinesterase 76.51 ChEMBL 10.1016/j.bmc.2012.07.045 10.7270/Q22R3SRB 22944335 Mao, F; Huang, L; Luo, Z; Liu, A; Lu, C; Xie, Z; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50391529 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50391529&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71456415 163340553 CHEMBL2147362 ZINC95558705 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50954096 Oc1ccccc1CNCCCCNc1c2CCCCc2nc2cc(Cl)ccc12 InChI=1S/C24H28ClN3O/c25-18-11-12-20-22(15-18)28-21-9-3-2-8-19(21)24(20)27-14-6-5-13-26-16-17-7-1-4-10-23(17)29/h1,4,7,10-12,15,26,29H,2-3,5-6,8-9,13-14,16H2,(H,27,28) DZCWPLOFGHBGEG-UHFFFAOYSA-N 50391530 CHEMBL2147363 Cholinesterase 28.09 ChEMBL 10.1016/j.bmc.2012.07.045 10.7270/Q22R3SRB 22944335 Mao, F; Huang, L; Luo, Z; Liu, A; Lu, C; Xie, Z; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50391530 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50391530&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71456416 163340554 CHEMBL2147363 ZINC95558267 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50954097 Oc1ccccc1CNCCCCCCNc1c2CCCCc2nc2cc(Cl)ccc12 InChI=1S/C26H32ClN3O/c27-20-13-14-22-24(17-20)30-23-11-5-4-10-21(23)26(22)29-16-8-2-1-7-15-28-18-19-9-3-6-12-25(19)31/h3,6,9,12-14,17,28,31H,1-2,4-5,7-8,10-11,15-16,18H2,(H,29,30) YNMJBNMTGPFCKD-UHFFFAOYSA-N 50391531 CHEMBL2147457 Cholinesterase 11.1 ChEMBL 10.1016/j.bmc.2012.07.045 10.7270/Q22R3SRB 22944335 Mao, F; Huang, L; Luo, Z; Liu, A; Lu, C; Xie, Z; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50391531 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50391531&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71451096 163340555 CHEMBL2147457 ZINC95558755 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50954098 Oc1ccccc1CNCCCCCCCNc1c2CCCCc2nc2cc(Cl)ccc12 InChI=1S/C27H34ClN3O/c28-21-14-15-23-25(18-21)31-24-12-6-5-11-22(24)27(23)30-17-9-3-1-2-8-16-29-19-20-10-4-7-13-26(20)32/h4,7,10,13-15,18,29,32H,1-3,5-6,8-9,11-12,16-17,19H2,(H,30,31) KGRWZINXJXJSOA-UHFFFAOYSA-N 50391532 CHEMBL2147458 Cholinesterase 17.79 ChEMBL 10.1016/j.bmc.2012.07.045 10.7270/Q22R3SRB 22944335 Mao, F; Huang, L; Luo, Z; Liu, A; Lu, C; Xie, Z; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50391532 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50391532&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71452917 163340556 CHEMBL2147458 ZINC95560094 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50954099 Oc1ccccc1CNCCCCCCCCNc1c2CCCCc2nc2cc(Cl)ccc12 InChI=1S/C28H36ClN3O/c29-22-15-16-24-26(19-22)32-25-13-7-6-12-23(25)28(24)31-18-10-4-2-1-3-9-17-30-20-21-11-5-8-14-27(21)33/h5,8,11,14-16,19,30,33H,1-4,6-7,9-10,12-13,17-18,20H2,(H,31,32) QFULVZFCCVVSSF-UHFFFAOYSA-N 50391533 CHEMBL2147456 Cholinesterase 18.48 ChEMBL 10.1016/j.bmc.2012.07.045 10.7270/Q22R3SRB 22944335 Mao, F; Huang, L; Luo, Z; Liu, A; Lu, C; Xie, Z; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50391533 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50391533&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71461840 163340557 CHEMBL2147456 ZINC95558767 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50954100 Oc1ccccc1CNCCCCCCCCCNc1c2CCCCc2nc2cc(Cl)ccc12 InChI=1S/C29H38ClN3O/c30-23-16-17-25-27(20-23)33-26-14-8-7-13-24(26)29(25)32-19-11-5-3-1-2-4-10-18-31-21-22-12-6-9-15-28(22)34/h6,9,12,15-17,20,31,34H,1-5,7-8,10-11,13-14,18-19,21H2,(H,32,33) KSFLJDVWZWUKRC-UHFFFAOYSA-N 50391534 CHEMBL2147459 Cholinesterase 22.98 ChEMBL 10.1016/j.bmc.2012.07.045 10.7270/Q22R3SRB 22944335 Mao, F; Huang, L; Luo, Z; Liu, A; Lu, C; Xie, Z; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50391534 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50391534&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71452918 163340558 CHEMBL2147459 ZINC95562024 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50954101 CN(C)c1ccccc1CNCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C29H40N4/c1-33(2)28-19-11-6-14-23(28)22-30-20-12-4-3-5-13-21-31-29-24-15-7-9-17-26(24)32-27-18-10-8-16-25(27)29/h6-7,9,11,14-15,17,19,30H,3-5,8,10,12-13,16,18,20-22H2,1-2H3,(H,31,32) FJPIMKXINVWPJB-UHFFFAOYSA-N 50391535 CHEMBL2147460 Cholinesterase 2.92 ChEMBL 10.1016/j.bmc.2012.07.045 10.7270/Q22R3SRB 22944335 Mao, F; Huang, L; Luo, Z; Liu, A; Lu, C; Xie, Z; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50391535 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50391535&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71460126 163340559 CHEMBL2147460 ZINC95558310 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50954102 CN(C)c1ccccc1CNCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C30H42N4/c1-34(2)29-20-12-7-15-24(29)23-31-21-13-5-3-4-6-14-22-32-30-25-16-8-10-18-27(25)33-28-19-11-9-17-26(28)30/h7-8,10,12,15-16,18,20,31H,3-6,9,11,13-14,17,19,21-23H2,1-2H3,(H,32,33) QYEGQBBNFVLNBH-UHFFFAOYSA-N 50391536 CHEMBL2147461 Cholinesterase 2.11 ChEMBL 10.1016/j.bmc.2012.07.045 10.7270/Q22R3SRB 22944335 Mao, F; Huang, L; Luo, Z; Liu, A; Lu, C; Xie, Z; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50391536 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50391536&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71452919 163340560 CHEMBL2147461 ZINC95558368 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50954103 CN(C)c1ccccc1CNCCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C31H44N4/c1-35(2)30-21-13-8-16-25(30)24-32-22-14-6-4-3-5-7-15-23-33-31-26-17-9-11-19-28(26)34-29-20-12-10-18-27(29)31/h8-9,11,13,16-17,19,21,32H,3-7,10,12,14-15,18,20,22-24H2,1-2H3,(H,33,34) QDAAXOQEIPAFJS-UHFFFAOYSA-N 50391537 CHEMBL2147462 Cholinesterase 2.65 ChEMBL 10.1016/j.bmc.2012.07.045 10.7270/Q22R3SRB 22944335 Mao, F; Huang, L; Luo, Z; Liu, A; Lu, C; Xie, Z; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50391537 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50391537&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71461841 163340561 CHEMBL2147462 ZINC95562045 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50954104 CCN(CC)c1ccccc1CNCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C32H46N4/c1-3-36(4-2)31-22-14-9-17-26(31)25-33-23-15-7-5-6-8-16-24-34-32-27-18-10-12-20-29(27)35-30-21-13-11-19-28(30)32/h9-10,12,14,17-18,20,22,33H,3-8,11,13,15-16,19,21,23-25H2,1-2H3,(H,34,35) PJRLIZPQYQHGHE-UHFFFAOYSA-N 50391538 CHEMBL2147463 Cholinesterase 2.82 ChEMBL 10.1016/j.bmc.2012.07.045 10.7270/Q22R3SRB 22944335 Mao, F; Huang, L; Luo, Z; Liu, A; Lu, C; Xie, Z; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50391538 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50391538&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71451097 163340562 CHEMBL2147463 ZINC95558334 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50954105 C(CCCCNc1c2CCCCc2nc2ccccc12)CCCNCc1ccccn1 InChI=1S/C27H36N4/c1(3-10-18-28-21-22-13-9-12-19-29-22)2-4-11-20-30-27-23-14-5-7-16-25(23)31-26-17-8-6-15-24(26)27/h5,7,9,12-14,16,19,28H,1-4,6,8,10-11,15,17-18,20-21H2,(H,30,31) XMOSBLJPEBOIEB-UHFFFAOYSA-N 50391539 CHEMBL2147464 Cholinesterase 2.99 ChEMBL 10.1016/j.bmc.2012.07.045 10.7270/Q22R3SRB 22944335 Mao, F; Huang, L; Luo, Z; Liu, A; Lu, C; Xie, Z; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50391539 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50391539&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71451098 163340563 CHEMBL2147464 ZINC95561214 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50954106 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 15.8 ChEMBL 10.1016/j.bmc.2012.07.045 10.7270/Q22R3SRB 22944335 Mao, F; Huang, L; Luo, Z; Liu, A; Lu, C; Xie, Z; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50956533 CN(CCCCCN(C)c1cc2nc(nn(-c3ccccc3)c2cc1=O)-c1ccccc1)Cc1ccccc1 InChI=1S/C33H35N5O/c1-36(25-26-15-7-3-8-16-26)21-13-6-14-22-37(2)31-23-29-30(24-32(31)39)38(28-19-11-5-12-20-28)35-33(34-29)27-17-9-4-10-18-27/h3-5,7-12,15-20,23-24H,6,13-14,21-22,25H2,1-2H3 IOZXVPRYPZPTHB-UHFFFAOYSA-N 50392583 CHEMBL2153022 Cholinesterase 1900 ChEMBL 10.1016/j.ejmech.2012.10.003 10.7270/Q2DR2WMH 23108363 Catto, M; Berezin, AA; Lo Re, D; Loizou, G; Demetriades, M; De Stradis, A; Campagna, F; Koutentis, PA; Carotti, A Universit£ degli Studi di Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50392583 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50392583&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71460317 163341607 CHEMBL2153022 ZINC95576063 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50956534 CN(CCCCCCCCN(C)c1cc2nc(nn(-c3ccccc3)c2cc1=O)-c1ccccc1)Cc1ccccc1 InChI=1S/C36H41N5O/c1-39(28-29-18-10-7-11-19-29)24-16-5-3-4-6-17-25-40(2)34-26-32-33(27-35(34)42)41(31-22-14-9-15-23-31)38-36(37-32)30-20-12-8-13-21-30/h7-15,18-23,26-27H,3-6,16-17,24-25,28H2,1-2H3 QSCUQGSALNRSCA-UHFFFAOYSA-N 50392584 CHEMBL2153024 Cholinesterase 310 ChEMBL 10.1016/j.ejmech.2012.10.003 10.7270/Q2DR2WMH 23108363 Catto, M; Berezin, AA; Lo Re, D; Loizou, G; Demetriades, M; De Stradis, A; Campagna, F; Koutentis, PA; Carotti, A Universit£ degli Studi di Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50392584 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50392584&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71451281 163341608 CHEMBL2153024 ZINC95573564 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50956535 CN(C)CCCN(C)c1cc2nc(nn3c4ccccc4c(c23)c1=O)-c1ccccc1 InChI=1S/C25H25N5O/c1-28(2)14-9-15-29(3)21-16-19-23-22(24(21)31)18-12-7-8-13-20(18)30(23)27-25(26-19)17-10-5-4-6-11-17/h4-8,10-13,16H,9,14-15H2,1-3H3 FSNPZUVJTKGPOV-UHFFFAOYSA-N 50392585 CHEMBL2153030 Cholinesterase 4000 ChEMBL 10.1016/j.ejmech.2012.10.003 10.7270/Q2DR2WMH 23108363 Catto, M; Berezin, AA; Lo Re, D; Loizou, G; Demetriades, M; De Stradis, A; Campagna, F; Koutentis, PA; Carotti, A Universit£ degli Studi di Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50392585 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50392585&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71458467 163341609 CHEMBL2153030 ZINC95575943 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50956536 CN(CCCCCCCCN(C)c1cc2nc(nn3c4ccccc4c(c23)c1=O)-c1ccccc1)Cc1ccccc1 InChI=1S/C36H39N5O/c1-39(26-27-17-9-7-10-18-27)23-15-5-3-4-6-16-24-40(2)32-25-30-34-33(35(32)42)29-21-13-14-22-31(29)41(34)38-36(37-30)28-19-11-8-12-20-28/h7-14,17-22,25H,3-6,15-16,23-24,26H2,1-2H3 BTHSAKDAWXIOHX-UHFFFAOYSA-N 50392586 CHEMBL2153036 Cholinesterase 25 ChEMBL 10.1016/j.ejmech.2012.10.003 10.7270/Q2DR2WMH 23108363 Catto, M; Berezin, AA; Lo Re, D; Loizou, G; Demetriades, M; De Stradis, A; Campagna, F; Koutentis, PA; Carotti, A Universit£ degli Studi di Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50392586 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50392586&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71449480 163341610 CHEMBL2153036 ZINC95577158 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965956 COc1cc(\C=C\C(=O)NCCCNc2c3CCCCc3nc3ccccc23)ccc1OCCO[N+]([O-])=O InChI=1S/C28H32N4O6/c1-36-26-19-20(11-13-25(26)37-17-18-38-32(34)35)12-14-27(33)29-15-6-16-30-28-21-7-2-4-9-23(21)31-24-10-5-3-8-22(24)28/h2,4,7,9,11-14,19H,3,5-6,8,10,15-18H2,1H3,(H,29,33)(H,30,31)/b14-12+ KQWCLBFRMLZCNA-WYMLVPIESA-N 50396109 CHEMBL2171313 Cholinesterase 24.9 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396109 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396109&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57521473 163345133 CHEMBL2171313 ZINC95557566 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965957 COc1cc(\C=C\C(=O)NCCNc2c3CCCCc3nc3ccccc23)ccc1OCCCCCCO[N+]([O-])=O InChI=1S/C31H38N4O6/c1-39-29-22-23(14-16-28(29)40-20-8-2-3-9-21-41-35(37)38)15-17-30(36)32-18-19-33-31-24-10-4-6-12-26(24)34-27-13-7-5-11-25(27)31/h4,6,10,12,14-17,22H,2-3,5,7-9,11,13,18-21H2,1H3,(H,32,36)(H,33,34)/b17-15+ BUTINQKWVMUCFM-BMRADRMJSA-N 50396110 CHEMBL2171312 Cholinesterase 21.8 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396110 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396110&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57521472 163345134 CHEMBL2171312 ZINC95552617 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965958 COc1cc(\C=C\C(=O)NCCNc2c3CCCCc3nc3ccccc23)ccc1OCCCCO[N+]([O-])=O InChI=1S/C29H34N4O6/c1-37-27-20-21(12-14-26(27)38-18-6-7-19-39-33(35)36)13-15-28(34)30-16-17-31-29-22-8-2-4-10-24(22)32-25-11-5-3-9-23(25)29/h2,4,8,10,12-15,20H,3,5-7,9,11,16-19H2,1H3,(H,30,34)(H,31,32)/b15-13+ PCUAPIPQRZANHJ-FYWRMAATSA-N 50396111 CHEMBL2171311 Cholinesterase 7.6 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396111 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396111&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57521471 163345135 CHEMBL2171311 ZINC95552291 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965959 COc1cc(\C=C\C(=O)NCCNc2c3CCCCc3nc3ccccc23)ccc1OCCCO[N+]([O-])=O InChI=1S/C28H32N4O6/c1-36-26-19-20(11-13-25(26)37-17-6-18-38-32(34)35)12-14-27(33)29-15-16-30-28-21-7-2-4-9-23(21)31-24-10-5-3-8-22(24)28/h2,4,7,9,11-14,19H,3,5-6,8,10,15-18H2,1H3,(H,29,33)(H,30,31)/b14-12+ UNHZVFVBIVAPKU-WYMLVPIESA-N 50396112 CHEMBL2171334 Cholinesterase 8.4 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396112 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396112&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57521470 163345136 CHEMBL2171334 ZINC95554499 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965960 COc1cc(\C=C\C(=O)NCCNc2c3CCCCc3nc3ccccc23)ccc1OCCO[N+]([O-])=O InChI=1S/C27H30N4O6/c1-35-25-18-19(10-12-24(25)36-16-17-37-31(33)34)11-13-26(32)28-14-15-29-27-20-6-2-4-8-22(20)30-23-9-5-3-7-21(23)27/h2,4,6,8,10-13,18H,3,5,7,9,14-17H2,1H3,(H,28,32)(H,29,30)/b13-11+ PSMMLTDOFSEEAG-ACCUITESSA-N 50396113 CHEMBL2171333 Cholinesterase 10.5 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396113 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396113&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57521364 163345137 CHEMBL2171333 ZINC95556513 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965961 COc1cc(\C=C\C(O)=O)ccc1OCCCCCCO[N+]([O-])=O InChI=1S/C16H21NO7/c1-22-15-12-13(7-9-16(18)19)6-8-14(15)23-10-4-2-3-5-11-24-17(20)21/h6-9,12H,2-5,10-11H2,1H3,(H,18,19)/b9-7+ ZEDVBWFTUWXMCH-VQHVLOKHSA-N 50396114 CHEMBL2171332 Cholinesterase >10000 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396114 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396114&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57522016 163345138 CHEMBL2171332 ZINC95556301 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965962 COc1cc(\C=C\C(O)=O)ccc1OCCCCO[N+]([O-])=O InChI=1S/C14H17NO7/c1-20-13-10-11(5-7-14(16)17)4-6-12(13)21-8-2-3-9-22-15(18)19/h4-7,10H,2-3,8-9H2,1H3,(H,16,17)/b7-5+ QUMLMSGIJMAYKM-FNORWQNLSA-N 50396115 CHEMBL2171331 Cholinesterase >10000 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396115 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396115&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57522015 163345139 CHEMBL2171331 ZINC95556921 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965963 COc1cc(\C=C\C(O)=O)ccc1OCCCO[N+]([O-])=O InChI=1S/C13H15NO7/c1-19-12-9-10(4-6-13(15)16)3-5-11(12)20-7-2-8-21-14(17)18/h3-6,9H,2,7-8H2,1H3,(H,15,16)/b6-4+ WZAOGUQJVYJNJU-GQCTYLIASA-N 50396116 CHEMBL2171330 Cholinesterase >10000 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396116 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396116&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57521894 163345140 CHEMBL2171330 ZINC95554852 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965964 COc1cc(\C=C\C(O)=O)ccc1OCCO[N+]([O-])=O InChI=1S/C12H13NO7/c1-18-11-8-9(3-5-12(14)15)2-4-10(11)19-6-7-20-13(16)17/h2-5,8H,6-7H2,1H3,(H,14,15)/b5-3+ WXYQLRQBMASZKE-HWKANZROSA-N 50396117 CHEMBL2171329 Cholinesterase >10000 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396117 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396117&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57521893 163345141 CHEMBL2171329 ZINC95553427 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965965 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 10.6 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965966 COc1cc(\C=C\C(=O)NCCCCCCNc2c3CCCCc3nc3ccccc23)ccc1O InChI=1S/C29H35N3O3/c1-35-27-20-21(14-16-26(27)33)15-17-28(34)30-18-8-2-3-9-19-31-29-22-10-4-6-12-24(22)32-25-13-7-5-11-23(25)29/h4,6,10,12,14-17,20,33H,2-3,5,7-9,11,13,18-19H2,1H3,(H,30,34)(H,31,32)/b17-15+ KKKODFFFJFQMSI-BMRADRMJSA-N 50396118 CHEMBL2171309 Cholinesterase 26.3 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396118 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396118&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57521363 163345142 CHEMBL2171309 ZINC95554876 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965967 CCCOc1ccc(\C=C\C(=O)NCCCNc2c3CCCCc3nc3ccccc23)cc1OC InChI=1S/C29H35N3O3/c1-3-19-35-26-15-13-21(20-27(26)34-2)14-16-28(33)30-17-8-18-31-29-22-9-4-6-11-24(22)32-25-12-7-5-10-23(25)29/h4,6,9,11,13-16,20H,3,5,7-8,10,12,17-19H2,1-2H3,(H,30,33)(H,31,32)/b16-14+ MPXQSLWIVILKJD-JQIJEIRASA-N 50396119 CHEMBL2171308 Cholinesterase 40.3 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396119 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396119&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57521889 163345143 CHEMBL2171308 ZINC95552349 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965968 COc1cc(\C=C\C(=O)NCCCCCCCCNc2c3CCCCc3nc3ccccc23)ccc1OCCCCCCO[N+]([O-])=O InChI=1S/C37H50N4O6/c1-45-35-28-29(20-22-34(35)46-26-14-6-7-15-27-47-41(43)44)21-23-36(42)38-24-12-4-2-3-5-13-25-39-37-30-16-8-10-18-32(30)40-33-19-11-9-17-31(33)37/h8,10,16,18,20-23,28H,2-7,9,11-15,17,19,24-27H2,1H3,(H,38,42)(H,39,40)/b23-21+ QQFGVNJQUPSBQA-XTQSDGFTSA-N 50396120 CHEMBL2169901 Cholinesterase 1.9 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396120 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396120&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57521888 163345144 CHEMBL2169901 ZINC95555499 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965969 COc1cc(\C=C\C(=O)NCCCCCCCCNc2c3CCCCc3nc3ccccc23)ccc1OCCCCO[N+]([O-])=O InChI=1S/C35H46N4O6/c1-43-33-26-27(18-20-32(33)44-24-12-13-25-45-39(41)42)19-21-34(40)36-22-10-4-2-3-5-11-23-37-35-28-14-6-8-16-30(28)38-31-17-9-7-15-29(31)35/h6,8,14,16,18-21,26H,2-5,7,9-13,15,17,22-25H2,1H3,(H,36,40)(H,37,38)/b21-19+ BJJCLZUIJHPKEU-XUTLUUPISA-N 50396121 CHEMBL2171327 Cholinesterase 1.8 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396121 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396121&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57521790 163345145 CHEMBL2171327 ZINC95557304 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965970 COc1cc(\C=C\C(=O)NCCCCCCCCNc2c3CCCCc3nc3ccccc23)ccc1OCCCO[N+]([O-])=O InChI=1S/C34H44N4O6/c1-42-32-25-26(17-19-31(32)43-23-12-24-44-38(40)41)18-20-33(39)35-21-10-4-2-3-5-11-22-36-34-27-13-6-8-15-29(27)37-30-16-9-7-14-28(30)34/h6,8,13,15,17-20,25H,2-5,7,9-12,14,16,21-24H2,1H3,(H,35,39)(H,36,37)/b20-18+ VJAKMKZFERBZGI-CZIZESTLSA-N 50396122 CHEMBL2171326 Cholinesterase 1 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396122 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396122&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57521789 163345146 CHEMBL2171326 ZINC95555523 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965971 COc1cc(\C=C\C(=O)NCCCCCCCCNc2c3CCCCc3nc3ccccc23)ccc1OCCO[N+]([O-])=O InChI=1S/C33H42N4O6/c1-41-31-24-25(16-18-30(31)42-22-23-43-37(39)40)17-19-32(38)34-20-10-4-2-3-5-11-21-35-33-26-12-6-8-14-28(26)36-29-15-9-7-13-27(29)33/h6,8,12,14,16-19,24H,2-5,7,9-11,13,15,20-23H2,1H3,(H,34,38)(H,35,36)/b19-17+ PTUILSVHZQBPQW-HTXNQAPBSA-N 50396123 CHEMBL2171325 Cholinesterase 1.6 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396123 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396123&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57521788 163345147 CHEMBL2171325 ZINC95554558 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965972 COc1cc(\C=C\C(=O)NCCCCCCNc2c3CCCCc3nc3ccccc23)ccc1OCCCCCCO[N+]([O-])=O InChI=1S/C35H46N4O6/c1-43-33-26-27(18-20-32(33)44-24-12-4-5-13-25-45-39(41)42)19-21-34(40)36-22-10-2-3-11-23-37-35-28-14-6-8-16-30(28)38-31-17-9-7-15-29(31)35/h6,8,14,16,18-21,26H,2-5,7,9-13,15,17,22-25H2,1H3,(H,36,40)(H,37,38)/b21-19+ ARORREBHGWSMBK-XUTLUUPISA-N 50396124 CHEMBL2171324 Cholinesterase 2 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396124 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396124&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57521787 163345148 CHEMBL2171324 ZINC95553346 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965973 COc1cc(\C=C\C(=O)NCCCCCCNc2c3CCCCc3nc3ccccc23)ccc1OCCCCO[N+]([O-])=O InChI=1S/C33H42N4O6/c1-41-31-24-25(16-18-30(31)42-22-10-11-23-43-37(39)40)17-19-32(38)34-20-8-2-3-9-21-35-33-26-12-4-6-14-28(26)36-29-15-7-5-13-27(29)33/h4,6,12,14,16-19,24H,2-3,5,7-11,13,15,20-23H2,1H3,(H,34,38)(H,35,36)/b19-17+ KSXDOJVIZJSREQ-HTXNQAPBSA-N 50396125 CHEMBL2171323 Cholinesterase 1.4 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396125 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396125&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57521677 163345149 CHEMBL2171323 ZINC95557595 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965974 COc1cc(\C=C\C(=O)NCCCCCCNc2c3CCCCc3nc3ccccc23)ccc1OCCCO[N+]([O-])=O InChI=1S/C32H40N4O6/c1-40-30-23-24(15-17-29(30)41-21-10-22-42-36(38)39)16-18-31(37)33-19-8-2-3-9-20-34-32-25-11-4-6-13-27(25)35-28-14-7-5-12-26(28)32/h4,6,11,13,15-18,23H,2-3,5,7-10,12,14,19-22H2,1H3,(H,33,37)(H,34,35)/b18-16+ UHAQXHVUNBQUOS-FBMGVBCBSA-N 50396126 CHEMBL2171322 Cholinesterase 5.6 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396126 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396126&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57521676 163345150 CHEMBL2171322 ZINC95552647 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965975 COc1cc(\C=C\C(=O)NCCCCCCNc2c3CCCCc3nc3ccccc23)ccc1OCCO[N+]([O-])=O InChI=1S/C31H38N4O6/c1-39-29-22-23(14-16-28(29)40-20-21-41-35(37)38)15-17-30(36)32-18-8-2-3-9-19-33-31-24-10-4-6-12-26(24)34-27-13-7-5-11-25(27)31/h4,6,10,12,14-17,22H,2-3,5,7-9,11,13,18-21H2,1H3,(H,32,36)(H,33,34)/b17-15+ HNDBWRWMAUROSM-BMRADRMJSA-N 50396127 CHEMBL2171321 Cholinesterase 5.2 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396127 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396127&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57521675 163345151 CHEMBL2171321 ZINC95555204 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965976 COc1cc(\C=C\C(=O)NCCCCNc2c3CCCCc3nc3ccccc23)ccc1OCCCCCCO[N+]([O-])=O InChI=1S/C33H42N4O6/c1-41-31-24-25(16-18-30(31)42-22-10-2-3-11-23-43-37(39)40)17-19-32(38)34-20-8-9-21-35-33-26-12-4-6-14-28(26)36-29-15-7-5-13-27(29)33/h4,6,12,14,16-19,24H,2-3,5,7-11,13,15,20-23H2,1H3,(H,34,38)(H,35,36)/b19-17+ UDOAAZCRVRXHQR-HTXNQAPBSA-N 50396128 CHEMBL2171320 Cholinesterase 11.7 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396128 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396128&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57521674 163345152 CHEMBL2171320 ZINC95556515 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965977 COc1cc(\C=C\C(=O)NCCCCNc2c3CCCCc3nc3ccccc23)ccc1OCCCCO[N+]([O-])=O InChI=1S/C31H38N4O6/c1-39-29-22-23(14-16-28(29)40-20-8-9-21-41-35(37)38)15-17-30(36)32-18-6-7-19-33-31-24-10-2-4-12-26(24)34-27-13-5-3-11-25(27)31/h2,4,10,12,14-17,22H,3,5-9,11,13,18-21H2,1H3,(H,32,36)(H,33,34)/b17-15+ BKGOZCMFKBHNDN-BMRADRMJSA-N 50396129 CHEMBL2171319 Cholinesterase 4.7 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396129 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396129&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57521574 163345153 CHEMBL2171319 ZINC95552655 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965978 COc1cc(\C=C\C(=O)NCCCCNc2c3CCCCc3nc3ccccc23)ccc1OCCCO[N+]([O-])=O InChI=1S/C30H36N4O6/c1-38-28-21-22(13-15-27(28)39-19-8-20-40-34(36)37)14-16-29(35)31-17-6-7-18-32-30-23-9-2-4-11-25(23)33-26-12-5-3-10-24(26)30/h2,4,9,11,13-16,21H,3,5-8,10,12,17-20H2,1H3,(H,31,35)(H,32,33)/b16-14+ OACQCWYXXSUPFA-JQIJEIRASA-N 50396130 CHEMBL2171318 Cholinesterase 23.6 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396130 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396130&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57521573 163345154 CHEMBL2171318 ZINC95556530 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965979 COc1cc(\C=C\C(=O)NCCCCNc2c3CCCCc3nc3ccccc23)ccc1OCCO[N+]([O-])=O InChI=1S/C29H34N4O6/c1-37-27-20-21(12-14-26(27)38-18-19-39-33(35)36)13-15-28(34)30-16-6-7-17-31-29-22-8-2-4-10-24(22)32-25-11-5-3-9-23(25)29/h2,4,8,10,12-15,20H,3,5-7,9,11,16-19H2,1H3,(H,30,34)(H,31,32)/b15-13+ FQMCKDBNTRRIDI-FYWRMAATSA-N 50396131 CHEMBL2171317 Cholinesterase 20.2 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396131 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396131&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57521572 163345155 CHEMBL2171317 ZINC95556906 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965980 COc1cc(\C=C\C(=O)NCCCNc2c3CCCCc3nc3ccccc23)ccc1OCCCCCCO[N+]([O-])=O InChI=1S/C32H40N4O6/c1-40-30-23-24(15-17-29(30)41-21-8-2-3-9-22-42-36(38)39)16-18-31(37)33-19-10-20-34-32-25-11-4-6-13-27(25)35-28-14-7-5-12-26(28)32/h4,6,11,13,15-18,23H,2-3,5,7-10,12,14,19-22H2,1H3,(H,33,37)(H,34,35)/b18-16+ WZZQWJMOQVNXLK-FBMGVBCBSA-N 50396132 CHEMBL2171316 Cholinesterase 19.3 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396132 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396132&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57521571 163345156 CHEMBL2171316 ZINC95557315 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965981 COc1cc(\C=C\C(=O)NCCCNc2c3CCCCc3nc3ccccc23)ccc1OCCCCO[N+]([O-])=O InChI=1S/C30H36N4O6/c1-38-28-21-22(13-15-27(28)39-19-6-7-20-40-34(36)37)14-16-29(35)31-17-8-18-32-30-23-9-2-4-11-25(23)33-26-12-5-3-10-24(26)30/h2,4,9,11,13-16,21H,3,5-8,10,12,17-20H2,1H3,(H,31,35)(H,32,33)/b16-14+ YDLBPXOVGJPXQK-JQIJEIRASA-N 50396133 CHEMBL2171315 Cholinesterase 6.2 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396133 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396133&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57521570 163345157 CHEMBL2171315 ZINC95555839 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965982 COc1cc(\C=C\C(=O)NCCCNc2c3CCCCc3nc3ccccc23)ccc1OCCCO[N+]([O-])=O InChI=1S/C29H34N4O6/c1-37-27-20-21(12-14-26(27)38-18-7-19-39-33(35)36)13-15-28(34)30-16-6-17-31-29-22-8-2-4-10-24(22)32-25-11-5-3-9-23(25)29/h2,4,8,10,12-15,20H,3,5-7,9,11,16-19H2,1H3,(H,30,34)(H,31,32)/b15-13+ DDOBXWSLLJYUGD-FYWRMAATSA-N 50396134 CHEMBL2171314 Cholinesterase 17.7 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396134 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396134&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57521474 163345158 CHEMBL2171314 ZINC95556565 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965983 NCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C21H31N3/c22-15-9-3-1-2-4-10-16-23-21-17-11-5-7-13-19(17)24-20-14-8-6-12-18(20)21/h5,7,11,13H,1-4,6,8-10,12,14-16,22H2,(H,23,24) LFBAUYQQFKFFCF-UHFFFAOYSA-N 9426 CHEMBL258928::Heterodimeric Tacrine-Based Inhibitor 5g::N-(8-aminooctyl)-1,2,3,4-tetrahydroacridin-9-amine dihydrochloride::N-9-(1,2,3,4-Tetrahydroacridinyl)-1,8-diamino-octane Bis-hydrochloride Cholinesterase 2.8 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=9426 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=9426&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1UT6 657093 46510143 CHEMBL258928 ZINC12504440 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965984 NCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C19H27N3/c20-13-7-1-2-8-14-21-19-15-9-3-5-11-17(15)22-18-12-6-4-10-16(18)19/h3,5,9,11H,1-2,4,6-8,10,12-14,20H2,(H,21,22) VDSDQAGBQNPBFH-UHFFFAOYSA-N 50396135 CHEMBL2171328 Cholinesterase 6.6 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396135 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396135&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11645075 163345159 CHEMBL2171328 ZINC35994946 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965985 NCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C17H23N3/c18-11-5-6-12-19-17-13-7-1-3-9-15(13)20-16-10-4-2-8-14(16)17/h1,3,7,9H,2,4-6,8,10-12,18H2,(H,19,20) IRDRWZMLBBBOJK-UHFFFAOYSA-N 50377433 CHEMBL258926 Cholinesterase 22.9 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50377433 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50377433&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 24800470 160856516 CHEMBL258926 ZINC29047173 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965986 NCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C16H21N3/c17-10-5-11-18-16-12-6-1-3-8-14(12)19-15-9-4-2-7-13(15)16/h1,3,6,8H,2,4-5,7,9-11,17H2,(H,18,19) LUDRRADCGGTCHH-UHFFFAOYSA-N 50377431 CHEMBL258744 Cholinesterase 19.7 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50377431 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50377431&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11651775 160856514 CHEMBL258744 ZINC29047185 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965987 NCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C15H19N3/c16-9-10-17-15-11-5-1-3-7-13(11)18-14-8-4-2-6-12(14)15/h1,3,5,7H,2,4,6,8-10,16H2,(H,17,18) MTPGMAOIWNBPSP-UHFFFAOYSA-N 50377434 CHEMBL407765 Cholinesterase 30.9 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50377434 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50377434&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11658774 160856517 CHEMBL407765 ZINC29047182 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965988 COc1cc(\C=C\C(=O)NCCCCCCCCNc2c3CCCCc3nc3ccccc23)ccc1O InChI=1S/C31H39N3O3/c1-37-29-22-23(16-18-28(29)35)17-19-30(36)32-20-10-4-2-3-5-11-21-33-31-24-12-6-8-14-26(24)34-27-15-9-7-13-25(27)31/h6,8,12,14,16-19,22,35H,2-5,7,9-11,13,15,20-21H2,1H3,(H,32,36)(H,33,34)/b19-17+ WCWRTGJHBXDPMB-HTXNQAPBSA-N 50377435 CHEMBL256919 Cholinesterase 27.4 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50377435 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50377435&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44449390 160856518 CHEMBL256919 ZINC29046863 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965989 COc1cc(\C=C\C(=O)NCCCCNc2c3CCCCc3nc3ccccc23)ccc1O InChI=1S/C27H31N3O3/c1-33-25-18-19(12-14-24(25)31)13-15-26(32)28-16-6-7-17-29-27-20-8-2-4-10-22(20)30-23-11-5-3-9-21(23)27/h2,4,8,10,12-15,18,31H,3,5-7,9,11,16-17H2,1H3,(H,28,32)(H,29,30)/b15-13+ MBOPPOJUEPKDPT-FYWRMAATSA-N 50377436 CHEMBL255304 Cholinesterase 9.8 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50377436 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50377436&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44449420 160856519 CHEMBL255304 ZINC29047020 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965990 COc1cc(\C=C\C(=O)NCCCNc2c3CCCCc3nc3ccccc23)ccc1O InChI=1S/C26H29N3O3/c1-32-24-17-18(11-13-23(24)30)12-14-25(31)27-15-6-16-28-26-19-7-2-4-9-21(19)29-22-10-5-3-8-20(22)26/h2,4,7,9,11-14,17,30H,3,5-6,8,10,15-16H2,1H3,(H,27,31)(H,28,29)/b14-12+ WCIMPGNOMNOHJN-WYMLVPIESA-N 50377437 CHEMBL255502 Cholinesterase 31.1 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50377437 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50377437&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44449423 160856520 CHEMBL255502 ZINC29047029 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965991 COc1cc(\C=C\C(=O)NCCNc2c3CCCCc3nc3ccccc23)ccc1O InChI=1S/C25H27N3O3/c1-31-23-16-17(10-12-22(23)29)11-13-24(30)26-14-15-27-25-18-6-2-4-8-20(18)28-21-9-5-3-7-19(21)25/h2,4,6,8,10-13,16,29H,3,5,7,9,14-15H2,1H3,(H,26,30)(H,27,28)/b13-11+ BPEMBGATMVJEHW-ACCUITESSA-N 50377438 CHEMBL403083 Cholinesterase 37.5 ChEMBL 10.1021/jm300106z 10.7270/Q21837N7 22512543 Chen, Y; Sun, J; Fang, L; Liu, M; Peng, S; Liao, H; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50377438 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50377438&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44449422 160856521 CHEMBL403083 ZINC29047026 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957446 CCN(C)C(=O)Oc1ccc2N(C)C3N(CCc4ccccc34)Cc2c1 InChI=1S/C21H25N3O2/c1-4-22(2)21(25)26-17-9-10-19-16(13-17)14-24-12-11-15-7-5-6-8-18(15)20(24)23(19)3/h5-10,13,20H,4,11-12,14H2,1-3H3 CUSAPAFCNUXGJO-UHFFFAOYSA-N 50392998 CHEMBL2152544 Cholinesterase 274.6 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50392998 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50392998&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71453073 163342022 CHEMBL2152544 ZINC95573677 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957447 CCCCCCCNC(=O)Oc1ccc2N(C)C3N(CCc4ccccc34)Cc2c1 InChI=1S/C25H33N3O2/c1-3-4-5-6-9-15-26-25(29)30-21-12-13-23-20(17-21)18-28-16-14-19-10-7-8-11-22(19)24(28)27(23)2/h7-8,10-13,17,24H,3-6,9,14-16,18H2,1-2H3,(H,26,29) NRSCUZWEMZYPRV-UHFFFAOYSA-N 50392999 CHEMBL2152545 Cholinesterase 12.7 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50392999 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50392999&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 60165327 163342023 CHEMBL2152545 ZINC95574810 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957448 CNC(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1 InChI=1S/C15H21N3O2/c1-15-7-8-17(3)13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2/h5-6,9,13H,7-8H2,1-4H3,(H,16,19)/t13-,15+/m1/s1 PIJVFDBKTWXHHD-HIFRSBDPSA-N 50004000 (3aS,8aR)-1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol-5-yl methylcarbamate::Antilirium::CHEMBL94::Eserine::Physostol::physostigmine Cholinesterase 41 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50004000 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50004000&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5983 103917788 27953 CHEMBL94 DB00981 6598 C06535 ZINC33971762 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957459 CN1C2N(CCc3ccccc23)Cc2ccccc12 InChI=1S/C17H18N2/c1-18-16-9-5-3-7-14(16)12-19-11-10-13-6-2-4-8-15(13)17(18)19/h2-9,17H,10-12H2,1H3 LHJBHLMRUQBOHU-UHFFFAOYSA-N 50393000 CHEMBL2152537 Cholinesterase 43651.58 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393000 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393000&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71454814 163342024 CHEMBL2152537 ZINC95572482 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957460 CN1C2N(CCc3ccccc23)Cc2cc(O)ccc12 InChI=1S/C17H18N2O/c1-18-16-7-6-14(20)10-13(16)11-19-9-8-12-4-2-3-5-15(12)17(18)19/h2-7,10,17,20H,8-9,11H2,1H3 YMWULAJABIPEAC-UHFFFAOYSA-N 50393001 CHEMBL2152538 Cholinesterase 44668.36 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393001 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393001&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71456586 163342025 CHEMBL2152538 ZINC95574808 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957461 COc1ccc2N(C)C3N(CCc4ccccc34)Cc2c1 InChI=1S/C18H20N2O/c1-19-17-8-7-15(21-2)11-14(17)12-20-10-9-13-5-3-4-6-16(13)18(19)20/h3-8,11,18H,9-10,12H2,1-2H3 DLDBQZCDZBCPML-UHFFFAOYSA-N 50393002 CHEMBL2152539 Cholinesterase 54954.09 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393002 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393002&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71453072 163342026 CHEMBL2152539 ZINC95576642 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957462 CN1C2N(Cc3ccccc13)CCCc1ccccc21 InChI=1S/C18H20N2/c1-19-17-11-5-3-8-15(17)13-20-12-6-9-14-7-2-4-10-16(14)18(19)20/h2-5,7-8,10-11,18H,6,9,12-13H2,1H3 IQOLLSSUUDHAOT-UHFFFAOYSA-N 50393009 CHEMBL2152540 Cholinesterase 23442.29 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393009 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393009&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71460293 163342033 CHEMBL2152540 ZINC95575984 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957463 CN1C2N(Cc3cc(O)ccc13)CCCc1ccccc21 InChI=1S/C18H20N2O/c1-19-17-9-8-15(21)11-14(17)12-20-10-4-6-13-5-2-3-7-16(13)18(19)20/h2-3,5,7-9,11,18,21H,4,6,10,12H2,1H3 YVJVJQLKKKWOCZ-UHFFFAOYSA-N 50393003 CHEMBL2152541 Cholinesterase 7244.36 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393003 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393003&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71454815 163342027 CHEMBL2152541 ZINC95573081 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957464 COc1ccc2N(C)C3N(Cc2c1)CCCc1ccccc31 InChI=1S/C19H22N2O/c1-20-18-10-9-16(22-2)12-15(18)13-21-11-5-7-14-6-3-4-8-17(14)19(20)21/h3-4,6,8-10,12,19H,5,7,11,13H2,1-2H3 YXJMJZAPADMXJF-UHFFFAOYSA-N 50393010 CHEMBL2152542 Cholinesterase 29512.09 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393010 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393010&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71458446 163342034 CHEMBL2152542 ZINC95573596 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957465 CCCCCCCNC(=O)Oc1ccc2N(C)C3N(Cc2c1)CCCc1ccccc31 InChI=1S/C26H35N3O2/c1-3-4-5-6-9-16-27-26(30)31-22-14-15-24-21(18-22)19-29-17-10-12-20-11-7-8-13-23(20)25(29)28(24)2/h7-8,11,13-15,18,25H,3-6,9-10,12,16-17,19H2,1-2H3,(H,27,30) ANGFZTLLFSDRHV-UHFFFAOYSA-N 50393011 CHEMBL2152543 Cholinesterase 46.77 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393011 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393011&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71458447 163342035 CHEMBL2152543 ZINC95577760 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957466 CCN(C)C(=O)Oc1ccc2N(C)C3N(CCc4ccccc34)Cc2c1 InChI=1S/C21H25N3O2/c1-4-22(2)21(25)26-17-9-10-19-16(13-17)14-24-12-11-15-7-5-6-8-18(15)20(24)23(19)3/h5-10,13,20H,4,11-12,14H2,1-3H3 CUSAPAFCNUXGJO-UHFFFAOYSA-N 50392998 CHEMBL2152544 Cholinesterase 450 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50392998 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50392998&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71453073 163342022 CHEMBL2152544 ZINC95573677 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957467 CCCCCCCNC(=O)Oc1ccc2N(C)C3N(CCc4ccccc34)Cc2c1 InChI=1S/C25H33N3O2/c1-3-4-5-6-9-15-26-25(29)30-21-12-13-23-20(17-21)18-28-16-14-19-10-7-8-11-22(19)24(28)27(23)2/h7-8,10-13,17,24H,3-6,9,14-16,18H2,1-2H3,(H,26,29) NRSCUZWEMZYPRV-UHFFFAOYSA-N 50392999 CHEMBL2152545 Cholinesterase 58.88 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50392999 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50392999&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 60165327 163342023 CHEMBL2152545 ZINC95574810 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957468 COc1cccc(NC(=O)Oc2ccc3N(C)C4N(CCc5ccccc45)Cc3c2)c1 InChI=1S/C25H25N3O3/c1-27-23-11-10-21(31-25(29)26-19-7-5-8-20(15-19)30-2)14-18(23)16-28-13-12-17-6-3-4-9-22(17)24(27)28/h3-11,14-15,24H,12-13,16H2,1-2H3,(H,26,29) AOOZEYBUUVKXRR-UHFFFAOYSA-N 50393012 CHEMBL2152546 Cholinesterase 218.78 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393012 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393012&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71461989 163342036 CHEMBL2152546 ZINC95573061 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957469 CN1C2N(CCc3ccccc23)Cc2cc(OC(=O)Nc3ccccc3C)ccc12 InChI=1S/C25H25N3O2/c1-17-7-3-6-10-22(17)26-25(29)30-20-11-12-23-19(15-20)16-28-14-13-18-8-4-5-9-21(18)24(28)27(23)2/h3-12,15,24H,13-14,16H2,1-2H3,(H,26,29) ONMNBWIZOMLRQB-UHFFFAOYSA-N 50393013 CHEMBL2152547 Cholinesterase 144.54 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393013 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393013&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71449453 163342037 CHEMBL2152547 ZINC95572926 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957470 CC(C)c1ccc(NC(=O)Oc2ccc3N(C)C4N(CCc5ccccc45)Cc3c2)cc1 InChI=1S/C27H29N3O2/c1-18(2)19-8-10-22(11-9-19)28-27(31)32-23-12-13-25-21(16-23)17-30-15-14-20-6-4-5-7-24(20)26(30)29(25)3/h4-13,16,18,26H,14-15,17H2,1-3H3,(H,28,31) UACCYHYWHFDBIH-UHFFFAOYSA-N 50393014 CHEMBL2152548 Cholinesterase 131.83 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393014 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393014&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71458448 163342038 CHEMBL2152548 ZINC95577699 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957471 CN1C2CCCN2Cc2ccccc12 InChI=1S/C12H16N2/c1-13-11-6-3-2-5-10(11)9-14-8-4-7-12(13)14/h2-3,5-6,12H,4,7-9H2,1H3 DWBAFMVPHMOVBS-UHFFFAOYSA-N 50393004 CHEMBL2152549 Cholinesterase 38904.51 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393004 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393004&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12201724 163342028 CHEMBL2152549 ZINC95574221 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957472 CN1C2CCCN2Cc2cc(O)ccc12 InChI=1S/C12H16N2O/c1-13-11-5-4-10(15)7-9(11)8-14-6-2-3-12(13)14/h4-5,7,12,15H,2-3,6,8H2,1H3 KOQOKGCIWMIQTJ-UHFFFAOYSA-N 50393005 CHEMBL2152550 Cholinesterase 40738.03 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393005 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393005&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71458449 163342029 CHEMBL2152550 ZINC95575997 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957473 CCCCCCCNC(=O)Oc1ccc2N(C)C3CCCN3Cc2c1 InChI=1S/C20H31N3O2/c1-3-4-5-6-7-12-21-20(24)25-17-10-11-18-16(14-17)15-23-13-8-9-19(23)22(18)2/h10-11,14,19H,3-9,12-13,15H2,1-2H3,(H,21,24) CMQGYBSTIHAZAK-UHFFFAOYSA-N 50393006 CHEMBL2152551 Cholinesterase 1949.84 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393006 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393006&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71453074 163342030 CHEMBL2152551 ZINC95576016 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957474 COc1cccc(NC(=O)Oc2ccc3N(C)C4CCCN4Cc3c2)c1 InChI=1S/C20H23N3O3/c1-22-18-9-8-17(11-14(18)13-23-10-4-7-19(22)23)26-20(24)21-15-5-3-6-16(12-15)25-2/h3,5-6,8-9,11-12,19H,4,7,10,13H2,1-2H3,(H,21,24) NVDKATMGTBTTNE-UHFFFAOYSA-N 50393007 CHEMBL2152552 Cholinesterase 7585.78 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393007 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393007&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71460294 163342031 CHEMBL2152552 ZINC95571955 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957475 CN1C2CCCN2Cc2cc(OC(=O)Nc3ccccc3C)ccc12 InChI=1S/C20H23N3O2/c1-14-6-3-4-7-17(14)21-20(24)25-16-9-10-18-15(12-16)13-23-11-5-8-19(23)22(18)2/h3-4,6-7,9-10,12,19H,5,8,11,13H2,1-2H3,(H,21,24) IZGIQIYGKIYHFH-UHFFFAOYSA-N 50393008 CHEMBL2152553 Cholinesterase 4073.8 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393008 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393008&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71461990 163342032 CHEMBL2152553 ZINC95571907 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957476 CC(C)c1ccc(NC(=O)Oc2ccc3N(C)C4CCCN4Cc3c2)cc1 InChI=1S/C22H27N3O2/c1-15(2)16-6-8-18(9-7-16)23-22(26)27-19-10-11-20-17(13-19)14-25-12-4-5-21(25)24(20)3/h6-11,13,15,21H,4-5,12,14H2,1-3H3,(H,23,26) YRJYPCULCAKMAT-UHFFFAOYSA-N 50393015 CHEMBL2152554 Cholinesterase 2951.21 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393015 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393015&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71460295 163342039 CHEMBL2152554 ZINC95577278 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957488 CN1C2N(CCc3ccccc23)Cc2ccccc12 InChI=1S/C17H18N2/c1-18-16-9-5-3-7-14(16)12-19-11-10-13-6-2-4-8-15(13)17(18)19/h2-9,17H,10-12H2,1H3 LHJBHLMRUQBOHU-UHFFFAOYSA-N 50393000 CHEMBL2152537 Cholinesterase 44000 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393000 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393000&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71454814 163342024 CHEMBL2152537 ZINC95572482 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957489 CN1C2N(CCc3ccccc23)Cc2cc(O)ccc12 InChI=1S/C17H18N2O/c1-18-16-7-6-14(20)10-13(16)11-19-9-8-12-4-2-3-5-15(12)17(18)19/h2-7,10,17,20H,8-9,11H2,1H3 YMWULAJABIPEAC-UHFFFAOYSA-N 50393001 CHEMBL2152538 Cholinesterase 44300 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393001 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393001&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71456586 163342025 CHEMBL2152538 ZINC95574808 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957490 COc1ccc2N(C)C3N(CCc4ccccc34)Cc2c1 InChI=1S/C18H20N2O/c1-19-17-8-7-15(21-2)11-14(17)12-20-10-9-13-5-3-4-6-16(13)18(19)20/h3-8,11,18H,9-10,12H2,1-2H3 DLDBQZCDZBCPML-UHFFFAOYSA-N 50393002 CHEMBL2152539 Cholinesterase 55600 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393002 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393002&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71453072 163342026 CHEMBL2152539 ZINC95576642 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957491 CN1C2N(Cc3ccccc13)CCCc1ccccc21 InChI=1S/C18H20N2/c1-19-17-11-5-3-8-15(17)13-20-12-6-9-14-7-2-4-10-16(14)18(19)20/h2-5,7-8,10-11,18H,6,9,12-13H2,1H3 IQOLLSSUUDHAOT-UHFFFAOYSA-N 50393009 CHEMBL2152540 Cholinesterase 23700 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393009 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393009&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71460293 163342033 CHEMBL2152540 ZINC95575984 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957492 CN1C2N(Cc3cc(O)ccc13)CCCc1ccccc21 InChI=1S/C18H20N2O/c1-19-17-9-8-15(21)11-14(17)12-20-10-4-6-13-5-2-3-7-16(13)18(19)20/h2-3,5,7-9,11,18,21H,4,6,10,12H2,1H3 YVJVJQLKKKWOCZ-UHFFFAOYSA-N 50393003 CHEMBL2152541 Cholinesterase 7300 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393003 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393003&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71454815 163342027 CHEMBL2152541 ZINC95573081 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957493 COc1ccc2N(C)C3N(Cc2c1)CCCc1ccccc31 InChI=1S/C19H22N2O/c1-20-18-10-9-16(22-2)12-15(18)13-21-11-5-7-14-6-3-4-8-17(14)19(20)21/h3-4,6,8-10,12,19H,5,7,11,13H2,1-2H3 YXJMJZAPADMXJF-UHFFFAOYSA-N 50393010 CHEMBL2152542 Cholinesterase 29700 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393010 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393010&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71458446 163342034 CHEMBL2152542 ZINC95573596 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957494 CCCCCCCNC(=O)Oc1ccc2N(C)C3N(Cc2c1)CCCc1ccccc31 InChI=1S/C26H35N3O2/c1-3-4-5-6-9-16-27-26(30)31-22-14-15-24-21(18-22)19-29-17-10-12-20-11-7-8-13-23(20)25(29)28(24)2/h7-8,11,13-15,18,25H,3-6,9-10,12,16-17,19H2,1-2H3,(H,27,30) ANGFZTLLFSDRHV-UHFFFAOYSA-N 50393011 CHEMBL2152543 Cholinesterase 46 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393011 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393011&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71458447 163342035 CHEMBL2152543 ZINC95577760 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957495 CCN(C)C(=O)Oc1ccc2N(C)C3N(CCc4ccccc34)Cc2c1 InChI=1S/C21H25N3O2/c1-4-22(2)21(25)26-17-9-10-19-16(13-17)14-24-12-11-15-7-5-6-8-18(15)20(24)23(19)3/h5-10,13,20H,4,11-12,14H2,1-3H3 CUSAPAFCNUXGJO-UHFFFAOYSA-N 50392998 CHEMBL2152544 Cholinesterase 450 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50392998 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50392998&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71453073 163342022 CHEMBL2152544 ZINC95573677 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957496 CCCCCCCNC(=O)Oc1ccc2N(C)C3N(CCc4ccccc34)Cc2c1 InChI=1S/C25H33N3O2/c1-3-4-5-6-9-15-26-25(29)30-21-12-13-23-20(17-21)18-28-16-14-19-10-7-8-11-22(19)24(28)27(23)2/h7-8,10-13,17,24H,3-6,9,14-16,18H2,1-2H3,(H,26,29) NRSCUZWEMZYPRV-UHFFFAOYSA-N 50392999 CHEMBL2152545 Cholinesterase 60 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50392999 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50392999&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 60165327 163342023 CHEMBL2152545 ZINC95574810 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957497 COc1cccc(NC(=O)Oc2ccc3N(C)C4N(CCc5ccccc45)Cc3c2)c1 InChI=1S/C25H25N3O3/c1-27-23-11-10-21(31-25(29)26-19-7-5-8-20(15-19)30-2)14-18(23)16-28-13-12-17-6-3-4-9-22(17)24(27)28/h3-11,14-15,24H,12-13,16H2,1-2H3,(H,26,29) AOOZEYBUUVKXRR-UHFFFAOYSA-N 50393012 CHEMBL2152546 Cholinesterase 218 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393012 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393012&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71461989 163342036 CHEMBL2152546 ZINC95573061 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957498 CN1C2N(CCc3ccccc23)Cc2cc(OC(=O)Nc3ccccc3C)ccc12 InChI=1S/C25H25N3O2/c1-17-7-3-6-10-22(17)26-25(29)30-20-11-12-23-19(15-20)16-28-14-13-18-8-4-5-9-21(18)24(28)27(23)2/h3-12,15,24H,13-14,16H2,1-2H3,(H,26,29) ONMNBWIZOMLRQB-UHFFFAOYSA-N 50393013 CHEMBL2152547 Cholinesterase 144 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393013 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393013&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71449453 163342037 CHEMBL2152547 ZINC95572926 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957499 CC(C)c1ccc(NC(=O)Oc2ccc3N(C)C4N(CCc5ccccc45)Cc3c2)cc1 InChI=1S/C27H29N3O2/c1-18(2)19-8-10-22(11-9-19)28-27(31)32-23-12-13-25-21(16-23)17-30-15-14-20-6-4-5-7-24(20)26(30)29(25)3/h4-13,16,18,26H,14-15,17H2,1-3H3,(H,28,31) UACCYHYWHFDBIH-UHFFFAOYSA-N 50393014 CHEMBL2152548 Cholinesterase 131 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393014 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393014&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71458448 163342038 CHEMBL2152548 ZINC95577699 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957500 CN1C2CCCN2Cc2ccccc12 InChI=1S/C12H16N2/c1-13-11-6-3-2-5-10(11)9-14-8-4-7-12(13)14/h2-3,5-6,12H,4,7-9H2,1H3 DWBAFMVPHMOVBS-UHFFFAOYSA-N 50393004 CHEMBL2152549 Cholinesterase 38900 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393004 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393004&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12201724 163342028 CHEMBL2152549 ZINC95574221 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957501 CN1C2CCCN2Cc2cc(O)ccc12 InChI=1S/C12H16N2O/c1-13-11-5-4-10(15)7-9(11)8-14-6-2-3-12(13)14/h4-5,7,12,15H,2-3,6,8H2,1H3 KOQOKGCIWMIQTJ-UHFFFAOYSA-N 50393005 CHEMBL2152550 Cholinesterase 41000 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393005 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393005&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71458449 163342029 CHEMBL2152550 ZINC95575997 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957502 CCCCCCCNC(=O)Oc1ccc2N(C)C3CCCN3Cc2c1 InChI=1S/C20H31N3O2/c1-3-4-5-6-7-12-21-20(24)25-17-10-11-18-16(14-17)15-23-13-8-9-19(23)22(18)2/h10-11,14,19H,3-9,12-13,15H2,1-2H3,(H,21,24) CMQGYBSTIHAZAK-UHFFFAOYSA-N 50393006 CHEMBL2152551 Cholinesterase 1950 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393006 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393006&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71453074 163342030 CHEMBL2152551 ZINC95576016 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957503 COc1cccc(NC(=O)Oc2ccc3N(C)C4CCCN4Cc3c2)c1 InChI=1S/C20H23N3O3/c1-22-18-9-8-17(11-14(18)13-23-10-4-7-19(22)23)26-20(24)21-15-5-3-6-16(12-15)25-2/h3,5-6,8-9,11-12,19H,4,7,10,13H2,1-2H3,(H,21,24) NVDKATMGTBTTNE-UHFFFAOYSA-N 50393007 CHEMBL2152552 Cholinesterase 7520 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393007 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393007&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71460294 163342031 CHEMBL2152552 ZINC95571955 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50960209 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 3.8 ChEMBL 10.1016/j.bmc.2012.08.040 10.7270/Q20Z74DZ 23000296 Wang, Y; Wang, F; Yu, JP; Jiang, FC; Guan, XL; Wang, CM; Li, L; Cao, H; Li, MX; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50960210 CCN(CCCCCCNc1c2CCCCc2nc2ccccc12)CC(=O)Nc1nc(cs1)-c1ccc(OC)cc1 InChI=1S/C33H41N5O2S/c1-3-38(22-31(39)37-33-36-30(23-41-33)24-16-18-25(40-2)19-17-24)21-11-5-4-10-20-34-32-26-12-6-8-14-28(26)35-29-15-9-7-13-27(29)32/h6,8,12,14,16-19,23H,3-5,7,9-11,13,15,20-22H2,1-2H3,(H,34,35)(H,36,37,39) RKXNOCVEXXJMLH-UHFFFAOYSA-N 50393852 CHEMBL2158128 Cholinesterase 588.84 ChEMBL 10.1016/j.bmc.2012.08.040 10.7270/Q20Z74DZ 23000296 Wang, Y; Wang, F; Yu, JP; Jiang, FC; Guan, XL; Wang, CM; Li, L; Cao, H; Li, MX; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393852 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393852&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71456683 163342876 CHEMBL2158128 ZINC95578444 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50960211 CCN(CCCCCCNc1c2CCCCc2nc2ccccc12)CC(=O)Nc1nc(cs1)-c1ccccc1 InChI=1S/C32H39N5OS/c1-2-37(22-30(38)36-32-35-29(23-39-32)24-14-6-5-7-15-24)21-13-4-3-12-20-33-31-25-16-8-10-18-27(25)34-28-19-11-9-17-26(28)31/h5-8,10,14-16,18,23H,2-4,9,11-13,17,19-22H2,1H3,(H,33,34)(H,35,36,38) JTEVTVVXIIHVBV-UHFFFAOYSA-N 50393853 CHEMBL2158127 Cholinesterase 467.74 ChEMBL 10.1016/j.bmc.2012.08.040 10.7270/Q20Z74DZ 23000296 Wang, Y; Wang, F; Yu, JP; Jiang, FC; Guan, XL; Wang, CM; Li, L; Cao, H; Li, MX; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393853 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393853&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71451352 163342877 CHEMBL2158127 ZINC95574980 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50960212 CCN(CCCCNc1c2CCCCc2nc2ccccc12)CCC(=O)Nc1nc(cs1)-c1ccc(Cl)cc1 InChI=1S/C31H36ClN5OS/c1-2-37(20-17-29(38)36-31-35-28(21-39-31)22-13-15-23(32)16-14-22)19-8-7-18-33-30-24-9-3-5-11-26(24)34-27-12-6-4-10-25(27)30/h3,5,9,11,13-16,21H,2,4,6-8,10,12,17-20H2,1H3,(H,33,34)(H,35,36,38) AUOUXNQPFCJKKJ-UHFFFAOYSA-N 50393854 CHEMBL2158126 Cholinesterase 45.71 ChEMBL 10.1016/j.bmc.2012.08.040 10.7270/Q20Z74DZ 23000296 Wang, Y; Wang, F; Yu, JP; Jiang, FC; Guan, XL; Wang, CM; Li, L; Cao, H; Li, MX; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393854 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393854&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71458524 163342878 CHEMBL2158126 ZINC95578418 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50960213 CCN(CCCCNc1c2CCCCc2nc2ccccc12)CCC(=O)Nc1nc(cs1)-c1ccc(OC)cc1 InChI=1S/C32H39N5O2S/c1-3-37(21-18-30(38)36-32-35-29(22-40-32)23-14-16-24(39-2)17-15-23)20-9-8-19-33-31-25-10-4-6-12-27(25)34-28-13-7-5-11-26(28)31/h4,6,10,12,14-17,22H,3,5,7-9,11,13,18-21H2,1-2H3,(H,33,34)(H,35,36,38) BQDAZAMCOASTTO-UHFFFAOYSA-N 50393855 CHEMBL2158125 Cholinesterase 6.61 ChEMBL 10.1016/j.bmc.2012.08.040 10.7270/Q20Z74DZ 23000296 Wang, Y; Wang, F; Yu, JP; Jiang, FC; Guan, XL; Wang, CM; Li, L; Cao, H; Li, MX; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393855 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393855&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71453160 163342879 CHEMBL2158125 ZINC95575633 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50960214 CCN(CCCCNc1c2CCCCc2nc2ccccc12)CCC(=O)Nc1nc(cs1)-c1ccccc1 InChI=1S/C31H37N5OS/c1-2-36(21-18-29(37)35-31-34-28(22-38-31)23-12-4-3-5-13-23)20-11-10-19-32-30-24-14-6-8-16-26(24)33-27-17-9-7-15-25(27)30/h3-6,8,12-14,16,22H,2,7,9-11,15,17-21H2,1H3,(H,32,33)(H,34,35,37) CKRFXXHUTPXEDZ-UHFFFAOYSA-N 50393856 CHEMBL2158124 Cholinesterase 18.2 ChEMBL 10.1016/j.bmc.2012.08.040 10.7270/Q20Z74DZ 23000296 Wang, Y; Wang, F; Yu, JP; Jiang, FC; Guan, XL; Wang, CM; Li, L; Cao, H; Li, MX; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393856 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393856&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71449555 163342880 CHEMBL2158124 ZINC95572073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50960215 CCN(CCCNc1c2CCCCc2nc2ccccc12)CCC(=O)Nc1nc(cs1)-c1ccc(Cl)cc1 InChI=1S/C30H34ClN5OS/c1-2-36(19-16-28(37)35-30-34-27(20-38-30)21-12-14-22(31)15-13-21)18-7-17-32-29-23-8-3-5-10-25(23)33-26-11-6-4-9-24(26)29/h3,5,8,10,12-15,20H,2,4,6-7,9,11,16-19H2,1H3,(H,32,33)(H,34,35,37) XFIYFWAYRZWUOS-UHFFFAOYSA-N 50393857 CHEMBL2158123 Cholinesterase 4.17 ChEMBL 10.1016/j.bmc.2012.08.040 10.7270/Q20Z74DZ 23000296 Wang, Y; Wang, F; Yu, JP; Jiang, FC; Guan, XL; Wang, CM; Li, L; Cao, H; Li, MX; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393857 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393857&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71458523 163342881 CHEMBL2158123 ZINC95579507 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50960216 CCN(CCCNc1c2CCCCc2nc2ccccc12)CCC(=O)Nc1nc(cs1)-c1ccc(OC)cc1 InChI=1S/C31H37N5O2S/c1-3-36(20-17-29(37)35-31-34-28(21-39-31)22-13-15-23(38-2)16-14-22)19-8-18-32-30-24-9-4-6-11-26(24)33-27-12-7-5-10-25(27)30/h4,6,9,11,13-16,21H,3,5,7-8,10,12,17-20H2,1-2H3,(H,32,33)(H,34,35,37) IUDDYFCOEGNNOK-UHFFFAOYSA-N 50393858 CHEMBL2158122 Cholinesterase 0.479 ChEMBL 10.1016/j.bmc.2012.08.040 10.7270/Q20Z74DZ 23000296 Wang, Y; Wang, F; Yu, JP; Jiang, FC; Guan, XL; Wang, CM; Li, L; Cao, H; Li, MX; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393858 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393858&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71458522 163342882 CHEMBL2158122 ZINC95580679 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50960217 CCN(CCCNc1c2CCCCc2nc2ccccc12)CCC(=O)Nc1nc(cs1)-c1ccccc1 InChI=1S/C30H35N5OS/c1-2-35(20-17-28(36)34-30-33-27(21-37-30)22-11-4-3-5-12-22)19-10-18-31-29-23-13-6-8-15-25(23)32-26-16-9-7-14-24(26)29/h3-6,8,11-13,15,21H,2,7,9-10,14,16-20H2,1H3,(H,31,32)(H,33,34,36) GEDCFQCGOZAXCA-UHFFFAOYSA-N 50393859 CHEMBL2158121 Cholinesterase 6.03 ChEMBL 10.1016/j.bmc.2012.08.040 10.7270/Q20Z74DZ 23000296 Wang, Y; Wang, F; Yu, JP; Jiang, FC; Guan, XL; Wang, CM; Li, L; Cao, H; Li, MX; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393859 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393859&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71451351 163342883 CHEMBL2158121 ZINC95576112 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50960218 CCN(CCCCNc1c2CCCCc2nc2ccccc12)CC(=O)Nc1nc(cs1)-c1ccc(Cl)cc1 InChI=1S/C30H34ClN5OS/c1-2-36(19-28(37)35-30-34-27(20-38-30)21-13-15-22(31)16-14-21)18-8-7-17-32-29-23-9-3-5-11-25(23)33-26-12-6-4-10-24(26)29/h3,5,9,11,13-16,20H,2,4,6-8,10,12,17-19H2,1H3,(H,32,33)(H,34,35,37) SWNXUFFUARZIDF-UHFFFAOYSA-N 50393860 CHEMBL2158120 Cholinesterase 77.62 ChEMBL 10.1016/j.bmc.2012.08.040 10.7270/Q20Z74DZ 23000296 Wang, Y; Wang, F; Yu, JP; Jiang, FC; Guan, XL; Wang, CM; Li, L; Cao, H; Li, MX; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393860 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393860&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71454902 163342884 CHEMBL2158120 ZINC95580080 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50960219 CCN(CCCCNc1c2CCCCc2nc2ccccc12)CC(=O)Nc1nc(cs1)-c1ccc(OC)cc1 InChI=1S/C31H37N5O2S/c1-3-36(20-29(37)35-31-34-28(21-39-31)22-14-16-23(38-2)17-15-22)19-9-8-18-32-30-24-10-4-6-12-26(24)33-27-13-7-5-11-25(27)30/h4,6,10,12,14-17,21H,3,5,7-9,11,13,18-20H2,1-2H3,(H,32,33)(H,34,35,37) SURKRFGZUPRRDN-UHFFFAOYSA-N 50393861 CHEMBL2158119 Cholinesterase 20.42 ChEMBL 10.1016/j.bmc.2012.08.040 10.7270/Q20Z74DZ 23000296 Wang, Y; Wang, F; Yu, JP; Jiang, FC; Guan, XL; Wang, CM; Li, L; Cao, H; Li, MX; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393861 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393861&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71458521 163342885 CHEMBL2158119 ZINC95577343 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50960220 CCN(CCCCNc1c2CCCCc2nc2ccccc12)CC(=O)Nc1nc(cs1)-c1ccccc1 InChI=1S/C30H35N5OS/c1-2-35(20-28(36)34-30-33-27(21-37-30)22-12-4-3-5-13-22)19-11-10-18-31-29-23-14-6-8-16-25(23)32-26-17-9-7-15-24(26)29/h3-6,8,12-14,16,21H,2,7,9-11,15,17-20H2,1H3,(H,31,32)(H,33,34,36) GULDRVQQCVWSCP-UHFFFAOYSA-N 50393862 CHEMBL2158118 Cholinesterase 14.79 ChEMBL 10.1016/j.bmc.2012.08.040 10.7270/Q20Z74DZ 23000296 Wang, Y; Wang, F; Yu, JP; Jiang, FC; Guan, XL; Wang, CM; Li, L; Cao, H; Li, MX; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393862 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393862&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71456682 163342886 CHEMBL2158118 ZINC95577386 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50960221 CCN(CCCNc1c2CCCCc2nc2ccccc12)CC(=O)Nc1nc(cs1)-c1ccc(OC)cc1 InChI=1S/C30H35N5O2S/c1-3-35(19-28(36)34-30-33-27(20-38-30)21-13-15-22(37-2)16-14-21)18-8-17-31-29-23-9-4-6-11-25(23)32-26-12-7-5-10-24(26)29/h4,6,9,11,13-16,20H,3,5,7-8,10,12,17-19H2,1-2H3,(H,31,32)(H,33,34,36) IBVHBAHGLWJACY-UHFFFAOYSA-N 50393863 CHEMBL2158117 Cholinesterase 275.42 ChEMBL 10.1016/j.bmc.2012.08.040 10.7270/Q20Z74DZ 23000296 Wang, Y; Wang, F; Yu, JP; Jiang, FC; Guan, XL; Wang, CM; Li, L; Cao, H; Li, MX; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393863 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393863&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71449554 163342887 CHEMBL2158117 ZINC95576230 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50960222 CCN(CCCNc1c2CCCCc2nc2ccccc12)CC(=O)Nc1nc(cs1)-c1ccccc1 InChI=1S/C29H33N5OS/c1-2-34(19-27(35)33-29-32-26(20-36-29)21-11-4-3-5-12-21)18-10-17-30-28-22-13-6-8-15-24(22)31-25-16-9-7-14-23(25)28/h3-6,8,11-13,15,20H,2,7,9-10,14,16-19H2,1H3,(H,30,31)(H,32,33,35) OZPIPOFIRSDONX-UHFFFAOYSA-N 50393864 CHEMBL2158116 Cholinesterase 0.0447 ChEMBL 10.1016/j.bmc.2012.08.040 10.7270/Q20Z74DZ 23000296 Wang, Y; Wang, F; Yu, JP; Jiang, FC; Guan, XL; Wang, CM; Li, L; Cao, H; Li, MX; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393864 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393864&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71456681 163342888 CHEMBL2158116 ZINC95577894 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50960223 O=C(CCC(=O)Nc1nc2CCCCc2s1)NCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C28H35N5O2S/c34-25(15-16-26(35)33-28-32-23-13-5-6-14-24(23)36-28)29-17-7-8-18-30-27-19-9-1-3-11-21(19)31-22-12-4-2-10-20(22)27/h1,3,9,11H,2,4-8,10,12-18H2,(H,29,34)(H,30,31)(H,32,33,35) XBCFUURWGDJWHZ-UHFFFAOYSA-N 50393865 CHEMBL2158115 Cholinesterase 363.08 ChEMBL 10.1016/j.bmc.2012.08.040 10.7270/Q20Z74DZ 23000296 Wang, Y; Wang, F; Yu, JP; Jiang, FC; Guan, XL; Wang, CM; Li, L; Cao, H; Li, MX; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393865 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393865&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71460364 163342889 CHEMBL2158115 ZINC95580110 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50960224 Clc1ccc(cc1)-c1csc(NC(=O)CCC(=O)NCCCCNc2c3CCCCc3nc3ccccc23)n1 InChI=1S/C30H32ClN5O2S/c31-21-13-11-20(12-14-21)26-19-39-30(35-26)36-28(38)16-15-27(37)32-17-5-6-18-33-29-22-7-1-3-9-24(22)34-25-10-4-2-8-23(25)29/h1,3,7,9,11-14,19H,2,4-6,8,10,15-18H2,(H,32,37)(H,33,34)(H,35,36,38) VGQNFBMJENACNX-UHFFFAOYSA-N 50393866 CHEMBL2158114 Cholinesterase 16.6 ChEMBL 10.1016/j.bmc.2012.08.040 10.7270/Q20Z74DZ 23000296 Wang, Y; Wang, F; Yu, JP; Jiang, FC; Guan, XL; Wang, CM; Li, L; Cao, H; Li, MX; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393866 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393866&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71460363 163342890 CHEMBL2158114 ZINC95575576 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50960225 O=C(CCCC(=O)Nc1nc(cs1)-c1ccccc1)NCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C31H35N5O2S/c37-28(17-10-18-29(38)36-31-35-27(21-39-31)22-11-2-1-3-12-22)32-19-8-9-20-33-30-23-13-4-6-15-25(23)34-26-16-7-5-14-24(26)30/h1-4,6,11-13,15,21H,5,7-10,14,16-20H2,(H,32,37)(H,33,34)(H,35,36,38) VOZCWPZLVZULPC-UHFFFAOYSA-N 50393867 CHEMBL2158113 Cholinesterase 0.55 ChEMBL 10.1016/j.bmc.2012.08.040 10.7270/Q20Z74DZ 23000296 Wang, Y; Wang, F; Yu, JP; Jiang, FC; Guan, XL; Wang, CM; Li, L; Cao, H; Li, MX; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393867 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393867&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71451350 163342891 CHEMBL2158113 ZINC95573705 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957504 CN1C2CCCN2Cc2cc(OC(=O)Nc3ccccc3C)ccc12 InChI=1S/C20H23N3O2/c1-14-6-3-4-7-17(14)21-20(24)25-16-9-10-18-15(12-16)13-23-11-5-8-19(23)22(18)2/h3-4,6-7,9-10,12,19H,5,8,11,13H2,1-2H3,(H,21,24) IZGIQIYGKIYHFH-UHFFFAOYSA-N 50393008 CHEMBL2152553 Cholinesterase 4110 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393008 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393008&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71461990 163342032 CHEMBL2152553 ZINC95571907 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957505 CC(C)c1ccc(NC(=O)Oc2ccc3N(C)C4CCCN4Cc3c2)cc1 InChI=1S/C22H27N3O2/c1-15(2)16-6-8-18(9-7-16)23-22(26)27-19-10-11-20-17(13-19)14-25-12-4-5-21(25)24(20)3/h6-11,13,15,21H,4-5,12,14H2,1-3H3,(H,23,26) YRJYPCULCAKMAT-UHFFFAOYSA-N 50393015 CHEMBL2152554 Cholinesterase 3000 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393015 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393015&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71460295 163342039 CHEMBL2152554 ZINC95577278 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957506 CNC(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1 InChI=1S/C15H21N3O2/c1-15-7-8-17(3)13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2/h5-6,9,13H,7-8H2,1-4H3,(H,16,19)/t13-,15+/m1/s1 PIJVFDBKTWXHHD-HIFRSBDPSA-N 50004000 (3aS,8aR)-1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol-5-yl methylcarbamate::Antilirium::CHEMBL94::Eserine::Physostol::physostigmine Cholinesterase 42 ChEMBL 10.1021/ml3001825 10.7270/Q2P27079 24900407 Darras, FH; Kling, B; Heilmann, J; Decker, M TBA http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50004000 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50004000&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5983 103917788 27953 CHEMBL94 DB00981 6598 C06535 ZINC33971762 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50960226 O=C(CCC(=O)Nc1nc(cs1)-c1ccccc1)NCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C32H37N5O2S/c38-29(18-19-30(39)37-32-36-28(22-40-32)23-12-4-3-5-13-23)33-20-10-1-2-11-21-34-31-24-14-6-8-16-26(24)35-27-17-9-7-15-25(27)31/h3-6,8,12-14,16,22H,1-2,7,9-11,15,17-21H2,(H,33,38)(H,34,35)(H,36,37,39) YCAJMVTWURPZQW-UHFFFAOYSA-N 50393868 CHEMBL2158112 Cholinesterase 0.355 ChEMBL 10.1016/j.bmc.2012.08.040 10.7270/Q20Z74DZ 23000296 Wang, Y; Wang, F; Yu, JP; Jiang, FC; Guan, XL; Wang, CM; Li, L; Cao, H; Li, MX; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393868 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393868&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71456680 163342892 CHEMBL2158112 ZINC95579529 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50960227 O=C(CCCC(=O)Nc1nc(cs1)-c1ccccc1)NCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C30H33N5O2S/c36-27(16-8-17-28(37)35-30-34-26(20-38-30)21-10-2-1-3-11-21)31-18-9-19-32-29-22-12-4-6-14-24(22)33-25-15-7-5-13-23(25)29/h1-4,6,10-12,14,20H,5,7-9,13,15-19H2,(H,31,36)(H,32,33)(H,34,35,37) OKSRYUGDYGQOSF-UHFFFAOYSA-N 50393869 CHEMBL2158111 Cholinesterase 1778.28 ChEMBL 10.1016/j.bmc.2012.08.040 10.7270/Q20Z74DZ 23000296 Wang, Y; Wang, F; Yu, JP; Jiang, FC; Guan, XL; Wang, CM; Li, L; Cao, H; Li, MX; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393869 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393869&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71451349 163342893 CHEMBL2158111 ZINC95576819 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50960228 O=C(CCC(=O)Nc1nc(cs1)-c1ccccc1)NCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C30H33N5O2S/c36-27(16-17-28(37)35-30-34-26(20-38-30)21-10-2-1-3-11-21)31-18-8-9-19-32-29-22-12-4-6-14-24(22)33-25-15-7-5-13-23(25)29/h1-4,6,10-12,14,20H,5,7-9,13,15-19H2,(H,31,36)(H,32,33)(H,34,35,37) HBKRQZPHQINADC-UHFFFAOYSA-N 50393870 CHEMBL2158110 Cholinesterase 0.603 ChEMBL 10.1016/j.bmc.2012.08.040 10.7270/Q20Z74DZ 23000296 Wang, Y; Wang, F; Yu, JP; Jiang, FC; Guan, XL; Wang, CM; Li, L; Cao, H; Li, MX; Chen, JG Huazhong University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50393870 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50393870&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71451348 163342894 CHEMBL2158110 ZINC95577316 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965465 C1CN[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2[C@H]2N1CCc1c2[nH]c2ccccc12 InChI=1S/C20H25N3/c1-2-6-16-12(4-1)13-9-11-23-17-8-7-15(20(23)19(13)22-16)18-14(17)5-3-10-21-18/h1-2,4,6,14-15,17-18,20-22H,3,5,7-11H2/t14-,15-,17+,18-,20+/m0/s1 SBGPASZOVGSOFJ-CHBAHTGHSA-N 50396002 CHEMBL2165597 Cholinesterase 10630 ChEMBL 10.1016/j.bmc.2012.09.040 10.7270/Q2ZG6TBT 23062825 Brunhofer, G; Fallarero, A; Karlsson, D; Batista-Gonzalez, A; Shinde, P; Gopi Mohan, C; Vuorela, P Abo Akademi University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396002 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396002&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 398797 163345026 CHEMBL2165597 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965467 OC1N2CCCC2=Nc2ccccc12 InChI=1S/C11H12N2O/c14-11-8-4-1-2-5-9(8)12-10-6-3-7-13(10)11/h1-2,4-5,11,14H,3,6-7H2 RDWJAMWCGSWTQS-UHFFFAOYSA-N 50396003 CHEMBL2165578 Cholinesterase 11390 ChEMBL 10.1016/j.bmc.2012.09.040 10.7270/Q2ZG6TBT 23062825 Brunhofer, G; Fallarero, A; Karlsson, D; Batista-Gonzalez, A; Shinde, P; Gopi Mohan, C; Vuorela, P Abo Akademi University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396003 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396003&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3756584 163345027 CHEMBL2165578 ZINC00488403 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965491 COc1ccc2c(c[n+](C)c3c4cc5OCOc5cc4ccc23)c1OC InChI=1S/C21H18NO4/c1-22-10-16-13(6-7-17(23-2)21(16)24-3)14-5-4-12-8-18-19(26-11-25-18)9-15(12)20(14)22/h4-10H,11H2,1-3H3/q+1 LLEJIEBFSOEYIV-UHFFFAOYSA-N 25524 17,18-dimethoxy-21-methyl-5,7-dioxa-21-azapentacyclo[11.8.0.0^{2,10}.0^{4,8}.0^{14,19}]henicosa-1(13),2,4(8),9,11,14(19),15,17,20-nonaen-21-ium::CHEMBL13045::CHEMBL258893::Chelerytherine::Toddalin::chelerythrine Cholinesterase 6330 ChEMBL 10.1016/j.bmc.2012.09.040 10.7270/Q2ZG6TBT 23062825 Brunhofer, G; Fallarero, A; Karlsson, D; Batista-Gonzalez, A; Shinde, P; Gopi Mohan, C; Vuorela, P Abo Akademi University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=25524 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=25524&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search CTI 4D9Y,4Y29,4PDZ,3AS1,3ARW 2703 56412814 CHEMBL258893CHEMBL13045 5953 C12227 ZINC03872044 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965493 COc1cc2CCN(C)[C@@H]3Cc4ccc(O)c(Oc5ccc(C[C@@H]6N(C)CCc7cc(OC)c(OO)c(Oc1cc23)c67)cc5)c4 InChI=1S/C36H38N2O7/c1-37-13-11-23-18-31(41-3)32-20-26(23)27(37)16-22-7-10-29(39)30(17-22)43-25-8-5-21(6-9-25)15-28-34-24(12-14-38(28)2)19-33(42-4)35(45-40)36(34)44-32/h5-10,17-20,27-28,39-40H,11-16H2,1-4H3/t27-,28+/m1/s1 SODLLPYGRVMWNH-IZLXSDGUSA-N 50396005 CHEMBL2163794 Cholinesterase 4100 ChEMBL 10.1016/j.bmc.2012.09.040 10.7270/Q2ZG6TBT 23062825 Brunhofer, G; Fallarero, A; Karlsson, D; Batista-Gonzalez, A; Shinde, P; Gopi Mohan, C; Vuorela, P Abo Akademi University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396005 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396005&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71453367 163345029 CHEMBL2163794 C01025 ZINC95555330 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965494 COc1cc2CCN(C)[C@H]3Cc4ccc(Oc5cc(C[C@H]6N(C)CCc7cc(OC)c(OC)c(Oc1cc23)c67)ccc5OC(=O)c1ccc(cc1)[N+]([O-])=O)cc4 InChI=1S/C44H43N3O9/c1-45-18-16-29-23-37(51-3)39-25-33(29)34(45)20-26-6-13-32(14-7-26)54-38-22-27(8-15-36(38)56-44(48)28-9-11-31(12-10-28)47(49)50)21-35-41-30(17-19-46(35)2)24-40(52-4)42(53-5)43(41)55-39/h6-15,22-25,34-35H,16-21H2,1-5H3/t34-,35+/m0/s1 PUAVTDKYTXNVBU-OIDHKYIRSA-N 50396006 CHEMBL405686 Cholinesterase 4200 ChEMBL 10.1016/j.bmc.2012.09.040 10.7270/Q2ZG6TBT 23062825 Brunhofer, G; Fallarero, A; Karlsson, D; Batista-Gonzalez, A; Shinde, P; Gopi Mohan, C; Vuorela, P Abo Akademi University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396006 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396006&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 6610268 163345030 CHEMBL405686 ZINC95612501 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965495 C[C@H]([C@@H]1NC[C@@H](C)C[C@H]1O)c1ccc2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3Cc2c1C InChI=1S/C27H39NO2/c1-15-11-25(30)26(28-14-15)17(3)20-7-8-21-22-6-5-18-12-19(29)9-10-27(18,4)24(22)13-23(21)16(20)2/h5,7-8,15,17,19,22,24-26,28-30H,6,9-14H2,1-4H3/t15-,17-,19-,22-,24-,25+,26-,27-/m0/s1 MALFODICFSIXPO-KFKQDBFTSA-N 50396007 VERATRAMINE Cholinesterase 10780 ChEMBL 10.1016/j.bmc.2012.09.040 10.7270/Q2ZG6TBT 23062825 Brunhofer, G; Fallarero, A; Karlsson, D; Batista-Gonzalez, A; Shinde, P; Gopi Mohan, C; Vuorela, P Abo Akademi University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396007 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396007&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 6070 163345031 9951 C10829 ZINC03875407 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965496 C[C@@H]1CC[C@H]2[C@H](C)[C@H]3CC[C@@]4(O)[C@@H]5CC(=O)[C@H]6CC(=O)CC[C@]6(C)[C@H]5C[C@H]4[C@@H]3CN2C1 InChI=1S/C27H41NO3/c1-15-4-5-24-16(2)18-7-9-27(31)20(19(18)14-28(24)13-15)11-21-22(27)12-25(30)23-10-17(29)6-8-26(21,23)3/h15-16,18-24,31H,4-14H2,1-3H3/t15-,16-,18-,19-,20+,21+,22-,23-,24+,26-,27+/m1/s1 QIIPLDGFOSWORQ-VZORCSEKSA-N 50396008 CHEMBL1512936 Cholinesterase 3680 ChEMBL 10.1016/j.bmc.2012.09.040 10.7270/Q2ZG6TBT 23062825 Brunhofer, G; Fallarero, A; Karlsson, D; Batista-Gonzalez, A; Shinde, P; Gopi Mohan, C; Vuorela, P Abo Akademi University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396008 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396008&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 16407549 163345032 CHEMBL1512936 ZINC64693655 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965497 CCC1=C[C@@H]2CN3CCc4c([nH]c5ccccc45)[C@@](C2)([C@@H]13)C(=O)OC InChI=1S/C21H24N2O2/c1-3-14-10-13-11-21(20(24)25-2)18-16(8-9-23(12-13)19(14)21)15-6-4-5-7-17(15)22-18/h4-7,10,13,19,22H,3,8-9,11-12H2,1-2H3/t13-,19+,21-/m0/s1 CMKFQVZJOWHHDV-NQZBTDCJSA-N 50396009 CHEMBL2163793 Cholinesterase 5170 ChEMBL 10.1016/j.bmc.2012.09.040 10.7270/Q2ZG6TBT 23062825 Brunhofer, G; Fallarero, A; Karlsson, D; Batista-Gonzalez, A; Shinde, P; Gopi Mohan, C; Vuorela, P Abo Akademi University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396009 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396009&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5458190 163345033 CHEMBL2163793 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965498 COC(=O)[C@@H]1[C@@H](O)CC[C@@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12 InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15+,17+,18+,19+/m1/s1 BLGXFZZNTVWLAY-DIRVCLHFSA-N 50026636 17alpha-hydroxy-20alpha-yohimban-16beta-carboxylic acid methyl ester::CHEMBL10347::RAUWOLSCINE HYDROCHLORIDE::alpha-yohimbine::corynanthidine::isoyohimbine::mesoyohimbine::methyl (16beta,17alpha,20alpha)-17-hydroxyyohimban-16-carboxylate::methyl 17alpha-hydroxy-20alpha-yohimban-16beta-carboxylate::rauwolscine Cholinesterase 8380 ChEMBL 10.1016/j.bmc.2012.09.040 10.7270/Q2ZG6TBT 23062825 Brunhofer, G; Fallarero, A; Karlsson, D; Batista-Gonzalez, A; Shinde, P; Gopi Mohan, C; Vuorela, P Abo Akademi University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50026636 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50026636&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 643606 103936228 48565 CHEMBL10347 ZINC03977785 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965499 CC[C@H]1CN2CCc3c([nH]c4ccccc34)[C@H]2C[C@@H]1\C(=C/OC)C(=O)OC InChI=1S/C22H28N2O3/c1-4-14-12-24-10-9-16-15-7-5-6-8-19(15)23-21(16)20(24)11-17(14)18(13-26-2)22(25)27-3/h5-8,13-14,17,20,23H,4,9-12H2,1-3H3/b18-13+/t14-,17-,20+/m0/s1 NMLUOJBSAYAYEM-AZQGJTAVSA-N 50396011 CHEMBL327134 Cholinesterase 4970 ChEMBL 10.1016/j.bmc.2012.09.040 10.7270/Q2ZG6TBT 23062825 Brunhofer, G; Fallarero, A; Karlsson, D; Batista-Gonzalez, A; Shinde, P; Gopi Mohan, C; Vuorela, P Abo Akademi University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396011 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396011&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3037884 163345035 CHEMBL327134 C16972 ZINC26846321 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965500 C1CN2Cc3ccccc3N=C2C1 InChI=1S/C11H12N2/c1-2-5-10-9(4-1)8-13-7-3-6-11(13)12-10/h1-2,4-5H,3,6-8H2 WUFQLZTXIWKION-UHFFFAOYSA-N 50289102 1,2,3,9-Tetrahydro-pyrrolo[2,1-b]quinazoline::CHEMBL2163792::CHEMBL355821 Cholinesterase 11940 ChEMBL 10.1016/j.bmc.2012.09.040 10.7270/Q2ZG6TBT 23062825 Brunhofer, G; Fallarero, A; Karlsson, D; Batista-Gonzalez, A; Shinde, P; Gopi Mohan, C; Vuorela, P Abo Akademi University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50289102 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50289102&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 442894 104130673 CHEMBL355821CHEMBL2163792 C10656 ZINC00265524 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50965501 O[C@H]1CCN2Cc3ccccc3N=C12 InChI=1S/C11H12N2O/c14-10-5-6-13-7-8-3-1-2-4-9(8)12-11(10)13/h1-4,10,14H,5-7H2/t10-/m0/s1 YIICVSCAKJMMDJ-JTQLQIEISA-N 50396012 CHEMBL2163791 Cholinesterase 2530 ChEMBL 10.1016/j.bmc.2012.09.040 10.7270/Q2ZG6TBT 23062825 Brunhofer, G; Fallarero, A; Karlsson, D; Batista-Gonzalez, A; Shinde, P; Gopi Mohan, C; Vuorela, P Abo Akademi University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396012 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396012&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 667496 163345036 CHEMBL2163791 ZINC18286095 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025422 COc1ccc2C(=O)C(CC3C=CN(Cc4cccc(F)c4)C=C3C(C)=O)CCc2c1 InChI=1S/C26H26FNO3/c1-17(29)25-16-28(15-18-4-3-5-22(27)12-18)11-10-20(25)13-21-7-6-19-14-23(31-2)8-9-24(19)26(21)30/h3-5,8-12,14,16,20-21H,6-7,13,15H2,1-2H3 FSRCSQIYHAMNKX-UHFFFAOYSA-N 50291626 CHEMBL4174056 Cholinesterase 4400 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291626 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291626&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 22097165 104133178 ZINC36338527 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51091140 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 2500 ChEMBL 10.1016/j.ejmech.2013.11.026 10.7270/Q2474CC8 24378710 Gonzalez-Naranjo, P; Perez-Macias, N; Campillo, NE; Perez, C; Aran, VJ; Giron, R; Sanchez-Robles, E; Martin, MI; Gomez-Canas, M; Garcia-Arencibia, M; Fernandez-Ruiz, J; Paez, JA Instituto de Qu£mica M£dica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51091141 Nc1ccc2n(CCN3CCCCC3)nc(OCc3ccc4ccccc4c3)c2c1 InChI=1S/C25H28N4O/c26-22-10-11-24-23(17-22)25(27-29(24)15-14-28-12-4-1-5-13-28)30-18-19-8-9-20-6-2-3-7-21(20)16-19/h2-3,6-11,16-17H,1,4-5,12-15,18,26H2 BOMFDVKNDSZEQA-UHFFFAOYSA-N 50447015 CHEMBL3116300 Cholinesterase 1500 ChEMBL 10.1016/j.ejmech.2013.11.026 10.7270/Q2474CC8 24378710 Gonzalez-Naranjo, P; Perez-Macias, N; Campillo, NE; Perez, C; Aran, VJ; Giron, R; Sanchez-Robles, E; Martin, MI; Gomez-Canas, M; Garcia-Arencibia, M; Fernandez-Ruiz, J; Paez, JA Instituto de Qu£mica M£dica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447015 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447015&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 51357599 194944911 CHEMBL3116300 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51091142 Nc1ccc2n(Cc3ccccc3)nc(OCc3ccccc3)c2c1 InChI=1S/C21H19N3O/c22-18-11-12-20-19(13-18)21(25-15-17-9-5-2-6-10-17)23-24(20)14-16-7-3-1-4-8-16/h1-13H,14-15,22H2 XBGJISBWJWTPLH-UHFFFAOYSA-N 50447016 CHEMBL3116298 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2013.11.026 10.7270/Q2474CC8 24378710 Gonzalez-Naranjo, P; Perez-Macias, N; Campillo, NE; Perez, C; Aran, VJ; Giron, R; Sanchez-Robles, E; Martin, MI; Gomez-Canas, M; Garcia-Arencibia, M; Fernandez-Ruiz, J; Paez, JA Instituto de Qu£mica M£dica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447016 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447016&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 51357868 194944912 CHEMBL3116298 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51091143 [O-][N+](=O)c1ccc2n(Cc3ccc4ccccc4c3)nc(OCc3ccc4ccccc4c3)c2c1 InChI=1S/C29H21N3O3/c33-32(34)26-13-14-28-27(17-26)29(35-19-21-10-12-23-6-2-4-8-25(23)16-21)30-31(28)18-20-9-11-22-5-1-3-7-24(22)15-20/h1-17H,18-19H2 JBWCNAHZWJPFEN-UHFFFAOYSA-N 50447017 CHEMBL3116297 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2013.11.026 10.7270/Q2474CC8 24378710 Gonzalez-Naranjo, P; Perez-Macias, N; Campillo, NE; Perez, C; Aran, VJ; Giron, R; Sanchez-Robles, E; Martin, MI; Gomez-Canas, M; Garcia-Arencibia, M; Fernandez-Ruiz, J; Paez, JA Instituto de Qu£mica M£dica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447017 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447017&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76317914 194944913 CHEMBL3116297 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51091144 [O-][N+](=O)c1ccc2n(Cc3ccccc3)nc(OCc3ccc4ccccc4c3)c2c1 InChI=1S/C25H19N3O3/c29-28(30)22-12-13-24-23(15-22)25(26-27(24)16-18-6-2-1-3-7-18)31-17-19-10-11-20-8-4-5-9-21(20)14-19/h1-15H,16-17H2 QTJUKEFFXJKADG-UHFFFAOYSA-N 50447018 CHEMBL3116296 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2013.11.026 10.7270/Q2474CC8 24378710 Gonzalez-Naranjo, P; Perez-Macias, N; Campillo, NE; Perez, C; Aran, VJ; Giron, R; Sanchez-Robles, E; Martin, MI; Gomez-Canas, M; Garcia-Arencibia, M; Fernandez-Ruiz, J; Paez, JA Instituto de Qu£mica M£dica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447018 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447018&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 51357044 194944914 CHEMBL3116296 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51091145 [O-][N+](=O)c1ccc2n(CCN3CCOCC3)nc(OCc3ccc4ccccc4c3)c2c1 InChI=1S/C24H24N4O4/c29-28(30)21-7-8-23-22(16-21)24(25-27(23)10-9-26-11-13-31-14-12-26)32-17-18-5-6-19-3-1-2-4-20(19)15-18/h1-8,15-16H,9-14,17H2 UPOOBDMZXYSRQK-UHFFFAOYSA-N 50447019 CHEMBL3116295 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2013.11.026 10.7270/Q2474CC8 24378710 Gonzalez-Naranjo, P; Perez-Macias, N; Campillo, NE; Perez, C; Aran, VJ; Giron, R; Sanchez-Robles, E; Martin, MI; Gomez-Canas, M; Garcia-Arencibia, M; Fernandez-Ruiz, J; Paez, JA Instituto de Qu£mica M£dica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447019 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447019&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 51357319 194944915 CHEMBL3116295 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51091146 [O-][N+](=O)c1ccc2n(CCN3CCCCC3)nc(OCc3ccc4ccccc4c3)c2c1 InChI=1S/C25H26N4O3/c30-29(31)22-10-11-24-23(17-22)25(26-28(24)15-14-27-12-4-1-5-13-27)32-18-19-8-9-20-6-2-3-7-21(20)16-19/h2-3,6-11,16-17H,1,4-5,12-15,18H2 MSONOJVDYMPNLV-UHFFFAOYSA-N 50447020 CHEMBL3116294 Cholinesterase 2070 ChEMBL 10.1016/j.ejmech.2013.11.026 10.7270/Q2474CC8 24378710 Gonzalez-Naranjo, P; Perez-Macias, N; Campillo, NE; Perez, C; Aran, VJ; Giron, R; Sanchez-Robles, E; Martin, MI; Gomez-Canas, M; Garcia-Arencibia, M; Fernandez-Ruiz, J; Paez, JA Instituto de Qu£mica M£dica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447020 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447020&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76328792 194944916 CHEMBL3116294 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51091147 CCCCCn1nc(OCc2ccc3ccccc3c2)c2cc(ccc12)[N+]([O-])=O InChI=1S/C23H23N3O3/c1-2-3-6-13-25-22-12-11-20(26(27)28)15-21(22)23(24-25)29-16-17-9-10-18-7-4-5-8-19(18)14-17/h4-5,7-12,14-15H,2-3,6,13,16H2,1H3 NVAPCERQXKPLTK-UHFFFAOYSA-N 50447021 CHEMBL3116293 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2013.11.026 10.7270/Q2474CC8 24378710 Gonzalez-Naranjo, P; Perez-Macias, N; Campillo, NE; Perez, C; Aran, VJ; Giron, R; Sanchez-Robles, E; Martin, MI; Gomez-Canas, M; Garcia-Arencibia, M; Fernandez-Ruiz, J; Paez, JA Instituto de Qu£mica M£dica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447021 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447021&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 51357043 194944917 CHEMBL3116293 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51091148 CCCCCn1nc(OCc2ccc(OC)cc2)c2cc(ccc12)[N+]([O-])=O InChI=1S/C20H23N3O4/c1-3-4-5-12-22-19-11-8-16(23(24)25)13-18(19)20(21-22)27-14-15-6-9-17(26-2)10-7-15/h6-11,13H,3-5,12,14H2,1-2H3 FZCLGOSOJHUUST-UHFFFAOYSA-N 50447022 CHEMBL3116289 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2013.11.026 10.7270/Q2474CC8 24378710 Gonzalez-Naranjo, P; Perez-Macias, N; Campillo, NE; Perez, C; Aran, VJ; Giron, R; Sanchez-Robles, E; Martin, MI; Gomez-Canas, M; Garcia-Arencibia, M; Fernandez-Ruiz, J; Paez, JA Instituto de Qu£mica M£dica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447022 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447022&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 51357600 194944918 CHEMBL3116289 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51091149 [O-][N+](=O)c1ccc2n(Cc3ccccc3)nc(OCc3ccccc3)c2c1 InChI=1S/C21H17N3O3/c25-24(26)18-11-12-20-19(13-18)21(27-15-17-9-5-2-6-10-17)22-23(20)14-16-7-3-1-4-8-16/h1-13H,14-15H2 RUJMERFUMDLBHZ-UHFFFAOYSA-N 50447023 CHEMBL1973869 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2013.11.026 10.7270/Q2474CC8 24378710 Gonzalez-Naranjo, P; Perez-Macias, N; Campillo, NE; Perez, C; Aran, VJ; Giron, R; Sanchez-Robles, E; Martin, MI; Gomez-Canas, M; Garcia-Arencibia, M; Fernandez-Ruiz, J; Paez, JA Instituto de Qu£mica M£dica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447023 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447023&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 386338 194944919 CHEMBL1973869 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51091150 [O-][N+](=O)c1ccc2n(Cc3ccccc3)nc(OCC3CCCCC3)c2c1 InChI=1S/C21H23N3O3/c25-24(26)18-11-12-20-19(13-18)21(27-15-17-9-5-2-6-10-17)22-23(20)14-16-7-3-1-4-8-16/h1,3-4,7-8,11-13,17H,2,5-6,9-10,14-15H2 VLMJWSVJQMZYSE-UHFFFAOYSA-N 50447024 CHEMBL3116288 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2013.11.026 10.7270/Q2474CC8 24378710 Gonzalez-Naranjo, P; Perez-Macias, N; Campillo, NE; Perez, C; Aran, VJ; Giron, R; Sanchez-Robles, E; Martin, MI; Gomez-Canas, M; Garcia-Arencibia, M; Fernandez-Ruiz, J; Paez, JA Instituto de Qu£mica M£dica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447024 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447024&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76328790 194944920 CHEMBL3116288 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51091151 CCCCCOc1nn(CCCCC)c2ccc(cc12)[N+]([O-])=O InChI=1S/C17H25N3O3/c1-3-5-7-11-19-16-10-9-14(20(21)22)13-15(16)17(18-19)23-12-8-6-4-2/h9-10,13H,3-8,11-12H2,1-2H3 BYEHLGQTZYKVFJ-UHFFFAOYSA-N 50447025 CHEMBL3116287 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2013.11.026 10.7270/Q2474CC8 24378710 Gonzalez-Naranjo, P; Perez-Macias, N; Campillo, NE; Perez, C; Aran, VJ; Giron, R; Sanchez-Robles, E; Martin, MI; Gomez-Canas, M; Garcia-Arencibia, M; Fernandez-Ruiz, J; Paez, JA Instituto de Qu£mica M£dica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447025 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447025&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 51357316 194944921 CHEMBL3116287 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51091152 C(Cn1nc(OCc2ccc3ccccc3c2)c2ccccc12)N1CCCCC1 InChI=1S/C25H27N3O/c1-6-14-27(15-7-1)16-17-28-24-11-5-4-10-23(24)25(26-28)29-19-20-12-13-21-8-2-3-9-22(21)18-20/h2-5,8-13,18H,1,6-7,14-17,19H2 XGSMKAMHMWHCFH-UHFFFAOYSA-N 50447026 CHEMBL3116286 Cholinesterase 1400 ChEMBL 10.1016/j.ejmech.2013.11.026 10.7270/Q2474CC8 24378710 Gonzalez-Naranjo, P; Perez-Macias, N; Campillo, NE; Perez, C; Aran, VJ; Giron, R; Sanchez-Robles, E; Martin, MI; Gomez-Canas, M; Garcia-Arencibia, M; Fernandez-Ruiz, J; Paez, JA Instituto de Qu£mica M£dica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447026 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447026&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76317913 194944922 CHEMBL3116286 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51091153 C(Cn1nc(OCc2cccc3ccccc23)c2ccccc12)N1CCCCC1 InChI=1S/C25H27N3O/c1-6-15-27(16-7-1)17-18-28-24-14-5-4-13-23(24)25(26-28)29-19-21-11-8-10-20-9-2-3-12-22(20)21/h2-5,8-14H,1,6-7,15-19H2 JUBZXUXHZDJSBQ-UHFFFAOYSA-N 50447027 CHEMBL3116284 Cholinesterase 910 ChEMBL 10.1016/j.ejmech.2013.11.026 10.7270/Q2474CC8 24378710 Gonzalez-Naranjo, P; Perez-Macias, N; Campillo, NE; Perez, C; Aran, VJ; Giron, R; Sanchez-Robles, E; Martin, MI; Gomez-Canas, M; Garcia-Arencibia, M; Fernandez-Ruiz, J; Paez, JA Instituto de Qu£mica M£dica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447027 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447027&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76321623 194944923 CHEMBL3116284 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51091154 C(Cn1nc(OCc2cccc3ccccc23)c2ccccc12)N1CCCC1 InChI=1S/C24H25N3O/c1-2-11-21-19(8-1)9-7-10-20(21)18-28-24-22-12-3-4-13-23(22)27(25-24)17-16-26-14-5-6-15-26/h1-4,7-13H,5-6,14-18H2 CPGYXRHSZAOFEZ-UHFFFAOYSA-N 50447028 CHEMBL3116283 Cholinesterase 6700 ChEMBL 10.1016/j.ejmech.2013.11.026 10.7270/Q2474CC8 24378710 Gonzalez-Naranjo, P; Perez-Macias, N; Campillo, NE; Perez, C; Aran, VJ; Giron, R; Sanchez-Robles, E; Martin, MI; Gomez-Canas, M; Garcia-Arencibia, M; Fernandez-Ruiz, J; Paez, JA Instituto de Qu£mica M£dica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447028 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447028&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76325234 194944924 CHEMBL3116283 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51091155 COc1ccc(COc2nn(Cc3ccc(OC)cc3)c3ccccc23)cc1 InChI=1S/C23H22N2O3/c1-26-19-11-7-17(8-12-19)15-25-22-6-4-3-5-21(22)23(24-25)28-16-18-9-13-20(27-2)14-10-18/h3-14H,15-16H2,1-2H3 GSTMDKTUYLEMNX-UHFFFAOYSA-N 50447029 CHEMBL3116281 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2013.11.026 10.7270/Q2474CC8 24378710 Gonzalez-Naranjo, P; Perez-Macias, N; Campillo, NE; Perez, C; Aran, VJ; Giron, R; Sanchez-Robles, E; Martin, MI; Gomez-Canas, M; Garcia-Arencibia, M; Fernandez-Ruiz, J; Paez, JA Instituto de Qu£mica M£dica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447029 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447029&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 51357040 194944925 CHEMBL3116281 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51091156 COc1ccc(COc2nn(CCN(C(C)C)C(C)C)c3ccccc23)cc1 InChI=1S/C23H31N3O2/c1-17(2)25(18(3)4)14-15-26-22-9-7-6-8-21(22)23(24-26)28-16-19-10-12-20(27-5)13-11-19/h6-13,17-18H,14-16H2,1-5H3 CTXLHWVBEFYFSI-UHFFFAOYSA-N 50447030 CHEMBL3116280 Cholinesterase 2280 ChEMBL 10.1016/j.ejmech.2013.11.026 10.7270/Q2474CC8 24378710 Gonzalez-Naranjo, P; Perez-Macias, N; Campillo, NE; Perez, C; Aran, VJ; Giron, R; Sanchez-Robles, E; Martin, MI; Gomez-Canas, M; Garcia-Arencibia, M; Fernandez-Ruiz, J; Paez, JA Instituto de Qu£mica M£dica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447030 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447030&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 51357598 194944926 CHEMBL3116280 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51091157 C(Oc1nn(CC2CCCCC2)c2ccccc12)C1CCCCC1 InChI=1S/C21H30N2O/c1-3-9-17(10-4-1)15-23-20-14-8-7-13-19(20)21(22-23)24-16-18-11-5-2-6-12-18/h7-8,13-14,17-18H,1-6,9-12,15-16H2 AVHMZIMFLFDTIN-UHFFFAOYSA-N 50447031 CHEMBL3116278 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2013.11.026 10.7270/Q2474CC8 24378710 Gonzalez-Naranjo, P; Perez-Macias, N; Campillo, NE; Perez, C; Aran, VJ; Giron, R; Sanchez-Robles, E; Martin, MI; Gomez-Canas, M; Garcia-Arencibia, M; Fernandez-Ruiz, J; Paez, JA Instituto de Qu£mica M£dica (CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447031 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447031&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76321622 194944927 CHEMBL3116278 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095484 Cn1c(CNc2ccccc2)cc2cc(OCCCC3CCN(Cc4ccccc4)CC3)ccc12 InChI=1S/C31H37N3O/c1-33-29(23-32-28-12-6-3-7-13-28)21-27-22-30(14-15-31(27)33)35-20-8-11-25-16-18-34(19-17-25)24-26-9-4-2-5-10-26/h2-7,9-10,12-15,21-22,25,32H,8,11,16-20,23-24H2,1H3 BDELJWNINDTYLI-UHFFFAOYSA-N 50449209 CHEMBL3127978 Cholinesterase 850 ChEMBL 10.1016/j.ejmech.2013.12.028 10.7270/Q22R3T4P 24530494 Bautista-Aguilera, OM; Esteban, G; Bolea, I; Nikolic, K; Agbaba, D; Moraleda, I; Iriepa, I; Samadi, A; Soriano, E; Unzeta, M; Marco-Contelles, J Laboratorio de Quimica Medica (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449209 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449209&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76325641 194947105 CHEMBL3127978 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095485 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 840 ChEMBL 10.1016/j.ejmech.2013.12.028 10.7270/Q22R3T4P 24530494 Bautista-Aguilera, OM; Esteban, G; Bolea, I; Nikolic, K; Agbaba, D; Moraleda, I; Iriepa, I; Samadi, A; Soriano, E; Unzeta, M; Marco-Contelles, J Laboratorio de Quimica Medica (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095486 Cn1c(CNCC#C)cc2cc(OCCCC3CCN(Cc4ccccc4)CC3)ccc12 InChI=1S/C28H35N3O/c1-3-15-29-21-26-19-25-20-27(11-12-28(25)30(26)2)32-18-7-10-23-13-16-31(17-14-23)22-24-8-5-4-6-9-24/h1,4-6,8-9,11-12,19-20,23,29H,7,10,13-18,21-22H2,2H3 CTGSLKYRZVBABZ-UHFFFAOYSA-N 50449210 CHEMBL3127967 Cholinesterase 830 ChEMBL 10.1016/j.ejmech.2013.12.028 10.7270/Q22R3T4P 24530494 Bautista-Aguilera, OM; Esteban, G; Bolea, I; Nikolic, K; Agbaba, D; Moraleda, I; Iriepa, I; Samadi, A; Soriano, E; Unzeta, M; Marco-Contelles, J Laboratorio de Quimica Medica (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449210 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449210&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76318337 194947106 CHEMBL3127967 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095487 Cn1c(CN2CCOCC2)cc2cc(OCCCC3CCN(Cc4ccccc4)CC3)ccc12 InChI=1S/C29H39N3O2/c1-30-27(23-32-15-18-33-19-16-32)20-26-21-28(9-10-29(26)30)34-17-5-8-24-11-13-31(14-12-24)22-25-6-3-2-4-7-25/h2-4,6-7,9-10,20-21,24H,5,8,11-19,22-23H2,1H3 GIMCXESHZUNKQO-UHFFFAOYSA-N 50449211 CHEMBL3127966 Cholinesterase 790 ChEMBL 10.1016/j.ejmech.2013.12.028 10.7270/Q22R3T4P 24530494 Bautista-Aguilera, OM; Esteban, G; Bolea, I; Nikolic, K; Agbaba, D; Moraleda, I; Iriepa, I; Samadi, A; Soriano, E; Unzeta, M; Marco-Contelles, J Laboratorio de Quimica Medica (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449211 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449211&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76311136 194947107 CHEMBL3127966 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095488 Cn1c(CNCC=C)cc2cc(OCCCC3CCN(Cc4ccccc4)CC3)ccc12 InChI=1S/C28H37N3O/c1-3-15-29-21-26-19-25-20-27(11-12-28(25)30(26)2)32-18-7-10-23-13-16-31(17-14-23)22-24-8-5-4-6-9-24/h3-6,8-9,11-12,19-20,23,29H,1,7,10,13-18,21-22H2,2H3 KVRTXVQQTAWRKG-UHFFFAOYSA-N 50449212 CHEMBL3127968 Cholinesterase 460 ChEMBL 10.1016/j.ejmech.2013.12.028 10.7270/Q22R3T4P 24530494 Bautista-Aguilera, OM; Esteban, G; Bolea, I; Nikolic, K; Agbaba, D; Moraleda, I; Iriepa, I; Samadi, A; Soriano, E; Unzeta, M; Marco-Contelles, J Laboratorio de Quimica Medica (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449212 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449212&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76311137 194947108 CHEMBL3127968 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095489 CN(CC#C)Cc1cc2cc(OCCCC3CCN(Cc4ccccc4)CC3)ccc2n1C InChI=1S/C29H37N3O/c1-4-16-30(2)23-27-20-26-21-28(12-13-29(26)31(27)3)33-19-8-11-24-14-17-32(18-15-24)22-25-9-6-5-7-10-25/h1,5-7,9-10,12-13,20-21,24H,8,11,14-19,22-23H2,2-3H3 ADCBAOTWERXLAP-UHFFFAOYSA-N 50359391 CHEMBL1929421 Cholinesterase 460 ChEMBL 10.1016/j.ejmech.2013.12.028 10.7270/Q22R3T4P 24530494 Bautista-Aguilera, OM; Esteban, G; Bolea, I; Nikolic, K; Agbaba, D; Moraleda, I; Iriepa, I; Samadi, A; Soriano, E; Unzeta, M; Marco-Contelles, J Laboratorio de Quimica Medica (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50359391 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50359391&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53378764 136963415 CHEMBL1929421 ZINC72316998 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095492 Cn1c(CNCc2ccccc2)cc2cc(OCCCC3CCN(Cc4ccccc4)CC3)ccc12 InChI=1S/C32H39N3O/c1-34-30(24-33-23-27-9-4-2-5-10-27)21-29-22-31(14-15-32(29)34)36-20-8-13-26-16-18-35(19-17-26)25-28-11-6-3-7-12-28/h2-7,9-12,14-15,21-22,26,33H,8,13,16-20,23-25H2,1H3 HCEAUUMECSIZQJ-UHFFFAOYSA-N 50449214 CHEMBL3127977 Cholinesterase 290 ChEMBL 10.1016/j.ejmech.2013.12.028 10.7270/Q22R3T4P 24530494 Bautista-Aguilera, OM; Esteban, G; Bolea, I; Nikolic, K; Agbaba, D; Moraleda, I; Iriepa, I; Samadi, A; Soriano, E; Unzeta, M; Marco-Contelles, J Laboratorio de Quimica Medica (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449214 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449214&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76329220 194947110 CHEMBL3127977 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095503 COc1ccc2n(C)c(CNCc3ccccc3)cc2c1 InChI=1S/C18H20N2O/c1-20-16(13-19-12-14-6-4-3-5-7-14)10-15-11-17(21-2)8-9-18(15)20/h3-11,19H,12-13H2,1-2H3 GJOALJLTIZLPNU-UHFFFAOYSA-N 50449219 CHEMBL3124971 Cholinesterase 22900 ChEMBL 10.1016/j.ejmech.2013.12.028 10.7270/Q22R3T4P 24530494 Bautista-Aguilera, OM; Esteban, G; Bolea, I; Nikolic, K; Agbaba, D; Moraleda, I; Iriepa, I; Samadi, A; Soriano, E; Unzeta, M; Marco-Contelles, J Laboratorio de Quimica Medica (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449219 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449219&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76332873 194947115 CHEMBL3124971 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095509 Cn1c(CNCc2ccccc2)cc2cc(OCCCC3CCN(Cc4ccccc4)CC3)ccc12 InChI=1S/C32H39N3O/c1-34-30(24-33-23-27-9-4-2-5-10-27)21-29-22-31(14-15-32(29)34)36-20-8-13-26-16-18-35(19-17-26)25-28-11-6-3-7-12-28/h2-7,9-12,14-15,21-22,26,33H,8,13,16-20,23-25H2,1H3 HCEAUUMECSIZQJ-UHFFFAOYSA-N 50449214 CHEMBL3127977 Cholinesterase 290 ChEMBL 10.1016/j.ejmech.2013.12.028 10.7270/Q22R3T4P 24530494 Bautista-Aguilera, OM; Esteban, G; Bolea, I; Nikolic, K; Agbaba, D; Moraleda, I; Iriepa, I; Samadi, A; Soriano, E; Unzeta, M; Marco-Contelles, J Laboratorio de Quimica Medica (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449214 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449214&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76329220 194947110 CHEMBL3127977 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095510 Cn1c(CNCC=C)cc2cc(OCCCC3CCN(Cc4ccccc4)CC3)ccc12 InChI=1S/C28H37N3O/c1-3-15-29-21-26-19-25-20-27(11-12-28(25)30(26)2)32-18-7-10-23-13-16-31(17-14-23)22-24-8-5-4-6-9-24/h3-6,8-9,11-12,19-20,23,29H,1,7,10,13-18,21-22H2,2H3 KVRTXVQQTAWRKG-UHFFFAOYSA-N 50449212 CHEMBL3127968 Cholinesterase 460 ChEMBL 10.1016/j.ejmech.2013.12.028 10.7270/Q22R3T4P 24530494 Bautista-Aguilera, OM; Esteban, G; Bolea, I; Nikolic, K; Agbaba, D; Moraleda, I; Iriepa, I; Samadi, A; Soriano, E; Unzeta, M; Marco-Contelles, J Laboratorio de Quimica Medica (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449212 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449212&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76311137 194947108 CHEMBL3127968 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095511 Cn1c(CNCC#C)cc2cc(OCCCC3CCN(Cc4ccccc4)CC3)ccc12 InChI=1S/C28H35N3O/c1-3-15-29-21-26-19-25-20-27(11-12-28(25)30(26)2)32-18-7-10-23-13-16-31(17-14-23)22-24-8-5-4-6-9-24/h1,4-6,8-9,11-12,19-20,23,29H,7,10,13-18,21-22H2,2H3 CTGSLKYRZVBABZ-UHFFFAOYSA-N 50449210 CHEMBL3127967 Cholinesterase 830 ChEMBL 10.1016/j.ejmech.2013.12.028 10.7270/Q22R3T4P 24530494 Bautista-Aguilera, OM; Esteban, G; Bolea, I; Nikolic, K; Agbaba, D; Moraleda, I; Iriepa, I; Samadi, A; Soriano, E; Unzeta, M; Marco-Contelles, J Laboratorio de Quimica Medica (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449210 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449210&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76318337 194947106 CHEMBL3127967 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095512 Cn1c(CNc2ccccc2)cc2cc(OCCCC3CCN(Cc4ccccc4)CC3)ccc12 InChI=1S/C31H37N3O/c1-33-29(23-32-28-12-6-3-7-13-28)21-27-22-30(14-15-31(27)33)35-20-8-11-25-16-18-34(19-17-25)24-26-9-4-2-5-10-26/h2-7,9-10,12-15,21-22,25,32H,8,11,16-20,23-24H2,1H3 BDELJWNINDTYLI-UHFFFAOYSA-N 50449209 CHEMBL3127978 Cholinesterase 849 ChEMBL 10.1016/j.ejmech.2013.12.028 10.7270/Q22R3T4P 24530494 Bautista-Aguilera, OM; Esteban, G; Bolea, I; Nikolic, K; Agbaba, D; Moraleda, I; Iriepa, I; Samadi, A; Soriano, E; Unzeta, M; Marco-Contelles, J Laboratorio de Quimica Medica (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449209 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449209&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76325641 194947105 CHEMBL3127978 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095514 COc1ccc2n(C)c(CNCc3ccccc3)cc2c1 InChI=1S/C18H20N2O/c1-20-16(13-19-12-14-6-4-3-5-7-14)10-15-11-17(21-2)8-9-18(15)20/h3-11,19H,12-13H2,1-2H3 GJOALJLTIZLPNU-UHFFFAOYSA-N 50449219 CHEMBL3124971 Cholinesterase 22909 ChEMBL 10.1016/j.ejmech.2013.12.028 10.7270/Q22R3T4P 24530494 Bautista-Aguilera, OM; Esteban, G; Bolea, I; Nikolic, K; Agbaba, D; Moraleda, I; Iriepa, I; Samadi, A; Soriano, E; Unzeta, M; Marco-Contelles, J Laboratorio de Quimica Medica (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449219 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449219&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76332873 194947115 CHEMBL3124971 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095515 Cn1c(CO)cc2cc(OCCCC3CCN(Cc4ccccc4)CC3)ccc12 InChI=1S/C25H32N2O2/c1-26-23(19-28)16-22-17-24(9-10-25(22)26)29-15-5-8-20-11-13-27(14-12-20)18-21-6-3-2-4-7-21/h2-4,6-7,9-10,16-17,20,28H,5,8,11-15,18-19H2,1H3 GRSNPHJETKIVDS-UHFFFAOYSA-N 50449217 CHEMBL3127976 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2013.12.028 10.7270/Q22R3T4P 24530494 Bautista-Aguilera, OM; Esteban, G; Bolea, I; Nikolic, K; Agbaba, D; Moraleda, I; Iriepa, I; Samadi, A; Soriano, E; Unzeta, M; Marco-Contelles, J Laboratorio de Quimica Medica (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449217 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449217&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76318340 194947113 CHEMBL3127976 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095516 Cn1c(cc2cc(OCCCC3CCN(Cc4ccccc4)CC3)ccc12)C(=O)NCC#C InChI=1S/C28H33N3O2/c1-3-15-29-28(32)27-20-24-19-25(11-12-26(24)30(27)2)33-18-7-10-22-13-16-31(17-14-22)21-23-8-5-4-6-9-23/h1,4-6,8-9,11-12,19-20,22H,7,10,13-18,21H2,2H3,(H,29,32) JSXLPXFQNZANLF-UHFFFAOYSA-N 50449218 CHEMBL3127975 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2013.12.028 10.7270/Q22R3T4P 24530494 Bautista-Aguilera, OM; Esteban, G; Bolea, I; Nikolic, K; Agbaba, D; Moraleda, I; Iriepa, I; Samadi, A; Soriano, E; Unzeta, M; Marco-Contelles, J Laboratorio de Quimica Medica (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449218 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449218&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76332875 194947114 CHEMBL3127975 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095517 Cn1c(cc2cc(OCCCC3CCN(Cc4ccccc4)CC3)ccc12)C(=O)N1CCOCC1 InChI=1S/C29H37N3O3/c1-30-27-10-9-26(20-25(27)21-28(30)29(33)32-15-18-34-19-16-32)35-17-5-8-23-11-13-31(14-12-23)22-24-6-3-2-4-7-24/h2-4,6-7,9-10,20-21,23H,5,8,11-19,22H2,1H3 OGDDOHQOIBQGBC-UHFFFAOYSA-N 50449215 CHEMBL3127974 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2013.12.028 10.7270/Q22R3T4P 24530494 Bautista-Aguilera, OM; Esteban, G; Bolea, I; Nikolic, K; Agbaba, D; Moraleda, I; Iriepa, I; Samadi, A; Soriano, E; Unzeta, M; Marco-Contelles, J Laboratorio de Quimica Medica (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449215 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449215&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76318339 194947111 CHEMBL3127974 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095518 Cn1c(cc2cc(OCCCC3CCN(Cc4ccccc4)CC3)ccc12)C(=O)Nc1ccccc1 InChI=1S/C31H35N3O2/c1-33-29-15-14-28(21-26(29)22-30(33)31(35)32-27-12-6-3-7-13-27)36-20-8-11-24-16-18-34(19-17-24)23-25-9-4-2-5-10-25/h2-7,9-10,12-15,21-22,24H,8,11,16-20,23H2,1H3,(H,32,35) YVYQMYCCBJDVCH-UHFFFAOYSA-N 50449220 CHEMBL3127973 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2013.12.028 10.7270/Q22R3T4P 24530494 Bautista-Aguilera, OM; Esteban, G; Bolea, I; Nikolic, K; Agbaba, D; Moraleda, I; Iriepa, I; Samadi, A; Soriano, E; Unzeta, M; Marco-Contelles, J Laboratorio de Quimica Medica (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449220 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449220&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76322024 194947116 CHEMBL3127973 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095519 Cn1c(cc2cc(OCCCC3CCN(Cc4ccccc4)CC3)ccc12)C(=O)NCc1ccccc1 InChI=1S/C32H37N3O2/c1-34-30-15-14-29(21-28(30)22-31(34)32(36)33-23-26-9-4-2-5-10-26)37-20-8-13-25-16-18-35(19-17-25)24-27-11-6-3-7-12-27/h2-7,9-12,14-15,21-22,25H,8,13,16-20,23-24H2,1H3,(H,33,36) SQZHYASTMAIGQR-UHFFFAOYSA-N 50449221 CHEMBL3127972 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2013.12.028 10.7270/Q22R3T4P 24530494 Bautista-Aguilera, OM; Esteban, G; Bolea, I; Nikolic, K; Agbaba, D; Moraleda, I; Iriepa, I; Samadi, A; Soriano, E; Unzeta, M; Marco-Contelles, J Laboratorio de Quimica Medica (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449221 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449221&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76332874 194947117 CHEMBL3127972 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095520 Cn1c(cc2cc(OCCCC3CCN(Cc4ccccc4)CC3)ccc12)C(O)=O InChI=1S/C25H30N2O3/c1-26-23-10-9-22(16-21(23)17-24(26)25(28)29)30-15-5-8-19-11-13-27(14-12-19)18-20-6-3-2-4-7-20/h2-4,6-7,9-10,16-17,19H,5,8,11-15,18H2,1H3,(H,28,29) VZEKRYBNAKTFQR-UHFFFAOYSA-N 50449213 CHEMBL3127971 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2013.12.028 10.7270/Q22R3T4P 24530494 Bautista-Aguilera, OM; Esteban, G; Bolea, I; Nikolic, K; Agbaba, D; Moraleda, I; Iriepa, I; Samadi, A; Soriano, E; Unzeta, M; Marco-Contelles, J Laboratorio de Quimica Medica (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449213 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449213&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76325640 194947109 CHEMBL3127971 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095521 CCOC(=O)c1cc2cc(OCCCC3CCN(Cc4ccccc4)CC3)ccc2n1C InChI=1S/C27H34N2O3/c1-3-31-27(30)26-19-23-18-24(11-12-25(23)28(26)2)32-17-7-10-21-13-15-29(16-14-21)20-22-8-5-4-6-9-22/h4-6,8-9,11-12,18-19,21H,3,7,10,13-17,20H2,1-2H3 IVEAMFQRMFQHLP-UHFFFAOYSA-N 50449216 CHEMBL3127970 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2013.12.028 10.7270/Q22R3T4P 24530494 Bautista-Aguilera, OM; Esteban, G; Bolea, I; Nikolic, K; Agbaba, D; Moraleda, I; Iriepa, I; Samadi, A; Soriano, E; Unzeta, M; Marco-Contelles, J Laboratorio de Quimica Medica (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449216 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449216&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76318338 194947112 CHEMBL3127970 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095522 COc1ccc2n(C)c(cc2c1)C(=O)NCc1ccccc1 InChI=1S/C18H18N2O2/c1-20-16-9-8-15(22-2)10-14(16)11-17(20)18(21)19-12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3,(H,19,21) UDLRNLQUYOYAEF-UHFFFAOYSA-N 50449222 CHEMBL3127969 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2013.12.028 10.7270/Q22R3T4P 24530494 Bautista-Aguilera, OM; Esteban, G; Bolea, I; Nikolic, K; Agbaba, D; Moraleda, I; Iriepa, I; Samadi, A; Soriano, E; Unzeta, M; Marco-Contelles, J Laboratorio de Quimica Medica (IQOG, CSIC) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449222 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449222&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 50745004 194947118 CHEMBL3127969 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083970 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 5380 ChEMBL 10.1016/j.ejmech.2013.10.024 10.7270/Q2GQ7070 24211638 Asadipour, A; Alipour, M; Jafari, M; Khoobi, M; Emami, S; Nadri, H; Sakhteman, A; Moradi, A; Sheibani, V; Homayouni Moghadam, F; Shafiee, A; Foroumadi, A Kerman University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083971 COc1cccc2cc(C(=O)NCCC3CCN(Cc4ccccc4)CC3)c(=O)oc12 InChI=1S/C25H28N2O4/c1-30-22-9-5-8-20-16-21(25(29)31-23(20)22)24(28)26-13-10-18-11-14-27(15-12-18)17-19-6-3-2-4-7-19/h2-9,16,18H,10-15,17H2,1H3,(H,26,28) JPFKUWFJZDXCEF-UHFFFAOYSA-N 50443513 CHEMBL3087903 Cholinesterase 18000 ChEMBL 10.1016/j.ejmech.2013.10.024 10.7270/Q2GQ7070 24211638 Asadipour, A; Alipour, M; Jafari, M; Khoobi, M; Emami, S; Nadri, H; Sakhteman, A; Moradi, A; Sheibani, V; Homayouni Moghadam, F; Shafiee, A; Foroumadi, A Kerman University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443513 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443513&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76331720 194941409 CHEMBL3087903 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083972 Oc1ccc2cc(C(=O)NCCC3CCN(Cc4ccccc4)CC3)c(=O)oc2c1 InChI=1S/C24H26N2O4/c27-20-7-6-19-14-21(24(29)30-22(19)15-20)23(28)25-11-8-17-9-12-26(13-10-17)16-18-4-2-1-3-5-18/h1-7,14-15,17,27H,8-13,16H2,(H,25,28) BRQJEWFIJCKYJU-UHFFFAOYSA-N 50443514 CHEMBL3087902 Cholinesterase 46000 ChEMBL 10.1016/j.ejmech.2013.10.024 10.7270/Q2GQ7070 24211638 Asadipour, A; Alipour, M; Jafari, M; Khoobi, M; Emami, S; Nadri, H; Sakhteman, A; Moradi, A; Sheibani, V; Homayouni Moghadam, F; Shafiee, A; Foroumadi, A Kerman University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443514 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443514&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76331719 194941410 CHEMBL3087902 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083973 COc1ccc2cc(C(=O)NCCC3CCN(Cc4ccccc4)CC3)c(=O)oc2c1 InChI=1S/C25H28N2O4/c1-30-21-8-7-20-15-22(25(29)31-23(20)16-21)24(28)26-12-9-18-10-13-27(14-11-18)17-19-5-3-2-4-6-19/h2-8,15-16,18H,9-14,17H2,1H3,(H,26,28) BOYUHPHGPUPZAN-UHFFFAOYSA-N 50443515 CHEMBL3087901 Cholinesterase 357 ChEMBL 10.1016/j.ejmech.2013.10.024 10.7270/Q2GQ7070 24211638 Asadipour, A; Alipour, M; Jafari, M; Khoobi, M; Emami, S; Nadri, H; Sakhteman, A; Moradi, A; Sheibani, V; Homayouni Moghadam, F; Shafiee, A; Foroumadi, A Kerman University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443515 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443515&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76320834 194941411 CHEMBL3087901 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083974 Oc1ccc2oc(=O)c(cc2c1)C(=O)NCCC1CCN(Cc2ccccc2)CC1 InChI=1S/C24H26N2O4/c27-20-6-7-22-19(14-20)15-21(24(29)30-22)23(28)25-11-8-17-9-12-26(13-10-17)16-18-4-2-1-3-5-18/h1-7,14-15,17,27H,8-13,16H2,(H,25,28) FJZPZKMHBIHIKE-UHFFFAOYSA-N 50443516 CHEMBL3087900 Cholinesterase 15610 ChEMBL 10.1016/j.ejmech.2013.10.024 10.7270/Q2GQ7070 24211638 Asadipour, A; Alipour, M; Jafari, M; Khoobi, M; Emami, S; Nadri, H; Sakhteman, A; Moradi, A; Sheibani, V; Homayouni Moghadam, F; Shafiee, A; Foroumadi, A Kerman University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443516 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443516&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76309901 194941412 CHEMBL3087900 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083975 [O-][N+](=O)c1ccc2oc(=O)c(cc2c1)C(=O)NCCC1CCN(Cc2ccccc2)CC1 InChI=1S/C24H25N3O5/c28-23(21-15-19-14-20(27(30)31)6-7-22(19)32-24(21)29)25-11-8-17-9-12-26(13-10-17)16-18-4-2-1-3-5-18/h1-7,14-15,17H,8-13,16H2,(H,25,28) NUGZVYOVNXDMJO-UHFFFAOYSA-N 50443517 CHEMBL3087899 Cholinesterase 7900 ChEMBL 10.1016/j.ejmech.2013.10.024 10.7270/Q2GQ7070 24211638 Asadipour, A; Alipour, M; Jafari, M; Khoobi, M; Emami, S; Nadri, H; Sakhteman, A; Moradi, A; Sheibani, V; Homayouni Moghadam, F; Shafiee, A; Foroumadi, A Kerman University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443517 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443517&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76309900 194941413 CHEMBL3087899 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083976 Brc1ccc2oc(=O)c(cc2c1)C(=O)NCCC1CCN(Cc2ccccc2)CC1 InChI=1S/C24H25BrN2O3/c25-20-6-7-22-19(14-20)15-21(24(29)30-22)23(28)26-11-8-17-9-12-27(13-10-17)16-18-4-2-1-3-5-18/h1-7,14-15,17H,8-13,16H2,(H,26,28) KMWCKFRGWGNUNX-UHFFFAOYSA-N 50443518 CHEMBL3087898 Cholinesterase 420 ChEMBL 10.1016/j.ejmech.2013.10.024 10.7270/Q2GQ7070 24211638 Asadipour, A; Alipour, M; Jafari, M; Khoobi, M; Emami, S; Nadri, H; Sakhteman, A; Moradi, A; Sheibani, V; Homayouni Moghadam, F; Shafiee, A; Foroumadi, A Kerman University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443518 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443518&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76331718 194941414 CHEMBL3087898 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083977 O=C(NCCC1CCN(Cc2ccccc2)CC1)c1cc2ccccc2oc1=O InChI=1S/C24H26N2O3/c27-23(21-16-20-8-4-5-9-22(20)29-24(21)28)25-13-10-18-11-14-26(15-12-18)17-19-6-2-1-3-7-19/h1-9,16,18H,10-15,17H2,(H,25,27) XPPXKFPMGKJISB-UHFFFAOYSA-N 50443519 CHEMBL3087897 Cholinesterase 371 ChEMBL 10.1016/j.ejmech.2013.10.024 10.7270/Q2GQ7070 24211638 Asadipour, A; Alipour, M; Jafari, M; Khoobi, M; Emami, S; Nadri, H; Sakhteman, A; Moradi, A; Sheibani, V; Homayouni Moghadam, F; Shafiee, A; Foroumadi, A Kerman University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443519 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443519&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76324493 194941415 CHEMBL3087897 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083978 Oc1ccc2cc(C(=O)NC3CCN(Cc4ccccc4)CC3)c(=O)oc2c1 InChI=1S/C22H22N2O4/c25-18-7-6-16-12-19(22(27)28-20(16)13-18)21(26)23-17-8-10-24(11-9-17)14-15-4-2-1-3-5-15/h1-7,12-13,17,25H,8-11,14H2,(H,23,26) HJUZVDVNQYJSOC-UHFFFAOYSA-N 50443520 CHEMBL3087896 Cholinesterase 55000 ChEMBL 10.1016/j.ejmech.2013.10.024 10.7270/Q2GQ7070 24211638 Asadipour, A; Alipour, M; Jafari, M; Khoobi, M; Emami, S; Nadri, H; Sakhteman, A; Moradi, A; Sheibani, V; Homayouni Moghadam, F; Shafiee, A; Foroumadi, A Kerman University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443520 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443520&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76331717 194941416 CHEMBL3087896 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083979 COc1cccc2cc(C(=O)NC3CCN(Cc4ccccc4)CC3)c(=O)oc12 InChI=1S/C23H24N2O4/c1-28-20-9-5-8-17-14-19(23(27)29-21(17)20)22(26)24-18-10-12-25(13-11-18)15-16-6-3-2-4-7-16/h2-9,14,18H,10-13,15H2,1H3,(H,24,26) XXTZSMMGYBDUDM-UHFFFAOYSA-N 50443521 CHEMBL3087908 Cholinesterase 20000 ChEMBL 10.1016/j.ejmech.2013.10.024 10.7270/Q2GQ7070 24211638 Asadipour, A; Alipour, M; Jafari, M; Khoobi, M; Emami, S; Nadri, H; Sakhteman, A; Moradi, A; Sheibani, V; Homayouni Moghadam, F; Shafiee, A; Foroumadi, A Kerman University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443521 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443521&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 26681594 194941417 CHEMBL3087908 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083980 COc1ccc2cc(C(=O)NC3CCN(Cc4ccccc4)CC3)c(=O)oc2c1 InChI=1S/C23H24N2O4/c1-28-19-8-7-17-13-20(23(27)29-21(17)14-19)22(26)24-18-9-11-25(12-10-18)15-16-5-3-2-4-6-16/h2-8,13-14,18H,9-12,15H2,1H3,(H,24,26) YDYIOMIQOHASPL-UHFFFAOYSA-N 50443522 CHEMBL3087907 Cholinesterase 27000 ChEMBL 10.1016/j.ejmech.2013.10.024 10.7270/Q2GQ7070 24211638 Asadipour, A; Alipour, M; Jafari, M; Khoobi, M; Emami, S; Nadri, H; Sakhteman, A; Moradi, A; Sheibani, V; Homayouni Moghadam, F; Shafiee, A; Foroumadi, A Kerman University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443522 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443522&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76331721 194941418 CHEMBL3087907 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083981 [O-][N+](=O)c1ccc2oc(=O)c(cc2c1)C(=O)NC1CCN(Cc2ccccc2)CC1 InChI=1S/C22H21N3O5/c26-21(19-13-16-12-18(25(28)29)6-7-20(16)30-22(19)27)23-17-8-10-24(11-9-17)14-15-4-2-1-3-5-15/h1-7,12-13,17H,8-11,14H2,(H,23,26) ZVWLEWMOZZCARR-UHFFFAOYSA-N 50443523 CHEMBL3087906 Cholinesterase 22000 ChEMBL 10.1016/j.ejmech.2013.10.024 10.7270/Q2GQ7070 24211638 Asadipour, A; Alipour, M; Jafari, M; Khoobi, M; Emami, S; Nadri, H; Sakhteman, A; Moradi, A; Sheibani, V; Homayouni Moghadam, F; Shafiee, A; Foroumadi, A Kerman University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443523 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443523&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76320835 194941419 CHEMBL3087906 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083982 Brc1ccc2oc(=O)c(cc2c1)C(=O)NC1CCN(Cc2ccccc2)CC1 InChI=1S/C22H21BrN2O3/c23-17-6-7-20-16(12-17)13-19(22(27)28-20)21(26)24-18-8-10-25(11-9-18)14-15-4-2-1-3-5-15/h1-7,12-13,18H,8-11,14H2,(H,24,26) GLSIDGMLMYKUHZ-UHFFFAOYSA-N 50443524 CHEMBL3087905 Cholinesterase 42000 ChEMBL 10.1016/j.ejmech.2013.10.024 10.7270/Q2GQ7070 24211638 Asadipour, A; Alipour, M; Jafari, M; Khoobi, M; Emami, S; Nadri, H; Sakhteman, A; Moradi, A; Sheibani, V; Homayouni Moghadam, F; Shafiee, A; Foroumadi, A Kerman University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443524 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443524&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76309902 194941420 CHEMBL3087905 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083983 O=C(NC1CCN(Cc2ccccc2)CC1)c1cc2ccccc2oc1=O InChI=1S/C22H22N2O3/c25-21(19-14-17-8-4-5-9-20(17)27-22(19)26)23-18-10-12-24(13-11-18)15-16-6-2-1-3-7-16/h1-9,14,18H,10-13,15H2,(H,23,25) CWGBBJOGHVPXPJ-UHFFFAOYSA-N 50443525 CHEMBL3087904 Cholinesterase 17000 ChEMBL 10.1016/j.ejmech.2013.10.024 10.7270/Q2GQ7070 24211638 Asadipour, A; Alipour, M; Jafari, M; Khoobi, M; Emami, S; Nadri, H; Sakhteman, A; Moradi, A; Sheibani, V; Homayouni Moghadam, F; Shafiee, A; Foroumadi, A Kerman University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443525 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443525&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1071217 194941421 CHEMBL3087904 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084362 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 19 ChEMBL 10.1016/j.bmc.2013.09.050 10.7270/Q2DV1MCQ 24128814 Sun, Y; Chen, J; Chen, X; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084363 COc1ccc(\C=C2/COc3cc(O)ccc3C2=O)cc1 InChI=1S/C17H14O4/c1-20-14-5-2-11(3-6-14)8-12-10-21-16-9-13(18)4-7-15(16)17(12)19/h2-9,18H,10H2,1H3/b12-8+ DLQSYZMPSWHYMW-XYOKQWHBSA-N 50443669 Bonducellin Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2013.09.050 10.7270/Q2DV1MCQ 24128814 Sun, Y; Chen, J; Chen, X; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443669 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443669&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14079439 194941565 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084364 COc1ccc(CC2COc3cc(OCCCCCCNc4c5CCCCc5nc5ccccc45)ccc3C2=O)cc1 InChI=1S/C36H40N2O4/c1-40-27-16-14-25(15-17-27)22-26-24-42-34-23-28(18-19-31(34)36(26)39)41-21-9-3-2-8-20-37-35-29-10-4-6-12-32(29)38-33-13-7-5-11-30(33)35/h4,6,10,12,14-19,23,26H,2-3,5,7-9,11,13,20-22,24H2,1H3,(H,37,38) VPASMJLIZUECKG-UHFFFAOYSA-N 50443670 CHEMBL3093172 Cholinesterase 27 ChEMBL 10.1016/j.bmc.2013.09.050 10.7270/Q2DV1MCQ 24128814 Sun, Y; Chen, J; Chen, X; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443670 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443670&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72696517 194941566 CHEMBL3093172 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084365 COc1ccc(\C=C2/COc3cc(OCCCCCCCCNc4c5CCCCc5nc5cc(Cl)ccc45)ccc3C2=O)cc1 InChI=1S/C38H41ClN2O4/c1-43-29-15-12-26(13-16-29)22-27-25-45-36-24-30(17-19-33(36)38(27)42)44-21-9-5-3-2-4-8-20-40-37-31-10-6-7-11-34(31)41-35-23-28(39)14-18-32(35)37/h12-19,22-24H,2-11,20-21,25H2,1H3,(H,40,41)/b27-22+ HQFRITYNDMDAOQ-HPNDGRJYSA-N 50443671 CHEMBL3093171 Cholinesterase 613 ChEMBL 10.1016/j.bmc.2013.09.050 10.7270/Q2DV1MCQ 24128814 Sun, Y; Chen, J; Chen, X; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443671 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443671&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72697058 194941567 CHEMBL3093171 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084366 COc1ccc(\C=C2/COc3cc(OCCCCCCNc4c5CCCCc5nc5cc(Cl)ccc45)ccc3C2=O)cc1 InChI=1S/C36H37ClN2O4/c1-41-27-13-10-24(11-14-27)20-25-23-43-34-22-28(15-17-31(34)36(25)40)42-19-7-3-2-6-18-38-35-29-8-4-5-9-32(29)39-33-21-26(37)12-16-30(33)35/h10-17,20-22H,2-9,18-19,23H2,1H3,(H,38,39)/b25-20+ HMSFDXCISPMZNG-LKUDQCMESA-N 50443672 CHEMBL3093170 Cholinesterase 26 ChEMBL 10.1016/j.bmc.2013.09.050 10.7270/Q2DV1MCQ 24128814 Sun, Y; Chen, J; Chen, X; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443672 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443672&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72696920 194941568 CHEMBL3093170 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084367 COc1cc(\C=C2/COc3cc(OCCCCCCNc4c5CCCCc5nc5ccccc45)ccc3C2=O)cc(OC)c1OC InChI=1S/C38H42N2O6/c1-42-34-21-25(22-35(43-2)38(34)44-3)20-26-24-46-33-23-27(16-17-30(33)37(26)41)45-19-11-5-4-10-18-39-36-28-12-6-8-14-31(28)40-32-15-9-7-13-29(32)36/h6,8,12,14,16-17,20-23H,4-5,7,9-11,13,15,18-19,24H2,1-3H3,(H,39,40)/b26-20+ LEYSKBUXJHEJRR-LHLOQNFPSA-N 50443673 CHEMBL3093169 Cholinesterase 109 ChEMBL 10.1016/j.bmc.2013.09.050 10.7270/Q2DV1MCQ 24128814 Sun, Y; Chen, J; Chen, X; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443673 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443673&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72696919 194941569 CHEMBL3093169 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084368 COc1ccc(\C=C2/COc3cc(OCCCCCCNc4c5CCCCc5nc5ccccc45)ccc3C2=O)cc1OC InChI=1S/C37H40N2O5/c1-41-33-18-15-25(22-35(33)42-2)21-26-24-44-34-23-27(16-17-30(34)37(26)40)43-20-10-4-3-9-19-38-36-28-11-5-7-13-31(28)39-32-14-8-6-12-29(32)36/h5,7,11,13,15-18,21-23H,3-4,6,8-10,12,14,19-20,24H2,1-2H3,(H,38,39)/b26-21+ VSPGZOQDCVJWLW-YYADALCUSA-N 50443674 CHEMBL3093168 Cholinesterase 35 ChEMBL 10.1016/j.bmc.2013.09.050 10.7270/Q2DV1MCQ 24128814 Sun, Y; Chen, J; Chen, X; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443674 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443674&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72696918 194941570 CHEMBL3093168 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084369 COc1ccccc1\C=C1/COc2cc(OCCCCCCNc3c4CCCCc4nc4ccccc34)ccc2C1=O InChI=1S/C36H38N2O4/c1-40-33-17-9-4-12-25(33)22-26-24-42-34-23-27(18-19-30(34)36(26)39)41-21-11-3-2-10-20-37-35-28-13-5-7-15-31(28)38-32-16-8-6-14-29(32)35/h4-5,7,9,12-13,15,17-19,22-23H,2-3,6,8,10-11,14,16,20-21,24H2,1H3,(H,37,38)/b26-22+ JTRTUJZYMCZUFS-XTCLZLMSSA-N 50443675 CHEMBL3093167 Cholinesterase 30 ChEMBL 10.1016/j.bmc.2013.09.050 10.7270/Q2DV1MCQ 24128814 Sun, Y; Chen, J; Chen, X; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443675 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443675&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72696917 194941571 CHEMBL3093167 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084370 COc1cccc(\C=C2/COc3cc(OCCCCCCNc4c5CCCCc5nc5ccccc45)ccc3C2=O)c1 InChI=1S/C36H38N2O4/c1-40-27-12-10-11-25(22-27)21-26-24-42-34-23-28(17-18-31(34)36(26)39)41-20-9-3-2-8-19-37-35-29-13-4-6-15-32(29)38-33-16-7-5-14-30(33)35/h4,6,10-13,15,17-18,21-23H,2-3,5,7-9,14,16,19-20,24H2,1H3,(H,37,38)/b26-21+ IUDSOGKFUABNFH-YYADALCUSA-N 50443676 CHEMBL3093166 Cholinesterase 47 ChEMBL 10.1016/j.bmc.2013.09.050 10.7270/Q2DV1MCQ 24128814 Sun, Y; Chen, J; Chen, X; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443676 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443676&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72696784 194941572 CHEMBL3093166 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084371 CCN(CC)c1ccc(\C=C2/COc3cc(OCCCCCCNc4c5CCCCc5nc5ccccc45)ccc3C2=O)cc1 InChI=1S/C39H45N3O3/c1-3-42(4-2)30-19-17-28(18-20-30)25-29-27-45-37-26-31(21-22-34(37)39(29)43)44-24-12-6-5-11-23-40-38-32-13-7-9-15-35(32)41-36-16-10-8-14-33(36)38/h7,9,13,15,17-22,25-26H,3-6,8,10-12,14,16,23-24,27H2,1-2H3,(H,40,41)/b29-25+ FJJVJSGECIQSID-XLVZBRSZSA-N 50443677 CHEMBL3093165 Cholinesterase 235 ChEMBL 10.1016/j.bmc.2013.09.050 10.7270/Q2DV1MCQ 24128814 Sun, Y; Chen, J; Chen, X; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443677 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443677&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72696783 194941573 CHEMBL3093165 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084372 Clc1ccc(\C=C2/COc3cc(OCCCCCCNc4c5CCCCc5nc5ccccc45)ccc3C2=O)cc1 InChI=1S/C35H35ClN2O3/c36-26-15-13-24(14-16-26)21-25-23-41-33-22-27(17-18-30(33)35(25)39)40-20-8-2-1-7-19-37-34-28-9-3-5-11-31(28)38-32-12-6-4-10-29(32)34/h3,5,9,11,13-18,21-22H,1-2,4,6-8,10,12,19-20,23H2,(H,37,38)/b25-21+ JQKODBXTRUQWIX-NJNXFGOHSA-N 50443678 CHEMBL3093181 Cholinesterase 45 ChEMBL 10.1016/j.bmc.2013.09.050 10.7270/Q2DV1MCQ 24128814 Sun, Y; Chen, J; Chen, X; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443678 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443678&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72696782 194941574 CHEMBL3093181 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084373 Fc1ccc(\C=C2/COc3cc(OCCCCCCNc4c5CCCCc5nc5ccccc45)ccc3C2=O)cc1 InChI=1S/C35H35FN2O3/c36-26-15-13-24(14-16-26)21-25-23-41-33-22-27(17-18-30(33)35(25)39)40-20-8-2-1-7-19-37-34-28-9-3-5-11-31(28)38-32-12-6-4-10-29(32)34/h3,5,9,11,13-18,21-22H,1-2,4,6-8,10,12,19-20,23H2,(H,37,38)/b25-21+ UEPKIBDCMASFAW-NJNXFGOHSA-N 50443679 CHEMBL3093180 Cholinesterase 44 ChEMBL 10.1016/j.bmc.2013.09.050 10.7270/Q2DV1MCQ 24128814 Sun, Y; Chen, J; Chen, X; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443679 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443679&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72696781 194941575 CHEMBL3093180 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084374 Cc1ccc(\C=C2/COc3cc(OCCCCCCNc4c5CCCCc5nc5ccccc45)ccc3C2=O)cc1 InChI=1S/C36H38N2O3/c1-25-14-16-26(17-15-25)22-27-24-41-34-23-28(18-19-31(34)36(27)39)40-21-9-3-2-8-20-37-35-29-10-4-6-12-32(29)38-33-13-7-5-11-30(33)35/h4,6,10,12,14-19,22-23H,2-3,5,7-9,11,13,20-21,24H2,1H3,(H,37,38)/b27-22+ ACPMTDPDLGKXAK-HPNDGRJYSA-N 50443680 CHEMBL3093179 Cholinesterase 55 ChEMBL 10.1016/j.bmc.2013.09.050 10.7270/Q2DV1MCQ 24128814 Sun, Y; Chen, J; Chen, X; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443680 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443680&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72696780 194941576 CHEMBL3093179 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084375 CN(C)c1ccc(\C=C2/COc3cc(OCCCCCCNc4c5CCCCc5nc5ccccc45)ccc3C2=O)cc1 InChI=1S/C37H41N3O3/c1-40(2)28-17-15-26(16-18-28)23-27-25-43-35-24-29(19-20-32(35)37(27)41)42-22-10-4-3-9-21-38-36-30-11-5-7-13-33(30)39-34-14-8-6-12-31(34)36/h5,7,11,13,15-20,23-24H,3-4,6,8-10,12,14,21-22,25H2,1-2H3,(H,38,39)/b27-23+ RIFNFKMDIZEHMV-SLEBQGDGSA-N 50443681 CHEMBL3093178 Cholinesterase 66 ChEMBL 10.1016/j.bmc.2013.09.050 10.7270/Q2DV1MCQ 24128814 Sun, Y; Chen, J; Chen, X; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443681 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443681&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72696652 194941577 CHEMBL3093178 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084376 COc1ccc(\C=C2/COc3cc(OCCCCCCCCCCNc4c5CCCCc5nc5ccccc45)ccc3C2=O)cc1 InChI=1S/C40H46N2O4/c1-44-31-20-18-29(19-21-31)26-30-28-46-38-27-32(22-23-35(38)40(30)43)45-25-13-7-5-3-2-4-6-12-24-41-39-33-14-8-10-16-36(33)42-37-17-11-9-15-34(37)39/h8,10,14,16,18-23,26-27H,2-7,9,11-13,15,17,24-25,28H2,1H3,(H,41,42)/b30-26+ QEHOEIHANFQPNX-URGPHPNLSA-N 50443682 CHEMBL3093177 Cholinesterase 6.2 ChEMBL 10.1016/j.bmc.2013.09.050 10.7270/Q2DV1MCQ 24128814 Sun, Y; Chen, J; Chen, X; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72696651 194941578 CHEMBL3093177 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084377 COc1ccc(\C=C2/COc3cc(OCCCCCCCCCNc4c5CCCCc5nc5ccccc45)ccc3C2=O)cc1 InChI=1S/C39H44N2O4/c1-43-30-19-17-28(18-20-30)25-29-27-45-37-26-31(21-22-34(37)39(29)42)44-24-12-6-4-2-3-5-11-23-40-38-32-13-7-9-15-35(32)41-36-16-10-8-14-33(36)38/h7,9,13,15,17-22,25-26H,2-6,8,10-12,14,16,23-24,27H2,1H3,(H,40,41)/b29-25+ ADKCNMZUCJXVBJ-XLVZBRSZSA-N 50443683 CHEMBL3093176 Cholinesterase 31 ChEMBL 10.1016/j.bmc.2013.09.050 10.7270/Q2DV1MCQ 24128814 Sun, Y; Chen, J; Chen, X; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443683 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443683&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72696650 194941579 CHEMBL3093176 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084378 COc1ccc(\C=C2/COc3cc(OCCCCCCCCNc4c5CCCCc5nc5ccccc45)ccc3C2=O)cc1 InChI=1S/C38H42N2O4/c1-42-29-18-16-27(17-19-29)24-28-26-44-36-25-30(20-21-33(36)38(28)41)43-23-11-5-3-2-4-10-22-39-37-31-12-6-8-14-34(31)40-35-15-9-7-13-32(35)37/h6,8,12,14,16-21,24-25H,2-5,7,9-11,13,15,22-23,26H2,1H3,(H,39,40)/b28-24+ NJHSCOWKTJHWBT-ZZIIXHQDSA-N 50443684 CHEMBL3093175 Cholinesterase 93 ChEMBL 10.1016/j.bmc.2013.09.050 10.7270/Q2DV1MCQ 24128814 Sun, Y; Chen, J; Chen, X; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443684 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443684&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72696649 194941580 CHEMBL3093175 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084379 COc1ccc(\C=C2/COc3cc(OCCCCCCNc4c5CCCCc5nc5ccccc45)ccc3C2=O)cc1 InChI=1S/C36H38N2O4/c1-40-27-16-14-25(15-17-27)22-26-24-42-34-23-28(18-19-31(34)36(26)39)41-21-9-3-2-8-20-37-35-29-10-4-6-12-32(29)38-33-13-7-5-11-30(33)35/h4,6,10,12,14-19,22-23H,2-3,5,7-9,11,13,20-21,24H2,1H3,(H,37,38)/b26-22+ CBIYVBDPTVOIOY-XTCLZLMSSA-N 50443685 CHEMBL3093174 Cholinesterase 33 ChEMBL 10.1016/j.bmc.2013.09.050 10.7270/Q2DV1MCQ 24128814 Sun, Y; Chen, J; Chen, X; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443685 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443685&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72696519 194941581 CHEMBL3093174 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084380 COc1ccc(\C=C2/COc3cc(OCCCCCNc4c5CCCCc5nc5ccccc45)ccc3C2=O)cc1 InChI=1S/C35H36N2O4/c1-39-26-15-13-24(14-16-26)21-25-23-41-33-22-27(17-18-30(33)35(25)38)40-20-8-2-7-19-36-34-28-9-3-5-11-31(28)37-32-12-6-4-10-29(32)34/h3,5,9,11,13-18,21-22H,2,4,6-8,10,12,19-20,23H2,1H3,(H,36,37)/b25-21+ SKUMQRLMZICTHQ-NJNXFGOHSA-N 50443686 CHEMBL3093173 Cholinesterase 24 ChEMBL 10.1016/j.bmc.2013.09.050 10.7270/Q2DV1MCQ 24128814 Sun, Y; Chen, J; Chen, X; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443686 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443686&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72696518 194941582 CHEMBL3093173 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084411 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 47 ChEMBL 10.1016/j.bmc.2013.09.061 10.7270/Q25B03ZD 24148835 Luo, W; Su, YB; Hong, C; Tian, RG; Su, LP; Wang, YQ; Li, Y; Yue, JJ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084412 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 10620 (S)-3-(1-(dimethylamino)ethyl)phenyl ethyl(methyl)carbamate::3-((1S)-1-(Dimethylamino)ethyl)phenyl N-ethyl N-methyl carbamate::3-(1-(dimethylamino)ethyl)phenyl ethyl(methyl)carbamate::3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::CHEMBL636::ENA-713::Ethyl-methyl-carbamic acid 3-((R)-1-dimethylamino-ethyl)-phenyl ester::Ethyl-methyl-carbamic acid 3-((S)-1-dimethylamino-ethyl)-phenyl ester::Ethyl-methyl-carbamic acid 3-(1-dimethylamino-ethyl)-phenyl ester::Exelon::Rivastigmine::Rivastigmine (1)::SDZ-212-713::SDZ-ENA-713 Cholinesterase 1710 ChEMBL 10.1016/j.bmc.2013.09.061 10.7270/Q25B03ZD 24148835 Luo, W; Su, YB; Hong, C; Tian, RG; Su, LP; Wang, YQ; Li, Y; Yue, JJ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10620 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10620&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46511221 8874 CHEMBL636 DB00989 6602 C11766 ZINC00004413 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084413 CN(CCCCCCCCCCCCOc1ccc2c(c1)oc(cc2=O)-c1ccc(cc1)N(C)C)Cc1ccccc1 InChI=1S/C37H48N2O3/c1-38(2)32-21-19-31(20-22-32)36-28-35(40)34-24-23-33(27-37(34)42-36)41-26-16-11-9-7-5-4-6-8-10-15-25-39(3)29-30-17-13-12-14-18-30/h12-14,17-24,27-28H,4-11,15-16,25-26,29H2,1-3H3 UNXUBWQEVXWNCW-UHFFFAOYSA-N 50443693 CHEMBL3093845 Cholinesterase >50000 ChEMBL 10.1016/j.bmc.2013.09.061 10.7270/Q25B03ZD 24148835 Luo, W; Su, YB; Hong, C; Tian, RG; Su, LP; Wang, YQ; Li, Y; Yue, JJ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443693 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443693&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72697624 194941589 CHEMBL3093845 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084414 CN(CCCCCCCCCCOc1ccc2c(c1)oc(cc2=O)-c1ccc(cc1)N(C)C)Cc1ccccc1 InChI=1S/C35H44N2O3/c1-36(2)30-19-17-29(18-20-30)34-26-33(38)32-22-21-31(25-35(32)40-34)39-24-14-9-7-5-4-6-8-13-23-37(3)27-28-15-11-10-12-16-28/h10-12,15-22,25-26H,4-9,13-14,23-24,27H2,1-3H3 NTMNIVKKJBSBFN-UHFFFAOYSA-N 50443694 CHEMBL3093844 Cholinesterase >50000 ChEMBL 10.1016/j.bmc.2013.09.061 10.7270/Q25B03ZD 24148835 Luo, W; Su, YB; Hong, C; Tian, RG; Su, LP; Wang, YQ; Li, Y; Yue, JJ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443694 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443694&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72697480 194941590 CHEMBL3093844 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084415 CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCCCCCCCCCCN3CCCCC3)cc2o1 InChI=1S/C32H44N2O3/c1-33(2)27-16-14-26(15-17-27)31-25-30(35)29-19-18-28(24-32(29)37-31)36-23-13-8-6-4-3-5-7-10-20-34-21-11-9-12-22-34/h14-19,24-25H,3-13,20-23H2,1-2H3 JPZMMIMCBUXAEK-UHFFFAOYSA-N 50443695 CHEMBL3093843 Cholinesterase 2420 ChEMBL 10.1016/j.bmc.2013.09.061 10.7270/Q25B03ZD 24148835 Luo, W; Su, YB; Hong, C; Tian, RG; Su, LP; Wang, YQ; Li, Y; Yue, JJ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443695 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443695&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72697479 194941591 CHEMBL3093843 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084416 CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCCCCCCCCCCN3CCCC3)cc2o1 InChI=1S/C31H42N2O3/c1-32(2)26-15-13-25(14-16-26)30-24-29(34)28-18-17-27(23-31(28)36-30)35-22-12-8-6-4-3-5-7-9-19-33-20-10-11-21-33/h13-18,23-24H,3-12,19-22H2,1-2H3 IBUNNFOLIZJCPD-UHFFFAOYSA-N 50443696 CHEMBL3093842 Cholinesterase 820 ChEMBL 10.1016/j.bmc.2013.09.061 10.7270/Q25B03ZD 24148835 Luo, W; Su, YB; Hong, C; Tian, RG; Su, LP; Wang, YQ; Li, Y; Yue, JJ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443696 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443696&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72697478 194941592 CHEMBL3093842 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084417 CCN(CC)CCCCCCCCCCOc1ccc2c(c1)oc(cc2=O)-c1ccc(cc1)N(C)C InChI=1S/C31H44N2O3/c1-5-33(6-2)21-13-11-9-7-8-10-12-14-22-35-27-19-20-28-29(34)24-30(36-31(28)23-27)25-15-17-26(18-16-25)32(3)4/h15-20,23-24H,5-14,21-22H2,1-4H3 URYRRVOYTJPNPT-UHFFFAOYSA-N 50443697 CHEMBL3093841 Cholinesterase 2310 ChEMBL 10.1016/j.bmc.2013.09.061 10.7270/Q25B03ZD 24148835 Luo, W; Su, YB; Hong, C; Tian, RG; Su, LP; Wang, YQ; Li, Y; Yue, JJ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443697 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443697&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72697477 194941593 CHEMBL3093841 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084418 CN(CCCCCCCCOc1ccc2c(c1)oc(cc2=O)-c1ccc(cc1)N(C)C)Cc1ccccc1 InChI=1S/C33H40N2O3/c1-34(2)28-17-15-27(16-18-28)32-24-31(36)30-20-19-29(23-33(30)38-32)37-22-12-7-5-4-6-11-21-35(3)25-26-13-9-8-10-14-26/h8-10,13-20,23-24H,4-7,11-12,21-22,25H2,1-3H3 AKWAHKJJXBYPRC-UHFFFAOYSA-N 50443698 CHEMBL3093840 Cholinesterase >50000 ChEMBL 10.1016/j.bmc.2013.09.061 10.7270/Q25B03ZD 24148835 Luo, W; Su, YB; Hong, C; Tian, RG; Su, LP; Wang, YQ; Li, Y; Yue, JJ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443698 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443698&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72697476 194941594 CHEMBL3093840 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084419 CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCCC3)cc2o1 InChI=1S/C30H40N2O3/c1-31(2)25-14-12-24(13-15-25)29-23-28(33)27-17-16-26(22-30(27)35-29)34-21-11-6-4-3-5-8-18-32-19-9-7-10-20-32/h12-17,22-23H,3-11,18-21H2,1-2H3 QIVKRGJBFSDWRA-UHFFFAOYSA-N 50443699 CHEMBL3093839 Cholinesterase 8720 ChEMBL 10.1016/j.bmc.2013.09.061 10.7270/Q25B03ZD 24148835 Luo, W; Su, YB; Hong, C; Tian, RG; Su, LP; Wang, YQ; Li, Y; Yue, JJ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443699 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443699&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72697338 194941595 CHEMBL3093839 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084420 CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 InChI=1S/C29H38N2O3/c1-30(2)24-13-11-23(12-14-24)28-22-27(32)26-16-15-25(21-29(26)34-28)33-20-10-6-4-3-5-7-17-31-18-8-9-19-31/h11-16,21-22H,3-10,17-20H2,1-2H3 ATBSSXJNHBMRPD-UHFFFAOYSA-N 50443700 CHEMBL3093838 Cholinesterase 2600 ChEMBL 10.1016/j.bmc.2013.09.061 10.7270/Q25B03ZD 24148835 Luo, W; Su, YB; Hong, C; Tian, RG; Su, LP; Wang, YQ; Li, Y; Yue, JJ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443700 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443700&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72697337 194941596 CHEMBL3093838 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084421 CCN(CC)CCCCCCCCOc1ccc2c(c1)oc(cc2=O)-c1ccc(cc1)N(C)C InChI=1S/C29H40N2O3/c1-5-31(6-2)19-11-9-7-8-10-12-20-33-25-17-18-26-27(32)22-28(34-29(26)21-25)23-13-15-24(16-14-23)30(3)4/h13-18,21-22H,5-12,19-20H2,1-4H3 HOZXGWJSHHLESU-UHFFFAOYSA-N 50443692 CHEMBL3093837 Cholinesterase 5010 ChEMBL 10.1016/j.bmc.2013.09.061 10.7270/Q25B03ZD 24148835 Luo, W; Su, YB; Hong, C; Tian, RG; Su, LP; Wang, YQ; Li, Y; Yue, JJ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443692 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443692&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72697336 194941588 CHEMBL3093837 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084422 CN(CCCCCCOc1ccc2c(c1)oc(cc2=O)-c1ccc(cc1)N(C)C)Cc1ccccc1 InChI=1S/C31H36N2O3/c1-32(2)26-15-13-25(14-16-26)30-22-29(34)28-18-17-27(21-31(28)36-30)35-20-10-5-4-9-19-33(3)23-24-11-7-6-8-12-24/h6-8,11-18,21-22H,4-5,9-10,19-20,23H2,1-3H3 QNXXAEIGCVGQQR-UHFFFAOYSA-N 50443701 CHEMBL3093836 Cholinesterase >50000 ChEMBL 10.1016/j.bmc.2013.09.061 10.7270/Q25B03ZD 24148835 Luo, W; Su, YB; Hong, C; Tian, RG; Su, LP; Wang, YQ; Li, Y; Yue, JJ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443701 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443701&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72697335 194941597 CHEMBL3093836 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084423 CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCCCCCCN3CCCCC3)cc2o1 InChI=1S/C28H36N2O3/c1-29(2)23-12-10-22(11-13-23)27-21-26(31)25-15-14-24(20-28(25)33-27)32-19-9-4-3-6-16-30-17-7-5-8-18-30/h10-15,20-21H,3-9,16-19H2,1-2H3 XUFFCGINMSMQSJ-UHFFFAOYSA-N 50443702 CHEMBL3093835 Cholinesterase 5520 ChEMBL 10.1016/j.bmc.2013.09.061 10.7270/Q25B03ZD 24148835 Luo, W; Su, YB; Hong, C; Tian, RG; Su, LP; Wang, YQ; Li, Y; Yue, JJ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443702 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443702&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72697334 194941598 CHEMBL3093835 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084424 CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCCCCCCN3CCCC3)cc2o1 InChI=1S/C27H34N2O3/c1-28(2)22-11-9-21(10-12-22)26-20-25(30)24-14-13-23(19-27(24)32-26)31-18-8-4-3-5-15-29-16-6-7-17-29/h9-14,19-20H,3-8,15-18H2,1-2H3 KUMRYAIRJQQBFJ-UHFFFAOYSA-N 50443703 CHEMBL3093834 Cholinesterase 11450 ChEMBL 10.1016/j.bmc.2013.09.061 10.7270/Q25B03ZD 24148835 Luo, W; Su, YB; Hong, C; Tian, RG; Su, LP; Wang, YQ; Li, Y; Yue, JJ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443703 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443703&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72697333 194941599 CHEMBL3093834 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084425 CCN(CC)CCCCCCOc1ccc2c(c1)oc(cc2=O)-c1ccc(cc1)N(C)C InChI=1S/C27H36N2O3/c1-5-29(6-2)17-9-7-8-10-18-31-23-15-16-24-25(30)20-26(32-27(24)19-23)21-11-13-22(14-12-21)28(3)4/h11-16,19-20H,5-10,17-18H2,1-4H3 XYEFSCRPUDIHNA-UHFFFAOYSA-N 50443704 CHEMBL3093833 Cholinesterase 4610 ChEMBL 10.1016/j.bmc.2013.09.061 10.7270/Q25B03ZD 24148835 Luo, W; Su, YB; Hong, C; Tian, RG; Su, LP; Wang, YQ; Li, Y; Yue, JJ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443704 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443704&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72697194 194941600 CHEMBL3093833 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084426 CN(CCCCOc1ccc2c(c1)oc(cc2=O)-c1ccc(cc1)N(C)C)Cc1ccccc1 InChI=1S/C29H32N2O3/c1-30(2)24-13-11-23(12-14-24)28-20-27(32)26-16-15-25(19-29(26)34-28)33-18-8-7-17-31(3)21-22-9-5-4-6-10-22/h4-6,9-16,19-20H,7-8,17-18,21H2,1-3H3 AQXHNJKXLYVXMT-UHFFFAOYSA-N 50443705 CHEMBL3093832 Cholinesterase >50000 ChEMBL 10.1016/j.bmc.2013.09.061 10.7270/Q25B03ZD 24148835 Luo, W; Su, YB; Hong, C; Tian, RG; Su, LP; Wang, YQ; Li, Y; Yue, JJ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443705 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443705&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72697193 194941601 CHEMBL3093832 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084427 CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCCCCN3CCOCC3)cc2o1 InChI=1S/C25H30N2O4/c1-26(2)20-7-5-19(6-8-20)24-18-23(28)22-10-9-21(17-25(22)31-24)30-14-4-3-11-27-12-15-29-16-13-27/h5-10,17-18H,3-4,11-16H2,1-2H3 BYOLJIIINISJDP-UHFFFAOYSA-N 50443706 CHEMBL3093831 Cholinesterase 10100 ChEMBL 10.1016/j.bmc.2013.09.061 10.7270/Q25B03ZD 24148835 Luo, W; Su, YB; Hong, C; Tian, RG; Su, LP; Wang, YQ; Li, Y; Yue, JJ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443706 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443706&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72697192 194941602 CHEMBL3093831 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084428 CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCCCCN3CCCCC3)cc2o1 InChI=1S/C26H32N2O3/c1-27(2)21-10-8-20(9-11-21)25-19-24(29)23-13-12-22(18-26(23)31-25)30-17-7-6-16-28-14-4-3-5-15-28/h8-13,18-19H,3-7,14-17H2,1-2H3 ZCSQHWMSYZNFAX-UHFFFAOYSA-N 50443707 CHEMBL3093830 Cholinesterase 6120 ChEMBL 10.1016/j.bmc.2013.09.061 10.7270/Q25B03ZD 24148835 Luo, W; Su, YB; Hong, C; Tian, RG; Su, LP; Wang, YQ; Li, Y; Yue, JJ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443707 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443707&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72697191 194941603 CHEMBL3093830 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084429 CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCCCCN3CCCC3)cc2o1 InChI=1S/C25H30N2O3/c1-26(2)20-9-7-19(8-10-20)24-18-23(28)22-12-11-21(17-25(22)30-24)29-16-6-5-15-27-13-3-4-14-27/h7-12,17-18H,3-6,13-16H2,1-2H3 TYPAQONCWDRORA-UHFFFAOYSA-N 50443708 CHEMBL3093847 Cholinesterase 6140 ChEMBL 10.1016/j.bmc.2013.09.061 10.7270/Q25B03ZD 24148835 Luo, W; Su, YB; Hong, C; Tian, RG; Su, LP; Wang, YQ; Li, Y; Yue, JJ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443708 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443708&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72697190 194941604 CHEMBL3093847 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51084430 CCN(CC)CCCCOc1ccc2c(c1)oc(cc2=O)-c1ccc(cc1)N(C)C InChI=1S/C25H32N2O3/c1-5-27(6-2)15-7-8-16-29-21-13-14-22-23(28)18-24(30-25(22)17-21)19-9-11-20(12-10-19)26(3)4/h9-14,17-18H,5-8,15-16H2,1-4H3 JVOIGPRZOONFAU-UHFFFAOYSA-N 50443709 CHEMBL3093846 Cholinesterase 7880 ChEMBL 10.1016/j.bmc.2013.09.061 10.7270/Q25B03ZD 24148835 Luo, W; Su, YB; Hong, C; Tian, RG; Su, LP; Wang, YQ; Li, Y; Yue, JJ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443709 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443709&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72697189 194941605 CHEMBL3093846 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088576 Cc1ccc(\C=C2/CNCC3C2NC(=S)NC3c2ccc(C)cc2)cc1 InChI=1S/C22H25N3S/c1-14-3-7-16(8-4-14)11-18-12-23-13-19-20(24-22(26)25-21(18)19)17-9-5-15(2)6-10-17/h3-11,19-21,23H,12-13H2,1-2H3,(H2,24,25,26)/b18-11+ YQCQZYAJJOSYON-WOJGMQOQSA-N 50445692 CHEMBL3104449 Cholinesterase 6270 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445692 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445692&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76310151 194943588 CHEMBL3104449 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088577 COc1ccccc1\C=C1/CNCC2C1NC(=S)NC2c1ccccc1OC InChI=1S/C22H25N3O2S/c1-26-18-9-5-3-7-14(18)11-15-12-23-13-17-20(15)24-22(28)25-21(17)16-8-4-6-10-19(16)27-2/h3-11,17,20-21,23H,12-13H2,1-2H3,(H2,24,25,28)/b15-11+ LWWIMYKKFBLYLV-RVDMUPIBSA-N 50445693 CHEMBL3104448 Cholinesterase 1180 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445693 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445693&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76324748 194943589 CHEMBL3104448 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088578 Clc1ccccc1\C=C1/CNCC2C1NC(=S)NC2c1ccccc1Cl InChI=1S/C20H19Cl2N3S/c21-16-7-3-1-5-12(16)9-13-10-23-11-15-18(13)24-20(26)25-19(15)14-6-2-4-8-17(14)22/h1-9,15,18-19,23H,10-11H2,(H2,24,25,26)/b13-9+ ULTQRBSNPGXDHC-UKTHLTGXSA-N 50445694 CHEMBL3104447 Cholinesterase 2910 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445694 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445694&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76321097 194943590 CHEMBL3104447 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088579 S=C1NC2C(CNC\C2=C/c2ccccc2)C(N1)c1ccccc1 InChI=1S/C20H21N3S/c24-20-22-18(15-9-5-2-6-10-15)17-13-21-12-16(19(17)23-20)11-14-7-3-1-4-8-14/h1-11,17-19,21H,12-13H2,(H2,22,23,24)/b16-11+ NASWNKJUEZDISD-LFIBNONCSA-N 50445695 CHEMBL3104446 Cholinesterase 3780 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445695 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445695&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76310150 194943591 CHEMBL3104446 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088580 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 19340 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088581 COc1ccc(cc1)C1=CSC2=NC3=C(CNC\C3=C/c3ccc(F)cc3)C(N12)c1ccc(F)cc1 InChI=1S/C29H23F2N3OS/c1-35-24-12-6-19(7-13-24)26-17-36-29-33-27-21(14-18-2-8-22(30)9-3-18)15-32-16-25(27)28(34(26)29)20-4-10-23(31)11-5-20/h2-14,17,28,32H,15-16H2,1H3/b21-14+ KBZWOXRTKNUZMO-KGENOOAVSA-N 50445696 CHEMBL3104336 Cholinesterase 26550 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445696 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445696&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73333595 194943592 CHEMBL3104336 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088582 COc1ccc(cc1)C1=CSC2=NC3=C(CNC\C3=C/c3ccc(Cl)cc3)C(N12)c1ccc(Cl)cc1 InChI=1S/C29H23Cl2N3OS/c1-35-24-12-6-19(7-13-24)26-17-36-29-33-27-21(14-18-2-8-22(30)9-3-18)15-32-16-25(27)28(34(26)29)20-4-10-23(31)11-5-20/h2-14,17,28,32H,15-16H2,1H3/b21-14+ BJTJWSNHVLJIJI-KGENOOAVSA-N 50445697 CHEMBL3104335 Cholinesterase 12790 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445697 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445697&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73333594 194943593 CHEMBL3104335 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088583 COc1ccc(cc1)C1=CSC2=NC3=C(CNC\C3=C/c3ccc(C)cc3)C(N12)c1ccc(C)cc1 InChI=1S/C31H29N3OS/c1-20-4-8-22(9-5-20)16-25-17-32-18-27-29(25)33-31-34(30(27)24-10-6-21(2)7-11-24)28(19-36-31)23-12-14-26(35-3)15-13-23/h4-16,19,30,32H,17-18H2,1-3H3/b25-16+ CTVNTPIFRHFOFR-PCLIKHOPSA-N 50445698 CHEMBL3104334 Cholinesterase 10480 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445698 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445698&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73333593 194943594 CHEMBL3104334 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088584 COc1ccc(cc1)C1=CSC2=NC3=C(CNC\C3=C/c3ccccc3OC)C(N12)c1ccccc1OC InChI=1S/C31H29N3O3S/c1-35-23-14-12-20(13-15-23)26-19-38-31-33-29-22(16-21-8-4-6-10-27(21)36-2)17-32-18-25(29)30(34(26)31)24-9-5-7-11-28(24)37-3/h4-16,19,30,32H,17-18H2,1-3H3/b22-16+ FPOSITSESXWBAH-CJLVFECKSA-N 50445699 CHEMBL3104333 Cholinesterase 18560 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445699 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445699&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73333501 194943595 CHEMBL3104333 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088585 COc1ccc(cc1)C1=CSC2=NC3=C(CNC\C3=C/c3ccccc3Cl)C(N12)c1ccccc1Cl InChI=1S/C29H23Cl2N3OS/c1-35-21-12-10-18(11-13-21)26-17-36-29-33-27-20(14-19-6-2-4-8-24(19)30)15-32-16-23(27)28(34(26)29)22-7-3-5-9-25(22)31/h2-14,17,28,32H,15-16H2,1H3/b20-14+ SXNBYFCNJKLKND-XSFVSMFZSA-N 50445700 CHEMBL3104332 Cholinesterase 12560 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445700 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445700&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73333500 194943596 CHEMBL3104332 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088586 COc1ccc(cc1)C1=CSC2=NC3=C(CNC\C3=C/c3ccccc3)C(N12)c1ccccc1 InChI=1S/C29H25N3OS/c1-33-24-14-12-21(13-15-24)26-19-34-29-31-27-23(16-20-8-4-2-5-9-20)17-30-18-25(27)28(32(26)29)22-10-6-3-7-11-22/h2-16,19,28,30H,17-18H2,1H3/b23-16+ LESNVGHCGIMYEU-XQNSMLJCSA-N 50445701 CHEMBL3104331 Cholinesterase 10410 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445701 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445701&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73333499 194943597 CHEMBL3104331 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088587 Fc1ccc(\C=C2/CNCC3=C2N=C2SC=C(N2C3c2ccc(F)cc2)c2ccc(Cl)cc2)cc1 InChI=1S/C28H20ClF2N3S/c29-21-7-3-18(4-8-21)25-16-35-28-33-26-20(13-17-1-9-22(30)10-2-17)14-32-15-24(26)27(34(25)28)19-5-11-23(31)12-6-19/h1-13,16,27,32H,14-15H2/b20-13+ OHKCOQGAJDGEIC-DEDYPNTBSA-N 50445702 CHEMBL3104330 Cholinesterase 22240 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445702 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445702&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73333498 194943598 CHEMBL3104330 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088588 Clc1ccc(\C=C2/CNCC3=C2N=C2SC=C(N2C3c2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1 InChI=1S/C28H20Cl3N3S/c29-21-7-1-17(2-8-21)13-20-14-32-15-24-26(20)33-28-34(27(24)19-5-11-23(31)12-6-19)25(16-35-28)18-3-9-22(30)10-4-18/h1-13,16,27,32H,14-15H2/b20-13+ LZGQSXPHQTXUGY-DEDYPNTBSA-N 50445703 CHEMBL3104329 Cholinesterase 27430 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445703 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445703&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73333497 194943599 CHEMBL3104329 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088589 Cc1ccc(\C=C2/CNCC3=C2N=C2SC=C(N2C3c2ccc(C)cc2)c2ccc(Cl)cc2)cc1 InChI=1S/C30H26ClN3S/c1-19-3-7-21(8-4-19)15-24-16-32-17-26-28(24)33-30-34(29(26)23-9-5-20(2)6-10-23)27(18-35-30)22-11-13-25(31)14-12-22/h3-15,18,29,32H,16-17H2,1-2H3/b24-15+ UTUXRMJRHAGSCT-BUVRLJJBSA-N 50445704 CHEMBL3104328 Cholinesterase 32560 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445704 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445704&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73333409 194943600 CHEMBL3104328 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088590 COc1ccccc1\C=C1/CNCC2=C1N=C1SC=C(N1C2c1ccccc1OC)c1ccc(Cl)cc1 InChI=1S/C30H26ClN3O2S/c1-35-26-9-5-3-7-20(26)15-21-16-32-17-24-28(21)33-30-34(29(24)23-8-4-6-10-27(23)36-2)25(18-37-30)19-11-13-22(31)14-12-19/h3-15,18,29,32H,16-17H2,1-2H3/b21-15+ AVUVBKGKDCOGSY-RCCKNPSSSA-N 50445705 CHEMBL3104327 Cholinesterase 29280 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445705 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445705&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73333408 194943601 CHEMBL3104327 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088591 Clc1ccc(cc1)C1=CSC2=NC3=C(CNC\C3=C/c3ccccc3Cl)C(N12)c1ccccc1Cl InChI=1S/C28H20Cl3N3S/c29-20-11-9-17(10-12-20)25-16-35-28-33-26-19(13-18-5-1-3-7-23(18)30)14-32-15-22(26)27(34(25)28)21-6-2-4-8-24(21)31/h1-13,16,27,32H,14-15H2/b19-13+ WCDYIAVPTZFADG-CPNJWEJPSA-N 50445706 CHEMBL3104326 Cholinesterase 7650 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445706 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445706&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73333407 194943602 CHEMBL3104326 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088592 Clc1ccc(cc1)C1=CSC2=NC3=C(CNC\C3=C/c3ccccc3)C(N12)c1ccccc1 InChI=1S/C28H22ClN3S/c29-23-13-11-20(12-14-23)25-18-33-28-31-26-22(15-19-7-3-1-4-8-19)16-30-17-24(26)27(32(25)28)21-9-5-2-6-10-21/h1-15,18,27,30H,16-17H2/b22-15+ NTZLPLZBYOMXSP-PXLXIMEGSA-N 50445707 CHEMBL3104325 Cholinesterase 44340 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445707 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445707&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73333406 194943603 CHEMBL3104325 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088593 Fc1ccc(\C=C2/CNCC3=C2N=C2SC=C(N2C3c2ccc(F)cc2)c2ccc(F)cc2)cc1 InChI=1S/C28H20F3N3S/c29-21-7-1-17(2-8-21)13-20-14-32-15-24-26(20)33-28-34(27(24)19-5-11-23(31)12-6-19)25(16-35-28)18-3-9-22(30)10-4-18/h1-13,16,27,32H,14-15H2/b20-13+ AJCILFHONNNLGQ-DEDYPNTBSA-N 50445708 CHEMBL3104324 Cholinesterase 15770 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445708 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445708&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73333405 194943604 CHEMBL3104324 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088594 Fc1ccc(cc1)C1=CSC2=NC3=C(CNC\C3=C/c3ccc(Cl)cc3)C(N12)c1ccc(Cl)cc1 InChI=1S/C28H20Cl2FN3S/c29-21-7-1-17(2-8-21)13-20-14-32-15-24-26(20)33-28-34(27(24)19-3-9-22(30)10-4-19)25(16-35-28)18-5-11-23(31)12-6-18/h1-13,16,27,32H,14-15H2/b20-13+ BRZGSSIWSSYQOZ-DEDYPNTBSA-N 50445709 CHEMBL3104323 Cholinesterase 15800 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445709 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445709&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73333305 194943605 CHEMBL3104323 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088595 Cc1ccc(\C=C2/CNCC3=C2N=C2SC=C(N2C3c2ccc(C)cc2)c2ccc(F)cc2)cc1 InChI=1S/C30H26FN3S/c1-19-3-7-21(8-4-19)15-24-16-32-17-26-28(24)33-30-34(29(26)23-9-5-20(2)6-10-23)27(18-35-30)22-11-13-25(31)14-12-22/h3-15,18,29,32H,16-17H2,1-2H3/b24-15+ YFUMPZIUDXZOGA-BUVRLJJBSA-N 50445710 CHEMBL3104322 Cholinesterase 4910 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445710 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445710&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73333304 194943606 CHEMBL3104322 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088596 COc1ccccc1\C=C1/CNCC2=C1N=C1SC=C(N1C2c1ccccc1OC)c1ccc(F)cc1 InChI=1S/C30H26FN3O2S/c1-35-26-9-5-3-7-20(26)15-21-16-32-17-24-28(21)33-30-34(29(24)23-8-4-6-10-27(23)36-2)25(18-37-30)19-11-13-22(31)14-12-19/h3-15,18,29,32H,16-17H2,1-2H3/b21-15+ FVKWBAHPUAWUCW-RCCKNPSSSA-N 50445711 CHEMBL3104321 Cholinesterase 8750 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445711 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445711&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73333303 194943607 CHEMBL3104321 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088597 Fc1ccc(cc1)C1=CSC2=NC3=C(CNC\C3=C/c3ccccc3Cl)C(N12)c1ccccc1Cl InChI=1S/C28H20Cl2FN3S/c29-23-7-3-1-5-18(23)13-19-14-32-15-22-26(19)33-28-34(27(22)21-6-2-4-8-24(21)30)25(16-35-28)17-9-11-20(31)12-10-17/h1-13,16,27,32H,14-15H2/b19-13+ MEIKWAUCZKJDPF-CPNJWEJPSA-N 50445712 CHEMBL3104320 Cholinesterase 4630 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445712 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445712&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73333302 194943608 CHEMBL3104320 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088598 Fc1ccc(cc1)C1=CSC2=NC3=C(CNC\C3=C/c3ccccc3)C(N12)c1ccccc1 InChI=1S/C28H22FN3S/c29-23-13-11-20(12-14-23)25-18-33-28-31-26-22(15-19-7-3-1-4-8-19)16-30-17-24(26)27(32(25)28)21-9-5-2-6-10-21/h1-15,18,27,30H,16-17H2/b22-15+ YAFDVLXBQSRALV-PXLXIMEGSA-N 50445713 CHEMBL3102873 Cholinesterase 7910 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445713 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445713&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73333301 194943609 CHEMBL3102873 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088599 Fc1ccc(\C=C2/CNCC3=C2N=C2SC=C(N2C3c2ccc(F)cc2)c2ccccc2)cc1 InChI=1S/C28H21F2N3S/c29-22-10-6-18(7-11-22)14-21-15-31-16-24-26(21)32-28-33(27(24)20-8-12-23(30)13-9-20)25(17-34-28)19-4-2-1-3-5-19/h1-14,17,27,31H,15-16H2/b21-14+ OHNVVKMOCYXIGD-KGENOOAVSA-N 50445714 CHEMBL3104319 Cholinesterase 3950 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445714 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445714&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73333206 194943610 CHEMBL3104319 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088600 Clc1ccc(\C=C2/CNCC3=C2N=C2SC=C(N2C3c2ccc(Cl)cc2)c2ccccc2)cc1 InChI=1S/C28H21Cl2N3S/c29-22-10-6-18(7-11-22)14-21-15-31-16-24-26(21)32-28-33(27(24)20-8-12-23(30)13-9-20)25(17-34-28)19-4-2-1-3-5-19/h1-14,17,27,31H,15-16H2/b21-14+ ZEIFJJKBAHPYGV-KGENOOAVSA-N 50445715 CHEMBL3104318 Cholinesterase 2180 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445715 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445715&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73333205 194943611 CHEMBL3104318 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088601 Cc1ccc(\C=C2/CNCC3=C2N=C2SC=C(N2C3c2ccc(C)cc2)c2ccccc2)cc1 InChI=1S/C30H27N3S/c1-20-8-12-22(13-9-20)16-25-17-31-18-26-28(25)32-30-33(29(26)24-14-10-21(2)11-15-24)27(19-34-30)23-6-4-3-5-7-23/h3-16,19,29,31H,17-18H2,1-2H3/b25-16+ KGZWOOTZJBDGCI-PCLIKHOPSA-N 50445716 CHEMBL3104317 Cholinesterase 1710 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445716 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445716&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73333204 194943612 CHEMBL3104317 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088602 COc1ccccc1\C=C1/CNCC2=C1N=C1SC=C(N1C2c1ccccc1OC)c1ccccc1 InChI=1S/C30H27N3O2S/c1-34-26-14-8-6-12-21(26)16-22-17-31-18-24-28(22)32-30-33(25(19-36-30)20-10-4-3-5-11-20)29(24)23-13-7-9-15-27(23)35-2/h3-16,19,29,31H,17-18H2,1-2H3/b22-16+ UVPDOOCKENGVQL-CJLVFECKSA-N 50445717 CHEMBL3104454 Cholinesterase 4100 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445717 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445717&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73333203 194943613 CHEMBL3104454 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088603 Clc1ccccc1\C=C1/CNCC2=C1N=C1SC=C(N1C2c1ccccc1Cl)c1ccccc1 InChI=1S/C28H21Cl2N3S/c29-23-12-6-4-10-19(23)14-20-15-31-16-22-26(20)32-28-33(27(22)21-11-5-7-13-24(21)30)25(17-34-28)18-8-2-1-3-9-18/h1-14,17,27,31H,15-16H2/b20-14+ OHPJBWPFNZCIEX-XSFVSMFZSA-N 50445718 CHEMBL3104453 Cholinesterase 2680 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445718 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445718&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73333202 194943614 CHEMBL3104453 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088604 C1NCC2=C(N=C3SC=C(N3C2c2ccccc2)c2ccccc2)\C1=C\c1ccccc1 InChI=1S/C28H23N3S/c1-4-10-20(11-5-1)16-23-17-29-18-24-26(23)30-28-31(27(24)22-14-8-3-9-15-22)25(19-32-28)21-12-6-2-7-13-21/h1-16,19,27,29H,17-18H2/b23-16+ GHLUFKQBBJSVCU-XQNSMLJCSA-N 50445719 CHEMBL3104452 Cholinesterase 1740 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445719 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445719&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73333103 194943615 CHEMBL3104452 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088636 Fc1ccc(\C=C2/CNCC3C2NC(=S)NC3c2ccc(F)cc2)cc1 InChI=1S/C20H19F2N3S/c21-15-5-1-12(2-6-15)9-14-10-23-11-17-18(24-20(26)25-19(14)17)13-3-7-16(22)8-4-13/h1-9,17-19,23H,10-11H2,(H2,24,25,26)/b14-9+ JBCXXGLQQIFZNP-NTEUORMPSA-N 50445720 CHEMBL3104451 Cholinesterase 28820 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445720 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445720&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76324749 194943616 CHEMBL3104451 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51088637 Clc1ccc(\C=C2/CNCC3C2NC(=S)NC3c2ccc(Cl)cc2)cc1 InChI=1S/C20H19Cl2N3S/c21-15-5-1-12(2-6-15)9-14-10-23-11-17-18(24-20(26)25-19(14)17)13-3-7-16(22)8-4-13/h1-9,17-19,23H,10-11H2,(H2,24,25,26)/b14-9+ PZPVJFQTDWDACU-NTEUORMPSA-N 50445721 CHEMBL3104450 Cholinesterase 6260 ChEMBL 10.1016/j.bmc.2013.11.020 10.7270/Q23R0VBZ 24369842 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Hooda, A; Parsons, RB Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50445721 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50445721&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76317378 194943617 CHEMBL3104450 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083548 COc1cc2CCN(C)[C@H]3[C@H]4O\C(=C/C[C@H](O)C[C@H]4O)c(c1OC)c23 InChI=1S/C19H25NO5/c1-20-7-6-10-8-14(23-2)19(24-3)16-13-5-4-11(21)9-12(22)18(25-13)17(20)15(10)16/h5,8,11-12,17-18,21-22H,4,6-7,9H2,1-3H3/b13-5-/t11-,12+,17+,18-/m0/s1 OLOHLLRDMVSIEU-LOGUPIHKSA-N 50443326 CHEMBL3085884 Cholinesterase 13400 ChEMBL 10.1016/j.ejmech.2013.09.050 10.7270/Q2PG1T56 24148993 Singh, M; Kaur, M; Kukreja, H; Chugh, R; Silakari, O; Singh, D Punjabi University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443326 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443326&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76331592 194941222 CHEMBL3085884 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083646 O=c1n([se]c2ccccc12)-c1ccccc1 InChI=1S/C13H9NOSe/c15-13-11-8-4-5-9-12(11)16-14(13)10-6-2-1-3-7-10/h1-9H DYEFUKCXAQOFHX-UHFFFAOYSA-N 34233 2-Phenyl-benzo[d]isoselenazol-3-one::2-Phenyl-benzo[d]isoselenazol-3-one(Ebselen)::2-phenyl-1,2-benzisoselazol-3(2H)-one::2-phenyl-1,2-benzoselenazol-3-one::2-phenylbenzo[d][1,2]selenazol-3(2H)-one::CHEMBL51085::EBSELEN::Ebselen (C5)::MLS000028488::SMR000058445::cid_3194::med.21724, Compound 153 Cholinesterase 10368 ChEMBL 10.1021/jm401047q 10.7270/Q21R6RZF 24160297 Luo, Z; Sheng, J; Sun, Y; Lu, C; Yan, J; Liu, A; Luo, HB; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=34233 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=34233&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3194 251974442 CHEMBL51085 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083647 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 15 ChEMBL 10.1021/jm401047q 10.7270/Q21R6RZF 24160297 Luo, Z; Sheng, J; Sun, Y; Lu, C; Yan, J; Liu, A; Luo, HB; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093006 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 15 ChEMBL 10.1016/j.bmc.2013.12.066 10.7270/Q29P334G 24461494 Luo, Z; Liang, L; Sheng, J; Pang, Y; Li, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093007 O=c1n([se]c2ccccc12)-c1ccccc1 InChI=1S/C13H9NOSe/c15-13-11-8-4-5-9-12(11)16-14(13)10-6-2-1-3-7-10/h1-9H DYEFUKCXAQOFHX-UHFFFAOYSA-N 34233 2-Phenyl-benzo[d]isoselenazol-3-one::2-Phenyl-benzo[d]isoselenazol-3-one(Ebselen)::2-phenyl-1,2-benzisoselazol-3(2H)-one::2-phenyl-1,2-benzoselenazol-3-one::2-phenylbenzo[d][1,2]selenazol-3(2H)-one::CHEMBL51085::EBSELEN::Ebselen (C5)::MLS000028488::SMR000058445::cid_3194::med.21724, Compound 153 Cholinesterase 10580 ChEMBL 10.1016/j.bmc.2013.12.066 10.7270/Q29P334G 24461494 Luo, Z; Liang, L; Sheng, J; Pang, Y; Li, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=34233 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=34233&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3194 251974442 CHEMBL51085 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093008 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 3490 ChEMBL 10.1016/j.bmc.2013.12.066 10.7270/Q29P334G 24461494 Luo, Z; Liang, L; Sheng, J; Pang, Y; Li, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093009 COc1cc2[se]n(-c3ccc(OCCCCN4CCCCC4)cc3)c(=O)c2cc1OC InChI=1S/C24H30N2O4Se/c1-28-21-16-20-23(17-22(21)29-2)31-26(24(20)27)18-8-10-19(11-9-18)30-15-7-6-14-25-12-4-3-5-13-25/h8-11,16-17H,3-7,12-15H2,1-2H3 YJIPHBLIIILVCK-UHFFFAOYSA-N 50447959 CHEMBL3115026 Cholinesterase 5720 ChEMBL 10.1016/j.bmc.2013.12.066 10.7270/Q29P334G 24461494 Luo, Z; Liang, L; Sheng, J; Pang, Y; Li, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447959 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447959&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76317801 194945855 CHEMBL3115026 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093010 COc1cc2[se]n(-c3ccc(OCCCN4CCCCC4)cc3)c(=O)c2cc1OC InChI=1S/C23H28N2O4Se/c1-27-20-15-19-22(16-21(20)28-2)30-25(23(19)26)17-7-9-18(10-8-17)29-14-6-13-24-11-4-3-5-12-24/h7-10,15-16H,3-6,11-14H2,1-2H3 SEEWNPTXFPHRDI-UHFFFAOYSA-N 50447960 CHEMBL3112614 Cholinesterase 5800 ChEMBL 10.1016/j.bmc.2013.12.066 10.7270/Q29P334G 24461494 Luo, Z; Liang, L; Sheng, J; Pang, Y; Li, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76332357 194945856 CHEMBL3112614 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093011 COc1cc2[se]n(-c3ccc(OCCN4CCCCC4)cc3)c(=O)c2cc1OC InChI=1S/C22H26N2O4Se/c1-26-19-14-18-21(15-20(19)27-2)29-24(22(18)25)16-6-8-17(9-7-16)28-13-12-23-10-4-3-5-11-23/h6-9,14-15H,3-5,10-13H2,1-2H3 WBYXSWQBTVRKLU-UHFFFAOYSA-N 50447961 CHEMBL3115025 Cholinesterase 9690 ChEMBL 10.1016/j.bmc.2013.12.066 10.7270/Q29P334G 24461494 Luo, Z; Liang, L; Sheng, J; Pang, Y; Li, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76314229 194945857 CHEMBL3115025 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093012 COc1cc2[se]n(-c3ccc(CCN4CCCCC4)cc3)c(=O)c2cc1OC InChI=1S/C22H26N2O3Se/c1-26-19-14-18-21(15-20(19)27-2)28-24(22(18)25)17-8-6-16(7-9-17)10-13-23-11-4-3-5-12-23/h6-9,14-15H,3-5,10-13H2,1-2H3 MNZWOEGJCSJXFA-UHFFFAOYSA-N 50447962 CHEMBL3115024 Cholinesterase >15000 ChEMBL 10.1016/j.bmc.2013.12.066 10.7270/Q29P334G 24461494 Luo, Z; Liang, L; Sheng, J; Pang, Y; Li, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447962 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447962&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76285505 194945858 CHEMBL3115024 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093013 COc1cc2[se]n(-c3ccc(CCN4CCCC4)cc3)c(=O)c2cc1OC InChI=1S/C21H24N2O3Se/c1-25-18-13-17-20(14-19(18)26-2)27-23(21(17)24)16-7-5-15(6-8-16)9-12-22-10-3-4-11-22/h5-8,13-14H,3-4,9-12H2,1-2H3 ZPJJDDNKPMJLGS-UHFFFAOYSA-N 50447963 CHEMBL3115023 Cholinesterase >15000 ChEMBL 10.1016/j.bmc.2013.12.066 10.7270/Q29P334G 24461494 Luo, Z; Liang, L; Sheng, J; Pang, Y; Li, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447963 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447963&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76328677 194945859 CHEMBL3115023 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093014 COc1cc2[se]n(-c3ccc(CN(C)Cc4ccccc4)cc3)c(=O)c2cc1OC InChI=1S/C24H24N2O3Se/c1-25(15-17-7-5-4-6-8-17)16-18-9-11-19(12-10-18)26-24(27)20-13-21(28-2)22(29-3)14-23(20)30-26/h4-14H,15-16H2,1-3H3 HDQFCHJTCUAZOT-UHFFFAOYSA-N 50447964 CHEMBL3115022 Cholinesterase 3620 ChEMBL 10.1016/j.bmc.2013.12.066 10.7270/Q29P334G 24461494 Luo, Z; Liang, L; Sheng, J; Pang, Y; Li, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447964 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447964&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76317800 194945860 CHEMBL3115022 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093015 COc1cc2[se]n(-c3ccc(CN4CCCCC4)cc3)c(=O)c2cc1OC InChI=1S/C21H24N2O3Se/c1-25-18-12-17-20(13-19(18)26-2)27-23(21(17)24)16-8-6-15(7-9-16)14-22-10-4-3-5-11-22/h6-9,12-13H,3-5,10-11,14H2,1-2H3 NBEXJUQNTLSDAH-UHFFFAOYSA-N 50447965 CHEMBL3115021 Cholinesterase >15000 ChEMBL 10.1016/j.bmc.2013.12.066 10.7270/Q29P334G 24461494 Luo, Z; Liang, L; Sheng, J; Pang, Y; Li, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447965 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447965&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76285506 194945861 CHEMBL3115021 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093016 COc1cc2[se]n(-c3ccc(CN4CCCC4)cc3)c(=O)c2cc1OC InChI=1S/C20H22N2O3Se/c1-24-17-11-16-19(12-18(17)25-2)26-22(20(16)23)15-7-5-14(6-8-15)13-21-9-3-4-10-21/h5-8,11-12H,3-4,9-10,13H2,1-2H3 RSRPZXMUCGYGAT-UHFFFAOYSA-N 50447966 CHEMBL3115020 Cholinesterase 13400 ChEMBL 10.1016/j.bmc.2013.12.066 10.7270/Q29P334G 24461494 Luo, Z; Liang, L; Sheng, J; Pang, Y; Li, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447966 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447966&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76314228 194945862 CHEMBL3115020 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093017 O=c1n([se]c2ccccc12)-c1ccc(OCCN2CCCCC2)cc1 InChI=1S/C20H22N2O2Se/c23-20-18-6-2-3-7-19(18)25-22(20)16-8-10-17(11-9-16)24-15-14-21-12-4-1-5-13-21/h2-3,6-11H,1,4-5,12-15H2 JBKQSCQUUYXDOK-UHFFFAOYSA-N 50447967 CHEMBL3115029 Cholinesterase 1970 ChEMBL 10.1016/j.bmc.2013.12.066 10.7270/Q29P334G 24461494 Luo, Z; Liang, L; Sheng, J; Pang, Y; Li, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447967 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447967&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76321510 194945863 CHEMBL3115029 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093018 O=c1n([se]c2ccccc12)-c1ccc(CCN2CCCC2)cc1 InChI=1S/C19H20N2OSe/c22-19-17-5-1-2-6-18(17)23-21(19)16-9-7-15(8-10-16)11-14-20-12-3-4-13-20/h1-2,5-10H,3-4,11-14H2 HNRAWYZRZCBIMG-UHFFFAOYSA-N 50447968 CHEMBL3115028 Cholinesterase 6380 ChEMBL 10.1016/j.bmc.2013.12.066 10.7270/Q29P334G 24461494 Luo, Z; Liang, L; Sheng, J; Pang, Y; Li, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447968 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447968&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76314230 194945864 CHEMBL3115028 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093019 O=c1n([se]c2ccccc12)-c1ccc(CN2CCCCC2)cc1 InChI=1S/C19H20N2OSe/c22-19-17-6-2-3-7-18(17)23-21(19)16-10-8-15(9-11-16)14-20-12-4-1-5-13-20/h2-3,6-11H,1,4-5,12-14H2 HWARFVXWYZKCEU-UHFFFAOYSA-N 50447969 CHEMBL3115027 Cholinesterase 5560 ChEMBL 10.1016/j.bmc.2013.12.066 10.7270/Q29P334G 24461494 Luo, Z; Liang, L; Sheng, J; Pang, Y; Li, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447969 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447969&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76332358 194945865 CHEMBL3115027 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093034 CN1C[C@@H](c2ccccc2F)[C@@]2(CN(C\C(=C/c3ccccc3F)C2=O)C(=O)C=C)[C@@]11C(=O)Nc2ccccc12 InChI=1S/C32H27F2N3O3/c1-3-28(38)37-17-21(16-20-10-4-7-13-25(20)33)29(39)31(19-37)24(22-11-5-8-14-26(22)34)18-36(2)32(31)23-12-6-9-15-27(23)35-30(32)40/h3-16,24H,1,17-19H2,2H3,(H,35,40)/b21-16+/t24-,31+,32+/m0/s1 BKDSEXOCOKEHEW-DBTRPOLGSA-N 50447970 CHEMBL3115043 Cholinesterase 6760 ChEMBL 10.1016/j.bmc.2014.01.002 10.7270/Q25X2BDR 24461561 Kia, Y; Osman, H; Kumar, RS; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447970 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447970&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76332360 194945866 CHEMBL3115043 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093035 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 19340 ChEMBL 10.1016/j.bmc.2014.01.002 10.7270/Q25X2BDR 24461561 Kia, Y; Osman, H; Kumar, RS; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093036 CN1CC[C@@H](C(=O)N2C\C(=C/c3cccc4ccccc34)C(=O)[C@@]3(C2)[C@@H](CN(C)[C@]32C(=O)Nc3ccccc23)c2cccc3ccccc23)[C@@]11C(=O)Nc2ccccc12 InChI=1S/C50H43N5O4/c1-53-26-25-40(49(53)38-21-7-9-23-42(38)51-46(49)58)45(57)55-28-34(27-33-17-11-15-31-13-3-5-18-35(31)33)44(56)48(30-55)41(37-20-12-16-32-14-4-6-19-36(32)37)29-54(2)50(48)39-22-8-10-24-43(39)52-47(50)59/h3-24,27,40-41H,25-26,28-30H2,1-2H3,(H,51,58)(H,52,59)/b34-27+/t40-,41-,48+,49-,50+/m0/s1 DMYRBALMXHKIGH-YUVNHMKWSA-N 50447971 CHEMBL3115038 Cholinesterase 19120 ChEMBL 10.1016/j.bmc.2014.01.002 10.7270/Q25X2BDR 24461561 Kia, Y; Osman, H; Kumar, RS; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447971 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447971&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76328679 194945867 CHEMBL3115038 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093037 CN1CC[C@@H](C(=O)N2C\C(=C/c3ccc(F)cc3)C(=O)[C@@]3(C2)[C@@H](CN(C)[C@]32C(=O)Nc3ccccc23)c2ccc(F)cc2)[C@@]11C(=O)Nc2ccccc12 InChI=1S/C42H37F2N5O4/c1-47-20-19-32(41(47)30-7-3-5-9-34(30)45-38(41)52)37(51)49-22-27(21-25-11-15-28(43)16-12-25)36(50)40(24-49)33(26-13-17-29(44)18-14-26)23-48(2)42(40)31-8-4-6-10-35(31)46-39(42)53/h3-18,21,32-33H,19-20,22-24H2,1-2H3,(H,45,52)(H,46,53)/b27-21+/t32-,33-,40+,41-,42+/m0/s1 JBSBVWSGDQEAHW-QGBZOZHCSA-N 50447972 CHEMBL3115037 Cholinesterase 7820 ChEMBL 10.1016/j.bmc.2014.01.002 10.7270/Q25X2BDR 24461561 Kia, Y; Osman, H; Kumar, RS; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447972 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447972&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76328678 194945868 CHEMBL3115037 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093038 CN1CC[C@@H](C(=O)N2C\C(=C/c3ccc(Cl)cc3)C(=O)[C@@]3(C2)[C@@H](CN(C)[C@]32C(=O)Nc3ccccc23)c2ccc(Cl)cc2)[C@@]11C(=O)Nc2ccccc12 InChI=1S/C42H37Cl2N5O4/c1-47-20-19-32(41(47)30-7-3-5-9-34(30)45-38(41)52)37(51)49-22-27(21-25-11-15-28(43)16-12-25)36(50)40(24-49)33(26-13-17-29(44)18-14-26)23-48(2)42(40)31-8-4-6-10-35(31)46-39(42)53/h3-18,21,32-33H,19-20,22-24H2,1-2H3,(H,45,52)(H,46,53)/b27-21+/t32-,33-,40+,41-,42+/m0/s1 QSYNZYDUZLMXLT-QGBZOZHCSA-N 50447973 CHEMBL3115036 Cholinesterase 9440 ChEMBL 10.1016/j.bmc.2014.01.002 10.7270/Q25X2BDR 24461561 Kia, Y; Osman, H; Kumar, RS; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447973 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447973&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76317803 194945869 CHEMBL3115036 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093039 CN1CC[C@@H](C(=O)N2C\C(=C/c3ccc(C)cc3)C(=O)[C@@]3(C2)[C@@H](CN(C)[C@]32C(=O)Nc3ccccc23)c2ccc(C)cc2)[C@@]11C(=O)Nc2ccccc12 InChI=1S/C44H43N5O4/c1-27-13-17-29(18-14-27)23-31-24-49(39(51)34-21-22-47(3)43(34)32-9-5-7-11-36(32)45-40(43)52)26-42(38(31)50)35(30-19-15-28(2)16-20-30)25-48(4)44(42)33-10-6-8-12-37(33)46-41(44)53/h5-20,23,34-35H,21-22,24-26H2,1-4H3,(H,45,52)(H,46,53)/b31-23+/t34-,35-,42+,43-,44+/m0/s1 SYIJWEUVZBXTSK-KHBLXWHLSA-N 50447974 CHEMBL3115035 Cholinesterase 11290 ChEMBL 10.1016/j.bmc.2014.01.002 10.7270/Q25X2BDR 24461561 Kia, Y; Osman, H; Kumar, RS; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447974 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447974&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76325116 194945870 CHEMBL3115035 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093040 CN1CC[C@@H](C(=O)N2C\C(=C/c3ccc(Cl)cc3Cl)C(=O)[C@@]3(C2)[C@@H](CN(C)[C@]32C(=O)Nc3ccccc23)c2ccc(Cl)cc2Cl)[C@@]11C(=O)Nc2ccccc12 InChI=1S/C42H35Cl4N5O4/c1-49-16-15-30(41(49)28-7-3-5-9-34(28)47-38(41)54)37(53)51-20-24(17-23-11-12-25(43)18-32(23)45)36(52)40(22-51)31(27-14-13-26(44)19-33(27)46)21-50(2)42(40)29-8-4-6-10-35(29)48-39(42)55/h3-14,17-19,30-31H,15-16,20-22H2,1-2H3,(H,47,54)(H,48,55)/b24-17+/t30-,31-,40+,41-,42+/m0/s1 GPPGIVRQQSJCJT-ZJXUGDSISA-N 50447975 CHEMBL3115034 Cholinesterase 17900 ChEMBL 10.1016/j.bmc.2014.01.002 10.7270/Q25X2BDR 24461561 Kia, Y; Osman, H; Kumar, RS; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447975 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447975&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76325115 194945871 CHEMBL3115034 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093041 CN1CC[C@@H](C(=O)N2C\C(=C/c3cccc(c3)[N+]([O-])=O)C(=O)[C@@]3(C2)[C@@H](CN(C)[C@]32C(=O)Nc3ccccc23)c2cccc(c2)[N+]([O-])=O)[C@@]11C(=O)Nc2ccccc12 InChI=1S/C42H37N7O8/c1-45-18-17-32(41(45)30-13-3-5-15-34(30)43-38(41)52)37(51)47-22-27(19-25-9-7-11-28(20-25)48(54)55)36(50)40(24-47)33(26-10-8-12-29(21-26)49(56)57)23-46(2)42(40)31-14-4-6-16-35(31)44-39(42)53/h3-16,19-21,32-33H,17-18,22-24H2,1-2H3,(H,43,52)(H,44,53)/b27-19+/t32-,33-,40+,41-,42+/m0/s1 VPPIZGVJYULPCI-AKXUEXMOSA-N 50447976 CHEMBL3115033 Cholinesterase 12340 ChEMBL 10.1016/j.bmc.2014.01.002 10.7270/Q25X2BDR 24461561 Kia, Y; Osman, H; Kumar, RS; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447976 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447976&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76332359 194945872 CHEMBL3115033 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093042 CN1CC[C@@H](C(=O)N2C\C(=C/c3ccccc3F)C(=O)[C@@]3(C2)[C@@H](CN(C)[C@]32C(=O)Nc3ccccc23)c2ccccc2F)[C@@]11C(=O)Nc2ccccc12 InChI=1S/C42H37F2N5O4/c1-47-20-19-30(41(47)28-13-5-9-17-34(28)45-38(41)52)37(51)49-22-26(21-25-11-3-7-15-32(25)43)36(50)40(24-49)31(27-12-4-8-16-33(27)44)23-48(2)42(40)29-14-6-10-18-35(29)46-39(42)53/h3-18,21,30-31H,19-20,22-24H2,1-2H3,(H,45,52)(H,46,53)/b26-21+/t30-,31-,40+,41-,42+/m0/s1 LZCINFLXWAYHAD-UNICUECWSA-N 50447977 CHEMBL3115032 Cholinesterase 7440 ChEMBL 10.1016/j.bmc.2014.01.002 10.7270/Q25X2BDR 24461561 Kia, Y; Osman, H; Kumar, RS; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447977 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447977&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76317802 194945873 CHEMBL3115032 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093043 CN1CC[C@@H](C(=O)N2C\C(=C/c3ccccc3Cl)C(=O)[C@@]3(C2)[C@@H](CN(C)[C@]32C(=O)Nc3ccccc23)c2ccccc2Cl)[C@@]11C(=O)Nc2ccccc12 InChI=1S/C42H37Cl2N5O4/c1-47-20-19-30(41(47)28-13-5-9-17-34(28)45-38(41)52)37(51)49-22-26(21-25-11-3-7-15-32(25)43)36(50)40(24-49)31(27-12-4-8-16-33(27)44)23-48(2)42(40)29-14-6-10-18-35(29)46-39(42)53/h3-18,21,30-31H,19-20,22-24H2,1-2H3,(H,45,52)(H,46,53)/b26-21+/t30-,31-,40+,41-,42+/m0/s1 URTUAVNTWXXCEN-UNICUECWSA-N 50447978 CHEMBL3115031 Cholinesterase 9380 ChEMBL 10.1016/j.bmc.2014.01.002 10.7270/Q25X2BDR 24461561 Kia, Y; Osman, H; Kumar, RS; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447978 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447978&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76310594 194945874 CHEMBL3115031 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093044 COc1ccccc1\C=C1/CN(C[C@@]2([C@@H](CN(C)[C@]22C(=O)Nc3ccccc23)c2ccccc2OC)C1=O)C(=O)[C@@H]1CCN(C)[C@]11C(=O)Nc2ccccc12 InChI=1S/C44H43N5O6/c1-47-22-21-32(43(47)30-15-7-9-17-34(30)45-40(43)52)39(51)49-24-28(23-27-13-5-11-19-36(27)54-3)38(50)42(26-49)33(29-14-6-12-20-37(29)55-4)25-48(2)44(42)31-16-8-10-18-35(31)46-41(44)53/h5-20,23,32-33H,21-22,24-26H2,1-4H3,(H,45,52)(H,46,53)/b28-23+/t32-,33-,42+,43-,44+/m0/s1 QJLCTYMBVMACFN-UGYSWYPASA-N 50447979 CHEMBL3115030 Cholinesterase 10420 ChEMBL 10.1016/j.bmc.2014.01.002 10.7270/Q25X2BDR 24461561 Kia, Y; Osman, H; Kumar, RS; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447979 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447979&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76321511 194945875 CHEMBL3115030 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093045 CN1CC[C@@H](C(=O)N2C\C(=C/c3ccccc3C)C(=O)[C@@]3(C2)[C@@H](CN(C)[C@]32C(=O)Nc3ccccc23)c2ccccc2C)[C@@]11C(=O)Nc2ccccc12 InChI=1S/C44H43N5O4/c1-27-13-5-7-15-29(27)23-30-24-49(39(51)34-21-22-47(3)43(34)32-17-9-11-19-36(32)45-40(43)52)26-42(38(30)50)35(31-16-8-6-14-28(31)2)25-48(4)44(42)33-18-10-12-20-37(33)46-41(44)53/h5-20,23,34-35H,21-22,24-26H2,1-4H3,(H,45,52)(H,46,53)/b30-23+/t34-,35-,42+,43-,44+/m0/s1 QSFNNADKNRBZRA-UURVOFGNSA-N 50447980 CHEMBL3115198 Cholinesterase 12510 ChEMBL 10.1016/j.bmc.2014.01.002 10.7270/Q25X2BDR 24461561 Kia, Y; Osman, H; Kumar, RS; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447980 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447980&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76335994 194945876 CHEMBL3115198 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093046 CN1CC[C@@H](C(=O)N2C\C(=C/c3ccccc3)C(=O)[C@@]3(C2)[C@@H](CN(C)[C@]32C(=O)Nc3ccccc23)c2ccccc2)[C@@]11C(=O)Nc2ccccc12 InChI=1S/C42H39N5O4/c1-45-22-21-32(41(45)30-17-9-11-19-34(30)43-38(41)50)37(49)47-24-29(23-27-13-5-3-6-14-27)36(48)40(26-47)33(28-15-7-4-8-16-28)25-46(2)42(40)31-18-10-12-20-35(31)44-39(42)51/h3-20,23,32-33H,21-22,24-26H2,1-2H3,(H,43,50)(H,44,51)/b29-23+/t32-,33-,40+,41-,42+/m0/s1 YYYKXFFODWMENN-GTRCEIMPSA-N 50447981 CHEMBL3115197 Cholinesterase 9340 ChEMBL 10.1016/j.bmc.2014.01.002 10.7270/Q25X2BDR 24461561 Kia, Y; Osman, H; Kumar, RS; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447981 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447981&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76335993 194945877 CHEMBL3115197 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093047 CN1C[C@@H](c2cccc3ccccc23)[C@@]2(CN(C\C(=C/c3cccc4ccccc34)C2=O)C(=O)C=C)[C@@]11C(=O)Nc2ccccc12 InChI=1S/C40H33N3O3/c1-3-36(44)43-23-29(22-28-16-10-14-26-12-4-6-17-30(26)28)37(45)39(25-43)34(32-19-11-15-27-13-5-7-18-31(27)32)24-42(2)40(39)33-20-8-9-21-35(33)41-38(40)46/h3-22,34H,1,23-25H2,2H3,(H,41,46)/b29-22+/t34-,39+,40+/m0/s1 CIGWHVQNGHCCQD-AFCOQHGVSA-N 50447982 CHEMBL3115196 Cholinesterase 8850 ChEMBL 10.1016/j.bmc.2014.01.002 10.7270/Q25X2BDR 24461561 Kia, Y; Osman, H; Kumar, RS; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447982 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447982&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76332365 194945878 CHEMBL3115196 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093048 CN1C[C@@H](c2ccc(F)cc2)[C@@]2(CN(C\C(=C/c3ccc(F)cc3)C2=O)C(=O)C=C)[C@@]11C(=O)Nc2ccccc12 InChI=1S/C32H27F2N3O3/c1-3-28(38)37-17-22(16-20-8-12-23(33)13-9-20)29(39)31(19-37)26(21-10-14-24(34)15-11-21)18-36(2)32(31)25-6-4-5-7-27(25)35-30(32)40/h3-16,26H,1,17-19H2,2H3,(H,35,40)/b22-16+/t26-,31+,32+/m0/s1 MVRSVSUWAGKMRS-RLKYIGPZSA-N 50447983 CHEMBL3115048 Cholinesterase 3390 ChEMBL 10.1016/j.bmc.2014.01.002 10.7270/Q25X2BDR 24461561 Kia, Y; Osman, H; Kumar, RS; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447983 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447983&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76314231 194945879 CHEMBL3115048 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083648 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 3365 ChEMBL 10.1021/jm401047q 10.7270/Q21R6RZF 24160297 Luo, Z; Sheng, J; Sun, Y; Lu, C; Yan, J; Liu, A; Luo, HB; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083649 COc1cc2C(=O)N(CCC3CCN(Cc4ccccc4)CC3)[Se](=O)c2cc1OC InChI=1S/C23H28N2O4Se/c1-28-20-14-19-22(15-21(20)29-2)30(27)25(23(19)26)13-10-17-8-11-24(12-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17H,8-13,16H2,1-2H3 ISDBEASSBDUORE-UHFFFAOYSA-N 50443367 CHEMBL3086279 Cholinesterase 1362 ChEMBL 10.1021/jm401047q 10.7270/Q21R6RZF 24160297 Luo, Z; Sheng, J; Sun, Y; Lu, C; Yan, J; Liu, A; Luo, HB; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443367 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443367&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72736549 194941263 CHEMBL3086279 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083650 COc1cc2[se]n(CCCCC3CCN(Cc4ccccc4)CC3)c(=O)c2cc1OC InChI=1S/C25H32N2O3Se/c1-29-22-16-21-24(17-23(22)30-2)31-27(25(21)28)13-7-6-8-19-11-14-26(15-12-19)18-20-9-4-3-5-10-20/h3-5,9-10,16-17,19H,6-8,11-15,18H2,1-2H3 XATRWWMRLDBURC-UHFFFAOYSA-N 50443368 CHEMBL3086278 Cholinesterase 517 ChEMBL 10.1021/jm401047q 10.7270/Q21R6RZF 24160297 Luo, Z; Sheng, J; Sun, Y; Lu, C; Yan, J; Liu, A; Luo, HB; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443368 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443368&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72736548 194941264 CHEMBL3086278 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083651 COc1cc2[se]n(CCCC3CCN(Cc4ccccc4)CC3)c(=O)c2cc1OC InChI=1S/C24H30N2O3Se/c1-28-21-15-20-23(16-22(21)29-2)30-26(24(20)27)12-6-9-18-10-13-25(14-11-18)17-19-7-4-3-5-8-19/h3-5,7-8,15-16,18H,6,9-14,17H2,1-2H3 SPTPBOSWJWYELM-UHFFFAOYSA-N 50443369 CHEMBL3086277 Cholinesterase 1503 ChEMBL 10.1021/jm401047q 10.7270/Q21R6RZF 24160297 Luo, Z; Sheng, J; Sun, Y; Lu, C; Yan, J; Liu, A; Luo, HB; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443369 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443369&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72736377 194941265 CHEMBL3086277 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083652 COc1cc2[se]n(CCC3CCN(Cc4ccccc4)CC3)c(=O)c2cc1OC InChI=1S/C23H28N2O3Se/c1-27-20-14-19-22(15-21(20)28-2)29-25(23(19)26)13-10-17-8-11-24(12-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17H,8-13,16H2,1-2H3 PGBBHNPZVCTISZ-UHFFFAOYSA-N 50443370 CHEMBL3086276 Cholinesterase 1586 ChEMBL 10.1021/jm401047q 10.7270/Q21R6RZF 24160297 Luo, Z; Sheng, J; Sun, Y; Lu, C; Yan, J; Liu, A; Luo, HB; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443370 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443370&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72736878 194941266 CHEMBL3086276 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083653 Clc1ccc2c(c1)[se]n(CCC1CCN(Cc3ccccc3)CC1)c2=O InChI=1S/C21H23ClN2OSe/c22-18-6-7-19-20(14-18)26-24(21(19)25)13-10-16-8-11-23(12-9-16)15-17-4-2-1-3-5-17/h1-7,14,16H,8-13,15H2 XURGOXPTELPZET-UHFFFAOYSA-N 50443371 CHEMBL3086275 Cholinesterase 2346 ChEMBL 10.1021/jm401047q 10.7270/Q21R6RZF 24160297 Luo, Z; Sheng, J; Sun, Y; Lu, C; Yan, J; Liu, A; Luo, HB; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443371 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443371&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72736727 194941267 CHEMBL3086275 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083654 Fc1ccc2c(c1)[se]n(CCC1CCN(Cc3ccccc3)CC1)c2=O InChI=1S/C21H23FN2OSe/c22-18-6-7-19-20(14-18)26-24(21(19)25)13-10-16-8-11-23(12-9-16)15-17-4-2-1-3-5-17/h1-7,14,16H,8-13,15H2 HEJCLDPZAASSHU-UHFFFAOYSA-N 50443372 CHEMBL3086274 Cholinesterase 3668 ChEMBL 10.1021/jm401047q 10.7270/Q21R6RZF 24160297 Luo, Z; Sheng, J; Sun, Y; Lu, C; Yan, J; Liu, A; Luo, HB; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443372 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443372&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72736726 194941268 CHEMBL3086274 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083655 O=c1n(CCC2CCN(Cc3ccccc3)CC2)[se]c2ccccc12 InChI=1S/C21H24N2OSe/c24-21-19-8-4-5-9-20(19)25-23(21)15-12-17-10-13-22(14-11-17)16-18-6-2-1-3-7-18/h1-9,17H,10-16H2 WYBSTHYTYQKMRS-UHFFFAOYSA-N 50443373 CHEMBL3086273 Cholinesterase 2132 ChEMBL 10.1021/jm401047q 10.7270/Q21R6RZF 24160297 Luo, Z; Sheng, J; Sun, Y; Lu, C; Yan, J; Liu, A; Luo, HB; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443373 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443373&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72736725 194941269 CHEMBL3086273 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083656 COc1cc2[se]n(CC3CCN(Cc4ccccc4)CC3)c(=O)c2cc1OC InChI=1S/C22H26N2O3Se/c1-26-19-12-18-21(13-20(19)27-2)28-24(22(18)25)15-17-8-10-23(11-9-17)14-16-6-4-3-5-7-16/h3-7,12-13,17H,8-11,14-15H2,1-2H3 OHEZDVOIDWZWQA-UHFFFAOYSA-N 50443374 CHEMBL3086272 Cholinesterase 3921 ChEMBL 10.1021/jm401047q 10.7270/Q21R6RZF 24160297 Luo, Z; Sheng, J; Sun, Y; Lu, C; Yan, J; Liu, A; Luo, HB; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443374 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443374&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72736724 194941270 CHEMBL3086272 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083657 Clc1ccc2c(c1)[se]n(CC1CCN(Cc3ccccc3)CC1)c2=O InChI=1S/C20H21ClN2OSe/c21-17-6-7-18-19(12-17)25-23(20(18)24)14-16-8-10-22(11-9-16)13-15-4-2-1-3-5-15/h1-7,12,16H,8-11,13-14H2 UAHJECNKOCTDNE-UHFFFAOYSA-N 50443375 CHEMBL3086271 Cholinesterase 2295 ChEMBL 10.1021/jm401047q 10.7270/Q21R6RZF 24160297 Luo, Z; Sheng, J; Sun, Y; Lu, C; Yan, J; Liu, A; Luo, HB; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443375 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443375&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72736723 194941271 CHEMBL3086271 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083658 Fc1ccc2c(c1)[se]n(CC1CCN(Cc3ccccc3)CC1)c2=O InChI=1S/C20H21FN2OSe/c21-17-6-7-18-19(12-17)25-23(20(18)24)14-16-8-10-22(11-9-16)13-15-4-2-1-3-5-15/h1-7,12,16H,8-11,13-14H2 GPRWLUZMXKEZMY-UHFFFAOYSA-N 50443376 CHEMBL3086270 Cholinesterase 3461 ChEMBL 10.1021/jm401047q 10.7270/Q21R6RZF 24160297 Luo, Z; Sheng, J; Sun, Y; Lu, C; Yan, J; Liu, A; Luo, HB; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443376 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443376&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72736722 194941272 CHEMBL3086270 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083659 O=c1n(CC2CCN(Cc3ccccc3)CC2)[se]c2ccccc12 InChI=1S/C20H22N2OSe/c23-20-18-8-4-5-9-19(18)24-22(20)15-17-10-12-21(13-11-17)14-16-6-2-1-3-7-16/h1-9,17H,10-15H2 WGQDDYQZJZACBY-UHFFFAOYSA-N 50443377 CHEMBL3086269 Cholinesterase 3628 ChEMBL 10.1021/jm401047q 10.7270/Q21R6RZF 24160297 Luo, Z; Sheng, J; Sun, Y; Lu, C; Yan, J; Liu, A; Luo, HB; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443377 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443377&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72736721 194941273 CHEMBL3086269 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083660 COc1cc2[se]n(C3CCN(Cc4ccccc4)CC3)c(=O)c2cc1OC InChI=1S/C21H24N2O3Se/c1-25-18-12-17-20(13-19(18)26-2)27-23(21(17)24)16-8-10-22(11-9-16)14-15-6-4-3-5-7-15/h3-7,12-13,16H,8-11,14H2,1-2H3 CARGOAUUVUJCKG-UHFFFAOYSA-N 50443378 CHEMBL3086268 Cholinesterase 9463 ChEMBL 10.1021/jm401047q 10.7270/Q21R6RZF 24160297 Luo, Z; Sheng, J; Sun, Y; Lu, C; Yan, J; Liu, A; Luo, HB; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443378 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443378&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72736554 194941274 CHEMBL3086268 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083661 Clc1ccc2c(c1)[se]n(C1CCN(Cc3ccccc3)CC1)c2=O InChI=1S/C19H19ClN2OSe/c20-15-6-7-17-18(12-15)24-22(19(17)23)16-8-10-21(11-9-16)13-14-4-2-1-3-5-14/h1-7,12,16H,8-11,13H2 HYQXXJPDFKHWQZ-UHFFFAOYSA-N 50443379 CHEMBL3086267 Cholinesterase 21520 ChEMBL 10.1021/jm401047q 10.7270/Q21R6RZF 24160297 Luo, Z; Sheng, J; Sun, Y; Lu, C; Yan, J; Liu, A; Luo, HB; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443379 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443379&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72736553 194941275 CHEMBL3086267 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083662 Fc1ccc2c(c1)[se]n(C1CCN(Cc3ccccc3)CC1)c2=O InChI=1S/C19H19FN2OSe/c20-15-6-7-17-18(12-15)24-22(19(17)23)16-8-10-21(11-9-16)13-14-4-2-1-3-5-14/h1-7,12,16H,8-11,13H2 HUUATXMEAHBUNW-UHFFFAOYSA-N 50443380 CHEMBL3086266 Cholinesterase 10580 ChEMBL 10.1021/jm401047q 10.7270/Q21R6RZF 24160297 Luo, Z; Sheng, J; Sun, Y; Lu, C; Yan, J; Liu, A; Luo, HB; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443380 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443380&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72736552 194941276 CHEMBL3086266 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51083663 O=c1n([se]c2ccccc12)C1CCN(Cc2ccccc2)CC1 InChI=1S/C19H20N2OSe/c22-19-17-8-4-5-9-18(17)23-21(19)16-10-12-20(13-11-16)14-15-6-2-1-3-7-15/h1-9,16H,10-14H2 SCYMJLNYMOSUDP-UHFFFAOYSA-N 50443381 CHEMBL3086353 Cholinesterase 8316 ChEMBL 10.1021/jm401047q 10.7270/Q21R6RZF 24160297 Luo, Z; Sheng, J; Sun, Y; Lu, C; Yan, J; Liu, A; Luo, HB; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50443381 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50443381&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72736551 194941277 CHEMBL3086353 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093051 CN1C[C@@H](c2ccc(Cl)cc2Cl)[C@@]2(CN(C\C(=C/c3ccc(Cl)cc3Cl)C2=O)C(=O)C=C)[C@@]11C(=O)Nc2ccccc12 InChI=1S/C32H25Cl4N3O3/c1-3-28(40)39-15-19(12-18-8-9-20(33)13-25(18)35)29(41)31(17-39)24(22-11-10-21(34)14-26(22)36)16-38(2)32(31)23-6-4-5-7-27(23)37-30(32)42/h3-14,24H,1,15-17H2,2H3,(H,37,42)/b19-12+/t24-,31+,32+/m0/s1 YLVDGFLHTCJOCC-YDGHPEPZSA-N 50447986 CHEMBL3115045 Cholinesterase 5320 ChEMBL 10.1016/j.bmc.2014.01.002 10.7270/Q25X2BDR 24461561 Kia, Y; Osman, H; Kumar, RS; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447986 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447986&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76325117 194945882 CHEMBL3115045 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093052 CN1C[C@@H](c2cccc(c2)[N+]([O-])=O)[C@@]2(CN(C\C(=C/c3cccc(c3)[N+]([O-])=O)C2=O)C(=O)C=C)[C@@]11C(=O)Nc2ccccc12 InChI=1S/C32H27N5O7/c1-3-28(38)35-17-22(14-20-8-6-10-23(15-20)36(41)42)29(39)31(19-35)26(21-9-7-11-24(16-21)37(43)44)18-34(2)32(31)25-12-4-5-13-27(25)33-30(32)40/h3-16,26H,1,17-19H2,2H3,(H,33,40)/b22-14+/t26-,31+,32+/m0/s1 OKHFUHHPYDCFSR-YFCWGEOWSA-N 50447987 CHEMBL3115044 Cholinesterase 7740 ChEMBL 10.1016/j.bmc.2014.01.002 10.7270/Q25X2BDR 24461561 Kia, Y; Osman, H; Kumar, RS; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447987 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447987&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76335988 194945883 CHEMBL3115044 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093053 CN1C[C@@H](c2ccccc2F)[C@@]2(CN(C\C(=C/c3ccccc3F)C2=O)C(=O)C=C)[C@@]11C(=O)Nc2ccccc12 InChI=1S/C32H27F2N3O3/c1-3-28(38)37-17-21(16-20-10-4-7-13-25(20)33)29(39)31(19-37)24(22-11-5-8-14-26(22)34)18-36(2)32(31)23-12-6-9-15-27(23)35-30(32)40/h3-16,24H,1,17-19H2,2H3,(H,35,40)/b21-16+/t24-,31+,32+/m0/s1 BKDSEXOCOKEHEW-DBTRPOLGSA-N 50447970 CHEMBL3115043 Cholinesterase 3210 ChEMBL 10.1016/j.bmc.2014.01.002 10.7270/Q25X2BDR 24461561 Kia, Y; Osman, H; Kumar, RS; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447970 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447970&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76332360 194945866 CHEMBL3115043 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093054 CN1C[C@@H](c2ccccc2Cl)[C@@]2(CN(C\C(=C/c3ccccc3Cl)C2=O)C(=O)C=C)[C@@]11C(=O)Nc2ccccc12 InChI=1S/C32H27Cl2N3O3/c1-3-28(38)37-17-21(16-20-10-4-7-13-25(20)33)29(39)31(19-37)24(22-11-5-8-14-26(22)34)18-36(2)32(31)23-12-6-9-15-27(23)35-30(32)40/h3-16,24H,1,17-19H2,2H3,(H,35,40)/b21-16+/t24-,31+,32+/m0/s1 UBLDCFKBHKDJPB-DBTRPOLGSA-N 50447988 CHEMBL3115042 Cholinesterase 4200 ChEMBL 10.1016/j.bmc.2014.01.002 10.7270/Q25X2BDR 24461561 Kia, Y; Osman, H; Kumar, RS; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447988 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447988&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76321512 194945884 CHEMBL3115042 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093055 COc1ccccc1\C=C1/CN(C[C@@]2([C@@H](CN(C)[C@]22C(=O)Nc3ccccc23)c2ccccc2OC)C1=O)C(=O)C=C InChI=1S/C34H33N3O5/c1-5-30(38)37-19-23(18-22-12-6-10-16-28(22)41-3)31(39)33(21-37)26(24-13-7-11-17-29(24)42-4)20-36(2)34(33)25-14-8-9-15-27(25)35-32(34)40/h5-18,26H,1,19-21H2,2-4H3,(H,35,40)/b23-18+/t26-,33+,34+/m0/s1 LSLPXJPINXJYED-AOBXVYRYSA-N 50447989 CHEMBL3115041 Cholinesterase 4220 ChEMBL 10.1016/j.bmc.2014.01.002 10.7270/Q25X2BDR 24461561 Kia, Y; Osman, H; Kumar, RS; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447989 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447989&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76310595 194945885 CHEMBL3115041 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093056 CN1C[C@@H](c2ccccc2C)[C@@]2(CN(C\C(=C/c3ccccc3C)C2=O)C(=O)C=C)[C@@]11C(=O)Nc2ccccc12 InChI=1S/C34H33N3O3/c1-5-30(38)37-19-25(18-24-14-8-6-12-22(24)2)31(39)33(21-37)28(26-15-9-7-13-23(26)3)20-36(4)34(33)27-16-10-11-17-29(27)35-32(34)40/h5-18,28H,1,19-21H2,2-4H3,(H,35,40)/b25-18+/t28-,33+,34+/m0/s1 ZKLQFVFZXDZESS-QFVGFNLVSA-N 50447990 CHEMBL3115040 Cholinesterase 3860 ChEMBL 10.1016/j.bmc.2014.01.002 10.7270/Q25X2BDR 24461561 Kia, Y; Osman, H; Kumar, RS; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447990 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447990&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76328680 194945886 CHEMBL3115040 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093057 CN1C[C@@H](c2ccccc2)[C@@]2(CN(C\C(=C/c3ccccc3)C2=O)C(=O)C=C)[C@@]11C(=O)Nc2ccccc12 InChI=1S/C32H29N3O3/c1-3-28(36)35-19-24(18-22-12-6-4-7-13-22)29(37)31(21-35)26(23-14-8-5-9-15-23)20-34(2)32(31)25-16-10-11-17-27(25)33-30(32)38/h3-18,26H,1,19-21H2,2H3,(H,33,38)/b24-18+/t26-,31+,32+/m0/s1 LHISBHNARPPDIO-JKHBRONLSA-N 50447991 CHEMBL3115039 Cholinesterase 7520 ChEMBL 10.1016/j.bmc.2014.01.002 10.7270/Q25X2BDR 24461561 Kia, Y; Osman, H; Kumar, RS; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447991 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447991&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76335987 194945887 CHEMBL3115039 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093049 CN1C[C@@H](c2ccc(Cl)cc2)[C@@]2(CN(C\C(=C/c3ccc(Cl)cc3)C2=O)C(=O)C=C)[C@@]11C(=O)Nc2ccccc12 InChI=1S/C32H27Cl2N3O3/c1-3-28(38)37-17-22(16-20-8-12-23(33)13-9-20)29(39)31(19-37)26(21-10-14-24(34)15-11-21)18-36(2)32(31)25-6-4-5-7-27(25)35-30(32)40/h3-16,26H,1,17-19H2,2H3,(H,35,40)/b22-16+/t26-,31+,32+/m0/s1 YIQGIPHCFFIJQN-RLKYIGPZSA-N 50447984 CHEMBL3115047 Cholinesterase 6770 ChEMBL 10.1016/j.bmc.2014.01.002 10.7270/Q25X2BDR 24461561 Kia, Y; Osman, H; Kumar, RS; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447984 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447984&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76310596 194945880 CHEMBL3115047 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51093050 CN1C[C@@H](c2ccc(C)cc2)[C@@]2(CN(C\C(=C/c3ccc(C)cc3)C2=O)C(=O)C=C)[C@@]11C(=O)Nc2ccccc12 InChI=1S/C34H33N3O3/c1-5-30(38)37-19-26(18-24-14-10-22(2)11-15-24)31(39)33(21-37)28(25-16-12-23(3)13-17-25)20-36(4)34(33)27-8-6-7-9-29(27)35-32(34)40/h5-18,28H,1,19-21H2,2-4H3,(H,35,40)/b26-18+/t28-,33+,34+/m0/s1 KXQUSZFXGCQBEY-LNEKVJQRSA-N 50447985 CHEMBL3115046 Cholinesterase 9280 ChEMBL 10.1016/j.bmc.2014.01.002 10.7270/Q25X2BDR 24461561 Kia, Y; Osman, H; Kumar, RS; Basiri, A; Murugaiyah, V Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50447985 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50447985&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76328681 194945881 CHEMBL3115046 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51080474 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 12700 ChEMBL 10.1016/j.ejmech.2013.09.024 10.7270/Q2BP048V 24095756 Li, SY; Wang, XB; Xie, SS; Jiang, N; Wang, KD; Yao, HQ; Sun, HB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51080475 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 50 ChEMBL 10.1016/j.ejmech.2013.09.024 10.7270/Q2BP048V 24095756 Li, SY; Wang, XB; Xie, SS; Jiang, N; Wang, KD; Yao, HQ; Sun, HB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51080476 O=c1ccoc2cc(OCCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)ccc12 InChI=1S/C32H38N4O3/c37-30-13-22-39-31-23-24(11-12-27(30)31)38-21-6-16-36-19-17-35(18-20-36)15-5-14-33-32-25-7-1-3-9-28(25)34-29-10-4-2-8-26(29)32/h1,3,7,9,11-13,22-23H,2,4-6,8,10,14-21H2,(H,33,34) PQVCLIWXIHZOHO-UHFFFAOYSA-N 50441840 CHEMBL2436692 Cholinesterase 26 ChEMBL 10.1016/j.ejmech.2013.09.024 10.7270/Q2BP048V 24095756 Li, SY; Wang, XB; Xie, SS; Jiang, N; Wang, KD; Yao, HQ; Sun, HB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50441840 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50441840&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73357093 175454157 CHEMBL2436692 ZINC96285550 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51080477 COc1cc(OCCCN2CCN(CCCNc3c4CCCCc4nc4ccccc34)CC2)cc2occc(=O)c12 InChI=1S/C33H40N4O4/c1-39-30-22-24(23-31-32(30)29(38)12-21-41-31)40-20-7-15-37-18-16-36(17-19-37)14-6-13-34-33-25-8-2-4-10-27(25)35-28-11-5-3-9-26(28)33/h2,4,8,10,12,21-23H,3,5-7,9,11,13-20H2,1H3,(H,34,35) TZWXGPOBAFCOHW-UHFFFAOYSA-N 50441841 CHEMBL2436691 Cholinesterase 35 ChEMBL 10.1016/j.ejmech.2013.09.024 10.7270/Q2BP048V 24095756 Li, SY; Wang, XB; Xie, SS; Jiang, N; Wang, KD; Yao, HQ; Sun, HB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50441841 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50441841&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73355546 175454158 CHEMBL2436691 ZINC96285551 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51080478 Oc1cc(OCCCN2CCN(CCCNc3c4CCCCc4nc4ccccc34)CC2)cc2occc(=O)c12 InChI=1S/C32H38N4O4/c37-28-11-20-40-30-22-23(21-29(38)31(28)30)39-19-6-14-36-17-15-35(16-18-36)13-5-12-33-32-24-7-1-3-9-26(24)34-27-10-4-2-8-25(27)32/h1,3,7,9,11,20-22,38H,2,4-6,8,10,12-19H2,(H,33,34) CCSIEQWILAQNOJ-UHFFFAOYSA-N 50441842 CHEMBL2436690 Cholinesterase 45 ChEMBL 10.1016/j.ejmech.2013.09.024 10.7270/Q2BP048V 24095756 Li, SY; Wang, XB; Xie, SS; Jiang, N; Wang, KD; Yao, HQ; Sun, HB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50441842 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50441842&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73357092 175454159 CHEMBL2436690 ZINC96285552 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51080479 [O-][N+](=O)c1ccc(cc1)-c1cc(=O)c2ccc(OCCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)cc2o1 InChI=1S/C38H41N5O5/c44-35-26-36(27-11-13-28(14-12-27)43(45)46)48-37-25-29(15-16-32(35)37)47-24-6-19-42-22-20-41(21-23-42)18-5-17-39-38-30-7-1-3-9-33(30)40-34-10-4-2-8-31(34)38/h1,3,7,9,11-16,25-26H,2,4-6,8,10,17-24H2,(H,39,40) LPFUNCKTPHEEPF-UHFFFAOYSA-N 50441843 CHEMBL2436710 Cholinesterase 460 ChEMBL 10.1016/j.ejmech.2013.09.024 10.7270/Q2BP048V 24095756 Li, SY; Wang, XB; Xie, SS; Jiang, N; Wang, KD; Yao, HQ; Sun, HB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50441843 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50441843&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73351053 175454160 CHEMBL2436710 ZINC96285553 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51080480 Clc1ccc(cc1)-c1cc(=O)c2ccc(OCCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)cc2o1 InChI=1S/C38H41ClN4O3/c39-28-13-11-27(12-14-28)36-26-35(44)32-16-15-29(25-37(32)46-36)45-24-6-19-43-22-20-42(21-23-43)18-5-17-40-38-30-7-1-3-9-33(30)41-34-10-4-2-8-31(34)38/h1,3,7,9,11-16,25-26H,2,4-6,8,10,17-24H2,(H,40,41) KODPQYQIVAWQBN-UHFFFAOYSA-N 50441844 CHEMBL2436709 Cholinesterase 994 ChEMBL 10.1016/j.ejmech.2013.09.024 10.7270/Q2BP048V 24095756 Li, SY; Wang, XB; Xie, SS; Jiang, N; Wang, KD; Yao, HQ; Sun, HB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50441844 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50441844&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73354017 175454161 CHEMBL2436709 ZINC96285554 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51080481 CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)cc2o1 InChI=1S/C40H47N5O3/c1-43(2)30-15-13-29(14-16-30)38-28-37(46)34-18-17-31(27-39(34)48-38)47-26-8-21-45-24-22-44(23-25-45)20-7-19-41-40-32-9-3-5-11-35(32)42-36-12-6-4-10-33(36)40/h3,5,9,11,13-18,27-28H,4,6-8,10,12,19-26H2,1-2H3,(H,41,42) HZYJRKKNDYPBCG-UHFFFAOYSA-N 50441845 CHEMBL2436708 Cholinesterase 845 ChEMBL 10.1016/j.ejmech.2013.09.024 10.7270/Q2BP048V 24095756 Li, SY; Wang, XB; Xie, SS; Jiang, N; Wang, KD; Yao, HQ; Sun, HB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50441845 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50441845&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73354016 175454162 CHEMBL2436708 ZINC96285555 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51080482 Nc1ccc(cc1)-c1cc(=O)c2ccc(OCCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)cc2o1 InChI=1S/C38H43N5O3/c39-28-13-11-27(12-14-28)36-26-35(44)32-16-15-29(25-37(32)46-36)45-24-6-19-43-22-20-42(21-23-43)18-5-17-40-38-30-7-1-3-9-33(30)41-34-10-4-2-8-31(34)38/h1,3,7,9,11-16,25-26H,2,4-6,8,10,17-24,39H2,(H,40,41) SLPHCZJNVLGGEM-UHFFFAOYSA-N 50441846 CHEMBL2436707 Cholinesterase 685 ChEMBL 10.1016/j.ejmech.2013.09.024 10.7270/Q2BP048V 24095756 Li, SY; Wang, XB; Xie, SS; Jiang, N; Wang, KD; Yao, HQ; Sun, HB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50441846 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50441846&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73351052 175454163 CHEMBL2436707 ZINC96285556 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51080483 COc1ccc(cc1)-c1cc(=O)c2ccc(OCCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)cc2o1 InChI=1S/C39H44N4O4/c1-45-29-14-12-28(13-15-29)37-27-36(44)33-17-16-30(26-38(33)47-37)46-25-7-20-43-23-21-42(22-24-43)19-6-18-40-39-31-8-2-4-10-34(31)41-35-11-5-3-9-32(35)39/h2,4,8,10,12-17,26-27H,3,5-7,9,11,18-25H2,1H3,(H,40,41) FYFPJPCNMIMCSI-UHFFFAOYSA-N 50441847 CHEMBL2436706 Cholinesterase 655 ChEMBL 10.1016/j.ejmech.2013.09.024 10.7270/Q2BP048V 24095756 Li, SY; Wang, XB; Xie, SS; Jiang, N; Wang, KD; Yao, HQ; Sun, HB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50441847 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50441847&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73351051 175454164 CHEMBL2436706 ZINC96285557 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51080484 Cc1ccc(cc1)-c1cc(=O)c2ccc(OCCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)cc2o1 InChI=1S/C39H44N4O3/c1-28-12-14-29(15-13-28)37-27-36(44)33-17-16-30(26-38(33)46-37)45-25-7-20-43-23-21-42(22-24-43)19-6-18-40-39-31-8-2-4-10-34(31)41-35-11-5-3-9-32(35)39/h2,4,8,10,12-17,26-27H,3,5-7,9,11,18-25H2,1H3,(H,40,41) RQWXJZZQVBAPHB-UHFFFAOYSA-N 50441848 CHEMBL2436705 Cholinesterase 573 ChEMBL 10.1016/j.ejmech.2013.09.024 10.7270/Q2BP048V 24095756 Li, SY; Wang, XB; Xie, SS; Jiang, N; Wang, KD; Yao, HQ; Sun, HB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50441848 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50441848&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73346453 175454165 CHEMBL2436705 ZINC96285558 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51080485 COc1cc(OCCCN2CCN(CCCNc3c4CCCCc4nc4ccccc34)CC2)cc2oc(cc(=O)c12)-c1ccccc1 InChI=1S/C39H44N4O4/c1-45-36-25-29(26-37-38(36)34(44)27-35(47-37)28-11-3-2-4-12-28)46-24-10-19-43-22-20-42(21-23-43)18-9-17-40-39-30-13-5-7-15-32(30)41-33-16-8-6-14-31(33)39/h2-5,7,11-13,15,25-27H,6,8-10,14,16-24H2,1H3,(H,40,41) JBXYRSPJNIZSAT-UHFFFAOYSA-N 50441849 CHEMBL2436704 Cholinesterase 360 ChEMBL 10.1016/j.ejmech.2013.09.024 10.7270/Q2BP048V 24095756 Li, SY; Wang, XB; Xie, SS; Jiang, N; Wang, KD; Yao, HQ; Sun, HB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50441849 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50441849&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73347955 175454166 CHEMBL2436704 ZINC96285559 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51080486 Oc1cc(OCCCN2CCN(CCCNc3c4CCCCc4nc4ccccc34)CC2)cc2oc(cc(=O)c12)-c1ccccc1 InChI=1S/C38H42N4O4/c43-33-24-28(25-36-37(33)34(44)26-35(46-36)27-10-2-1-3-11-27)45-23-9-18-42-21-19-41(20-22-42)17-8-16-39-38-29-12-4-6-14-31(29)40-32-15-7-5-13-30(32)38/h1-4,6,10-12,14,24-26,43H,5,7-9,13,15-23H2,(H,39,40) VBAJECZQEAYMJO-UHFFFAOYSA-N 50441850 CHEMBL2436703 Cholinesterase 558 ChEMBL 10.1016/j.ejmech.2013.09.024 10.7270/Q2BP048V 24095756 Li, SY; Wang, XB; Xie, SS; Jiang, N; Wang, KD; Yao, HQ; Sun, HB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50441850 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50441850&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73357095 175454167 CHEMBL2436703 ZINC96285560 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51080487 O=c1cc(oc2cc(OCCCCCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)ccc12)-c1ccccc1 InChI=1S/C41H48N4O3/c46-38-30-39(31-13-4-3-5-14-31)48-40-29-32(19-20-35(38)40)47-28-11-2-1-10-22-44-24-26-45(27-25-44)23-12-21-42-41-33-15-6-8-17-36(33)43-37-18-9-7-16-34(37)41/h3-6,8,13-15,17,19-20,29-30H,1-2,7,9-12,16,18,21-28H2,(H,42,43) LESFBJPJZADQHL-UHFFFAOYSA-N 50441851 CHEMBL2436702 Cholinesterase 414 ChEMBL 10.1016/j.ejmech.2013.09.024 10.7270/Q2BP048V 24095756 Li, SY; Wang, XB; Xie, SS; Jiang, N; Wang, KD; Yao, HQ; Sun, HB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50441851 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50441851&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73351050 175454168 CHEMBL2436702 ZINC96285561 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51080488 O=c1cc(oc2cc(OCCCCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)ccc12)-c1ccccc1 InChI=1S/C40H46N4O3/c45-37-29-38(30-12-3-1-4-13-30)47-39-28-31(18-19-34(37)39)46-27-10-2-9-21-43-23-25-44(26-24-43)22-11-20-41-40-32-14-5-7-16-35(32)42-36-17-8-6-15-33(36)40/h1,3-5,7,12-14,16,18-19,28-29H,2,6,8-11,15,17,20-27H2,(H,41,42) DDOHQRNJXWAFAL-UHFFFAOYSA-N 50441852 CHEMBL2436701 Cholinesterase 423 ChEMBL 10.1016/j.ejmech.2013.09.024 10.7270/Q2BP048V 24095756 Li, SY; Wang, XB; Xie, SS; Jiang, N; Wang, KD; Yao, HQ; Sun, HB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50441852 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50441852&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73347954 175454169 CHEMBL2436701 ZINC96285562 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51080489 O=c1cc(oc2cc(OCCCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)ccc12)-c1ccccc1 InChI=1S/C39H44N4O3/c44-36-28-37(29-11-2-1-3-12-29)46-38-27-30(17-18-33(36)38)45-26-9-8-20-42-22-24-43(25-23-42)21-10-19-40-39-31-13-4-6-15-34(31)41-35-16-7-5-14-32(35)39/h1-4,6,11-13,15,17-18,27-28H,5,7-10,14,16,19-26H2,(H,40,41) NHRHUIFWROFHGI-UHFFFAOYSA-N 50441853 CHEMBL2436700 Cholinesterase 317 ChEMBL 10.1016/j.ejmech.2013.09.024 10.7270/Q2BP048V 24095756 Li, SY; Wang, XB; Xie, SS; Jiang, N; Wang, KD; Yao, HQ; Sun, HB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50441853 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50441853&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73346452 175454170 CHEMBL2436700 ZINC96285563 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51080490 O=c1cc(oc2cc(OCCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)ccc12)-c1ccccc1 InChI=1S/C38H42N4O3/c43-35-27-36(28-10-2-1-3-11-28)45-37-26-29(16-17-32(35)37)44-25-9-20-42-23-21-41(22-24-42)19-8-18-39-38-30-12-4-6-14-33(30)40-34-15-7-5-13-31(34)38/h1-4,6,10-12,14,16-17,26-27H,5,7-9,13,15,18-25H2,(H,39,40) DAQOTHBGIZARGM-UHFFFAOYSA-N 50441854 CHEMBL2436699 Cholinesterase 208 ChEMBL 10.1016/j.ejmech.2013.09.024 10.7270/Q2BP048V 24095756 Li, SY; Wang, XB; Xie, SS; Jiang, N; Wang, KD; Yao, HQ; Sun, HB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50441854 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50441854&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73352527 175454171 CHEMBL2436699 ZINC96285564 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51080491 O=c1cc(oc2cc(OCCN3CCN(CCCNc4c5CCCCc5nc5ccccc45)CC3)ccc12)-c1ccccc1 InChI=1S/C37H40N4O3/c42-34-26-35(27-9-2-1-3-10-27)44-36-25-28(15-16-31(34)36)43-24-23-41-21-19-40(20-22-41)18-8-17-38-37-29-11-4-6-13-32(29)39-33-14-7-5-12-30(33)37/h1-4,6,9-11,13,15-16,25-26H,5,7-8,12,14,17-24H2,(H,38,39) MDVLYACOLMKYAL-UHFFFAOYSA-N 50441855 CHEMBL2436698 Cholinesterase 266 ChEMBL 10.1016/j.ejmech.2013.09.024 10.7270/Q2BP048V 24095756 Li, SY; Wang, XB; Xie, SS; Jiang, N; Wang, KD; Yao, HQ; Sun, HB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50441855 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50441855&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73347953 175454172 CHEMBL2436698 ZINC96285565 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51080492 O=c1cc(oc2cc(OCCCCCCN3CCN(CCNc4c5CCCCc5nc5ccccc45)CC3)ccc12)-c1ccccc1 InChI=1S/C40H46N4O3/c45-37-29-38(30-12-4-3-5-13-30)47-39-28-31(18-19-34(37)39)46-27-11-2-1-10-21-43-23-25-44(26-24-43)22-20-41-40-32-14-6-8-16-35(32)42-36-17-9-7-15-33(36)40/h3-6,8,12-14,16,18-19,28-29H,1-2,7,9-11,15,17,20-27H2,(H,41,42) JBVVLTRVHVGZEU-UHFFFAOYSA-N 50441856 CHEMBL2436697 Cholinesterase 289 ChEMBL 10.1016/j.ejmech.2013.09.024 10.7270/Q2BP048V 24095756 Li, SY; Wang, XB; Xie, SS; Jiang, N; Wang, KD; Yao, HQ; Sun, HB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50441856 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50441856&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73351049 175454173 CHEMBL2436697 ZINC96285566 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51080493 O=c1cc(oc2cc(OCCCCCN3CCN(CCNc4c5CCCCc5nc5ccccc45)CC3)ccc12)-c1ccccc1 InChI=1S/C39H44N4O3/c44-36-28-37(29-11-3-1-4-12-29)46-38-27-30(17-18-33(36)38)45-26-10-2-9-20-42-22-24-43(25-23-42)21-19-40-39-31-13-5-7-15-34(31)41-35-16-8-6-14-32(35)39/h1,3-5,7,11-13,15,17-18,27-28H,2,6,8-10,14,16,19-26H2,(H,40,41) NYSKQVVKHYVKTB-UHFFFAOYSA-N 50441857 CHEMBL2436696 Cholinesterase 258 ChEMBL 10.1016/j.ejmech.2013.09.024 10.7270/Q2BP048V 24095756 Li, SY; Wang, XB; Xie, SS; Jiang, N; Wang, KD; Yao, HQ; Sun, HB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50441857 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50441857&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73355548 175454174 CHEMBL2436696 ZINC96285567 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51080494 O=c1cc(oc2cc(OCCCCN3CCN(CCNc4c5CCCCc5nc5ccccc45)CC3)ccc12)-c1ccccc1 InChI=1S/C38H42N4O3/c43-35-27-36(28-10-2-1-3-11-28)45-37-26-29(16-17-32(35)37)44-25-9-8-19-41-21-23-42(24-22-41)20-18-39-38-30-12-4-6-14-33(30)40-34-15-7-5-13-31(34)38/h1-4,6,10-12,14,16-17,26-27H,5,7-9,13,15,18-25H2,(H,39,40) PGHRDQIVQWNEGD-UHFFFAOYSA-N 50441858 CHEMBL2436695 Cholinesterase 197 ChEMBL 10.1016/j.ejmech.2013.09.024 10.7270/Q2BP048V 24095756 Li, SY; Wang, XB; Xie, SS; Jiang, N; Wang, KD; Yao, HQ; Sun, HB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50441858 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50441858&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73355547 175454175 CHEMBL2436695 ZINC96285568 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51080495 O=c1cc(oc2cc(OCCCN3CCN(CCNc4c5CCCCc5nc5ccccc45)CC3)ccc12)-c1ccccc1 InChI=1S/C37H40N4O3/c42-34-26-35(27-9-2-1-3-10-27)44-36-25-28(15-16-31(34)36)43-24-8-18-40-20-22-41(23-21-40)19-17-38-37-29-11-4-6-13-32(29)39-33-14-7-5-12-30(33)37/h1-4,6,9-11,13,15-16,25-26H,5,7-8,12,14,17-24H2,(H,38,39) PDCBHYYTMYMYBE-UHFFFAOYSA-N 50441859 CHEMBL2436694 Cholinesterase 311 ChEMBL 10.1016/j.ejmech.2013.09.024 10.7270/Q2BP048V 24095756 Li, SY; Wang, XB; Xie, SS; Jiang, N; Wang, KD; Yao, HQ; Sun, HB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50441859 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50441859&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73351048 175454176 CHEMBL2436694 ZINC96285569 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51080496 O=c1cc(oc2cc(OCCN3CCN(CCNc4c5CCCCc5nc5ccccc45)CC3)ccc12)-c1ccccc1 InChI=1S/C36H38N4O3/c41-33-25-34(26-8-2-1-3-9-26)43-35-24-27(14-15-30(33)35)42-23-22-40-20-18-39(19-21-40)17-16-37-36-28-10-4-6-12-31(28)38-32-13-7-5-11-29(32)36/h1-4,6,8-10,12,14-15,24-25H,5,7,11,13,16-23H2,(H,37,38) OXTPOGAMUKLJIJ-UHFFFAOYSA-N 50441860 CHEMBL2436693 Cholinesterase 520 ChEMBL 10.1016/j.ejmech.2013.09.024 10.7270/Q2BP048V 24095756 Li, SY; Wang, XB; Xie, SS; Jiang, N; Wang, KD; Yao, HQ; Sun, HB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50441860 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50441860&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73357094 175454177 CHEMBL2436693 ZINC96285570 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51080497 Oc1ccc2c(c1)oc(cc2=O)-c1ccccc1 InChI=1S/C15H10O3/c16-11-6-7-12-13(17)9-14(18-15(12)8-11)10-4-2-1-3-5-10/h1-9,16H MQGPSCMMNJKMHQ-UHFFFAOYSA-N 26664 7-Hydroxy-flavone, 5a::7-Hydroxyflavone, 11::7-hydroxy-2-phenyl-4H-chromen-4-one::7-hydroxyflavone::CHEMBL276915 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2013.09.024 10.7270/Q2BP048V 24095756 Li, SY; Wang, XB; Xie, SS; Jiang, N; Wang, KD; Yao, HQ; Sun, HB; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=26664 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=26664&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5281894 57298376 CHEMBL276915 C11264 ZINC05934541 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51085791 C(CCCNc1c2CCCCc2nc2ccccc12)CCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C33H40N4/c1(2-12-22-34-32-24-14-4-8-18-28(24)36-29-19-9-5-15-25(29)32)3-13-23-35-33-26-16-6-10-20-30(26)37-31-21-11-7-17-27(31)33/h4,6,8,10,14,16,18,20H,1-3,5,7,9,11-13,15,17,19,21-23H2,(H,34,36)(H,35,37) ITZOKHKOFJOBFS-UHFFFAOYSA-N 8963 CHEMBL32823::Homodimeric Tacrine Analog 3b::N-[7-(1,2,3,4-tetrahydroacridin-9-ylamino)heptyl]-1,2,3,4-tetrahydroacridin-9-amine::Tacrine Dimer 3b::Tacrine-Based Inhibitor 2f::tacrine homobivalent compound 3a Cholinesterase 4.1 ChEMBL 10.1016/j.bmcl.2013.10.034 10.7270/Q2WQ058K 24220172 Mao, F; Chen, J; Zhou, Q; Luo, Z; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8963 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8963&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search AA7 2CKM,5EI5 9549196 46509739 CHEMBL32823 ZINC01893945 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51085792 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 16 ChEMBL 10.1016/j.bmcl.2013.10.034 10.7270/Q2WQ058K 24220172 Mao, F; Chen, J; Zhou, Q; Luo, Z; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51085793 COc1cc2[se]n(CCCCCCNc3c4CCCCc4nc4ccccc34)c(=O)c2cc1OC InChI=1S/C28H33N3O3Se/c1-33-24-17-21-26(18-25(24)34-2)35-31(28(21)32)16-10-4-3-9-15-29-27-19-11-5-7-13-22(19)30-23-14-8-6-12-20(23)27/h5,7,11,13,17-18H,3-4,6,8-10,12,14-16H2,1-2H3,(H,29,30) BGIOOSDXZCNZQT-UHFFFAOYSA-N 50444286 CHEMBL3093791 Cholinesterase 2.8 ChEMBL 10.1016/j.bmcl.2013.10.034 10.7270/Q2WQ058K 24220172 Mao, F; Chen, J; Zhou, Q; Luo, Z; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50444286 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50444286&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72724703 194942182 CHEMBL3093791 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51085794 O=c1n(CCCCCCCCCNc2c3CCCCc3nc3ccccc23)[se]c2ccccc12 InChI=1S/C29H35N3OSe/c33-29-24-16-8-11-19-27(24)34-32(29)21-13-5-3-1-2-4-12-20-30-28-22-14-6-9-17-25(22)31-26-18-10-7-15-23(26)28/h6,8-9,11,14,16-17,19H,1-5,7,10,12-13,15,18,20-21H2,(H,30,31) AQSLVOOUMIOXQV-UHFFFAOYSA-N 50444287 CHEMBL3093790 Cholinesterase 26 ChEMBL 10.1016/j.bmcl.2013.10.034 10.7270/Q2WQ058K 24220172 Mao, F; Chen, J; Zhou, Q; Luo, Z; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50444287 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50444287&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72724702 194942183 CHEMBL3093790 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51085795 O=c1n(CCCCCCCCNc2c3CCCCc3nc3ccccc23)[se]c2ccccc12 InChI=1S/C28H33N3OSe/c32-28-23-15-7-10-18-26(23)33-31(28)20-12-4-2-1-3-11-19-29-27-21-13-5-8-16-24(21)30-25-17-9-6-14-22(25)27/h5,7-8,10,13,15-16,18H,1-4,6,9,11-12,14,17,19-20H2,(H,29,30) LSPCUCAOBXWPQX-UHFFFAOYSA-N 50444288 CHEMBL3093789 Cholinesterase 17 ChEMBL 10.1016/j.bmcl.2013.10.034 10.7270/Q2WQ058K 24220172 Mao, F; Chen, J; Zhou, Q; Luo, Z; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50444288 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50444288&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72724701 194942184 CHEMBL3093789 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51085796 O=c1n(CCCCCCCNc2c3CCCCc3nc3ccccc23)[se]c2ccccc12 InChI=1S/C27H31N3OSe/c31-27-22-14-6-9-17-25(22)32-30(27)19-11-3-1-2-10-18-28-26-20-12-4-7-15-23(20)29-24-16-8-5-13-21(24)26/h4,6-7,9,12,14-15,17H,1-3,5,8,10-11,13,16,18-19H2,(H,28,29) DGOQVQGFMHBPPZ-UHFFFAOYSA-N 50444289 CHEMBL3093788 Cholinesterase 14 ChEMBL 10.1016/j.bmcl.2013.10.034 10.7270/Q2WQ058K 24220172 Mao, F; Chen, J; Zhou, Q; Luo, Z; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50444289 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50444289&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72724700 194942185 CHEMBL3093788 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51085797 O=c1n(CCCCCCNc2c3CCCCc3nc3ccccc23)[se]c2ccccc12 InChI=1S/C26H29N3OSe/c30-26-21-13-5-8-16-24(21)31-29(26)18-10-2-1-9-17-27-25-19-11-3-6-14-22(19)28-23-15-7-4-12-20(23)25/h3,5-6,8,11,13-14,16H,1-2,4,7,9-10,12,15,17-18H2,(H,27,28) NAKZJQSHDVVYBW-UHFFFAOYSA-N 50444290 CHEMBL3093787 Cholinesterase 4.4 ChEMBL 10.1016/j.bmcl.2013.10.034 10.7270/Q2WQ058K 24220172 Mao, F; Chen, J; Zhou, Q; Luo, Z; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50444290 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50444290&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72725625 194942186 CHEMBL3093787 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51085798 O=c1n(CCCCCNc2c3CCCCc3nc3ccccc23)[se]c2ccccc12 InChI=1S/C25H27N3OSe/c29-25-20-12-4-7-15-23(20)30-28(25)17-9-1-8-16-26-24-18-10-2-5-13-21(18)27-22-14-6-3-11-19(22)24/h2,4-5,7,10,12-13,15H,1,3,6,8-9,11,14,16-17H2,(H,26,27) CKRCLJQAERZABG-UHFFFAOYSA-N 50444291 CHEMBL3093786 Cholinesterase 4.5 ChEMBL 10.1016/j.bmcl.2013.10.034 10.7270/Q2WQ058K 24220172 Mao, F; Chen, J; Zhou, Q; Luo, Z; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50444291 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50444291&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72725624 194942187 CHEMBL3093786 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51085799 O=c1n(CCCCNc2c3CCCCc3nc3ccccc23)[se]c2ccccc12 InChI=1S/C24H25N3OSe/c28-24-19-11-3-6-14-22(19)29-27(24)16-8-7-15-25-23-17-9-1-4-12-20(17)26-21-13-5-2-10-18(21)23/h1,3-4,6,9,11-12,14H,2,5,7-8,10,13,15-16H2,(H,25,26) ZHNPSCBRTVYPSQ-UHFFFAOYSA-N 50444292 CHEMBL3093785 Cholinesterase 4.9 ChEMBL 10.1016/j.bmcl.2013.10.034 10.7270/Q2WQ058K 24220172 Mao, F; Chen, J; Zhou, Q; Luo, Z; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50444292 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50444292&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72725623 194942188 CHEMBL3093785 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51085800 O=c1n(CCCNc2c3CCCCc3nc3ccccc23)[se]c2ccccc12 InChI=1S/C23H23N3OSe/c27-23-18-10-3-6-13-21(18)28-26(23)15-7-14-24-22-16-8-1-4-11-19(16)25-20-12-5-2-9-17(20)22/h1,3-4,6,8,10-11,13H,2,5,7,9,12,14-15H2,(H,24,25) RIBQYGMQWSMLSJ-UHFFFAOYSA-N 50444293 CHEMBL3093793 Cholinesterase 29 ChEMBL 10.1016/j.bmcl.2013.10.034 10.7270/Q2WQ058K 24220172 Mao, F; Chen, J; Zhou, Q; Luo, Z; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50444293 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50444293&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72725622 194942189 CHEMBL3093793 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51085801 O=c1n(CCNc2c3CCCCc3nc3ccccc23)[se]c2ccccc12 InChI=1S/C22H21N3OSe/c26-22-17-9-3-6-12-20(17)27-25(22)14-13-23-21-15-7-1-4-10-18(15)24-19-11-5-2-8-16(19)21/h1,3-4,6-7,9-10,12H,2,5,8,11,13-14H2,(H,23,24) RZHHVUDTXZGPLD-UHFFFAOYSA-N 50444294 CHEMBL3093792 Cholinesterase 39 ChEMBL 10.1016/j.bmcl.2013.10.034 10.7270/Q2WQ058K 24220172 Mao, F; Chen, J; Zhou, Q; Luo, Z; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50444294 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50444294&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72725621 194942190 CHEMBL3093792 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50981860 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 5380 ChEMBL 10.1016/j.bmc.2012.08.052 10.7270/Q2SQ91J0 23140986 Alipour, M; Khoobi, M; Foroumadi, A; Nadri, H; Moradi, A; Sakhteman, A; Ghandi, M; Shafiee, A University College of Science http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50981861 Fc1ccc(C[n+]2ccc(\C=C\C(=O)c3cc4cc(Br)ccc4oc3=O)cc2)cc1 InChI=1S/C24H16BrFNO3/c25-19-4-8-23-18(13-19)14-21(24(29)30-23)22(28)7-3-16-9-11-27(12-10-16)15-17-1-5-20(26)6-2-17/h1-14H,15H2/q+1/b7-3+ LJNSOKMCYGFHKC-XVNBXDOJSA-N 50402576 CHEMBL2206130 Cholinesterase 494 ChEMBL 10.1016/j.bmc.2012.08.052 10.7270/Q2SQ91J0 23140986 Alipour, M; Khoobi, M; Foroumadi, A; Nadri, H; Moradi, A; Sakhteman, A; Ghandi, M; Shafiee, A University College of Science http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50402576 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50402576&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71457732 163351600 CHEMBL2206130 ZINC95563113 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50981862 Fc1ccccc1C[n+]1ccc(\C=C\C(=O)c2cc3cc(Br)ccc3oc2=O)cc1 InChI=1S/C24H16BrFNO3/c25-19-6-8-23-18(13-19)14-20(24(29)30-23)22(28)7-5-16-9-11-27(12-10-16)15-17-3-1-2-4-21(17)26/h1-14H,15H2/q+1/b7-5+ QORNFJYUWRABGN-FNORWQNLSA-N 50402577 CHEMBL2206129 Cholinesterase 489 ChEMBL 10.1016/j.bmc.2012.08.052 10.7270/Q2SQ91J0 23140986 Alipour, M; Khoobi, M; Foroumadi, A; Nadri, H; Moradi, A; Sakhteman, A; Ghandi, M; Shafiee, A University College of Science http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50402577 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50402577&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71454189 163351601 CHEMBL2206129 ZINC95561696 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50981863 COc1ccc(C[n+]2ccc(\C=C\C(=O)c3cc4cccc(OC)c4oc3=O)cc2)cc1 InChI=1S/C26H22NO5/c1-30-21-9-6-19(7-10-21)17-27-14-12-18(13-15-27)8-11-23(28)22-16-20-4-3-5-24(31-2)25(20)32-26(22)29/h3-16H,17H2,1-2H3/q+1/b11-8+ NRPFOQIIXRRGLP-DHZHZOJOSA-N 50402578 CHEMBL2206128 Cholinesterase 971 ChEMBL 10.1016/j.bmc.2012.08.052 10.7270/Q2SQ91J0 23140986 Alipour, M; Khoobi, M; Foroumadi, A; Nadri, H; Moradi, A; Sakhteman, A; Ghandi, M; Shafiee, A University College of Science http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50402578 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50402578&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71457730 163351602 CHEMBL2206128 ZINC95558672 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50981864 COc1cccc2cc(C(=O)\C=C\c3cc[n+](Cc4ccc(CCl)cc4)cc3)c(=O)oc12 InChI=1S/C26H21ClNO4/c1-31-24-4-2-3-21-15-22(26(30)32-25(21)24)23(29)10-9-18-11-13-28(14-12-18)17-20-7-5-19(16-27)6-8-20/h2-15H,16-17H2,1H3/q+1/b10-9+ VGHADGWAQLQJMZ-MDZDMXLPSA-N 50402579 CHEMBL2206127 Cholinesterase 15100 ChEMBL 10.1016/j.bmc.2012.08.052 10.7270/Q2SQ91J0 23140986 Alipour, M; Khoobi, M; Foroumadi, A; Nadri, H; Moradi, A; Sakhteman, A; Ghandi, M; Shafiee, A University College of Science http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50402579 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50402579&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71455929 163351603 CHEMBL2206127 ZINC95562674 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50981865 COc1cccc2cc(C(=O)\C=C\c3cc[n+](Cc4cccc(c4)C#N)cc3)c(=O)oc12 InChI=1S/C26H19N2O4/c1-31-24-7-3-6-21-15-22(26(30)32-25(21)24)23(29)9-8-18-10-12-28(13-11-18)17-20-5-2-4-19(14-20)16-27/h2-15H,17H2,1H3/q+1/b9-8+ NWIVALXPUXDWHP-CMDGGOBGSA-N 50402580 CHEMBL2206126 Cholinesterase 1000 ChEMBL 10.1016/j.bmc.2012.08.052 10.7270/Q2SQ91J0 23140986 Alipour, M; Khoobi, M; Foroumadi, A; Nadri, H; Moradi, A; Sakhteman, A; Ghandi, M; Shafiee, A University College of Science http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50402580 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50402580&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71450587 163351604 CHEMBL2206126 ZINC95560612 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50981866 COc1cccc2cc(C(=O)\C=C\c3cc[n+](Cc4ccc(C)cc4)cc3)c(=O)oc12 InChI=1S/C26H22NO4/c1-18-6-8-20(9-7-18)17-27-14-12-19(13-15-27)10-11-23(28)22-16-21-4-3-5-24(30-2)25(21)31-26(22)29/h3-16H,17H2,1-2H3/q+1/b11-10+ MTEXIDFMXDWASY-ZHACJKMWSA-N 50402581 CHEMBL2206125 Cholinesterase 27000 ChEMBL 10.1016/j.bmc.2012.08.052 10.7270/Q2SQ91J0 23140986 Alipour, M; Khoobi, M; Foroumadi, A; Nadri, H; Moradi, A; Sakhteman, A; Ghandi, M; Shafiee, A University College of Science http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50402581 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50402581&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71463094 163351605 CHEMBL2206125 ZINC95558481 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50981867 COc1cccc2cc(C(=O)\C=C\c3cc[n+](Cc4cccc(C)c4)cc3)c(=O)oc12 InChI=1S/C26H22NO4/c1-18-5-3-6-20(15-18)17-27-13-11-19(12-14-27)9-10-23(28)22-16-21-7-4-8-24(30-2)25(21)31-26(22)29/h3-16H,17H2,1-2H3/q+1/b10-9+ GQJQZYCUQODVAR-MDZDMXLPSA-N 50402582 CHEMBL2206124 Cholinesterase 11200 ChEMBL 10.1016/j.bmc.2012.08.052 10.7270/Q2SQ91J0 23140986 Alipour, M; Khoobi, M; Foroumadi, A; Nadri, H; Moradi, A; Sakhteman, A; Ghandi, M; Shafiee, A University College of Science http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50402582 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50402582&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71454187 163351606 CHEMBL2206124 ZINC95560320 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50981868 COc1cccc2cc(C(=O)\C=C\c3cc[n+](Cc4ccccc4C)cc3)c(=O)oc12 InChI=1S/C26H22NO4/c1-18-6-3-4-7-21(18)17-27-14-12-19(13-15-27)10-11-23(28)22-16-20-8-5-9-24(30-2)25(20)31-26(22)29/h3-16H,17H2,1-2H3/q+1/b11-10+ VZOIQDDBKBLHAD-ZHACJKMWSA-N 50402583 CHEMBL2206123 Cholinesterase 342 ChEMBL 10.1016/j.bmc.2012.08.052 10.7270/Q2SQ91J0 23140986 Alipour, M; Khoobi, M; Foroumadi, A; Nadri, H; Moradi, A; Sakhteman, A; Ghandi, M; Shafiee, A University College of Science http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50402583 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50402583&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71459638 163351607 CHEMBL2206123 ZINC95560979 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50981869 COc1cccc2cc(C(=O)\C=C\c3cc[n+](Cc4ccc(Cl)c(Cl)c4)cc3)c(=O)oc12 InChI=1S/C25H18Cl2NO4/c1-31-23-4-2-3-18-14-19(25(30)32-24(18)23)22(29)8-6-16-9-11-28(12-10-16)15-17-5-7-20(26)21(27)13-17/h2-14H,15H2,1H3/q+1/b8-6+ MBQJCZNIECHMGI-SOFGYWHQSA-N 50402584 CHEMBL2206122 Cholinesterase 5790 ChEMBL 10.1016/j.bmc.2012.08.052 10.7270/Q2SQ91J0 23140986 Alipour, M; Khoobi, M; Foroumadi, A; Nadri, H; Moradi, A; Sakhteman, A; Ghandi, M; Shafiee, A University College of Science http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50402584 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50402584&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71452421 163351608 CHEMBL2206122 ZINC95563465 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50981870 COc1cccc2cc(C(=O)\C=C\c3cc[n+](Cc4cccc(Cl)c4Cl)cc3)c(=O)oc12 InChI=1S/C25H18Cl2NO4/c1-31-22-7-3-4-17-14-19(25(30)32-24(17)22)21(29)9-8-16-10-12-28(13-11-16)15-18-5-2-6-20(26)23(18)27/h2-14H,15H2,1H3/q+1/b9-8+ FQSJWFBWGRXAMA-CMDGGOBGSA-N 50402585 CHEMBL2206121 Cholinesterase 6800 ChEMBL 10.1016/j.bmc.2012.08.052 10.7270/Q2SQ91J0 23140986 Alipour, M; Khoobi, M; Foroumadi, A; Nadri, H; Moradi, A; Sakhteman, A; Ghandi, M; Shafiee, A University College of Science http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50402585 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50402585&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71459636 163351609 CHEMBL2206121 ZINC95558971 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50981871 COc1cccc2cc(C(=O)\C=C\c3cc[n+](Cc4cccc(Cl)c4)cc3)c(=O)oc12 InChI=1S/C25H19ClNO4/c1-30-23-7-3-5-19-15-21(25(29)31-24(19)23)22(28)9-8-17-10-12-27(13-11-17)16-18-4-2-6-20(26)14-18/h2-15H,16H2,1H3/q+1/b9-8+ MDJFHQVVVASRSZ-CMDGGOBGSA-N 50402586 CHEMBL2206120 Cholinesterase 560 ChEMBL 10.1016/j.bmc.2012.08.052 10.7270/Q2SQ91J0 23140986 Alipour, M; Khoobi, M; Foroumadi, A; Nadri, H; Moradi, A; Sakhteman, A; Ghandi, M; Shafiee, A University College of Science http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50402586 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50402586&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71450585 163351610 CHEMBL2206120 ZINC95563841 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50981872 COc1cccc2cc(C(=O)\C=C\c3cc[n+](Cc4ccccc4Cl)cc3)c(=O)oc12 InChI=1S/C25H19ClNO4/c1-30-23-8-4-6-18-15-20(25(29)31-24(18)23)22(28)10-9-17-11-13-27(14-12-17)16-19-5-2-3-7-21(19)26/h2-15H,16H2,1H3/q+1/b10-9+ ZFQHYPWXOZXJOE-MDZDMXLPSA-N 50402587 CHEMBL2206119 Cholinesterase 125 ChEMBL 10.1016/j.bmc.2012.08.052 10.7270/Q2SQ91J0 23140986 Alipour, M; Khoobi, M; Foroumadi, A; Nadri, H; Moradi, A; Sakhteman, A; Ghandi, M; Shafiee, A University College of Science http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50402587 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50402587&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71450583 163351611 CHEMBL2206119 ZINC95560639 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50981873 COc1cccc2cc(C(=O)\C=C\c3cc[n+](Cc4c(F)cccc4[N+]([O-])=O)cc3)c(=O)oc12 InChI=1S/C25H18FN2O6/c1-33-23-7-2-4-17-14-18(25(30)34-24(17)23)22(29)9-8-16-10-12-27(13-11-16)15-19-20(26)5-3-6-21(19)28(31)32/h2-14H,15H2,1H3/q+1/b9-8+ UMUPNRXVXSSMDI-CMDGGOBGSA-N 50402588 CHEMBL2206118 Cholinesterase 685 ChEMBL 10.1016/j.bmc.2012.08.052 10.7270/Q2SQ91J0 23140986 Alipour, M; Khoobi, M; Foroumadi, A; Nadri, H; Moradi, A; Sakhteman, A; Ghandi, M; Shafiee, A University College of Science http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50402588 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50402588&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71457728 163351612 CHEMBL2206118 ZINC95561104 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50981874 COc1cccc2cc(C(=O)\C=C\c3cc[n+](Cc4ccc(F)cc4)cc3)c(=O)oc12 InChI=1S/C25H19FNO4/c1-30-23-4-2-3-19-15-21(25(29)31-24(19)23)22(28)10-7-17-11-13-27(14-12-17)16-18-5-8-20(26)9-6-18/h2-15H,16H2,1H3/q+1/b10-7+ QOBPRMLBOMZARO-JXMROGBWSA-N 50402589 CHEMBL2205577 Cholinesterase 931 ChEMBL 10.1016/j.bmc.2012.08.052 10.7270/Q2SQ91J0 23140986 Alipour, M; Khoobi, M; Foroumadi, A; Nadri, H; Moradi, A; Sakhteman, A; Ghandi, M; Shafiee, A University College of Science http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50402589 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50402589&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71450515 163351613 CHEMBL2205577 ZINC95559454 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50981875 COc1cccc2cc(C(=O)\C=C\c3cc[n+](Cc4cccc(F)c4)cc3)c(=O)oc12 InChI=1S/C25H19FNO4/c1-30-23-7-3-5-19-15-21(25(29)31-24(19)23)22(28)9-8-17-10-12-27(13-11-17)16-18-4-2-6-20(26)14-18/h2-15H,16H2,1H3/q+1/b9-8+ ADCUEIMTHWIRPV-CMDGGOBGSA-N 50402590 CHEMBL2205576 Cholinesterase 2100 ChEMBL 10.1016/j.bmc.2012.08.052 10.7270/Q2SQ91J0 23140986 Alipour, M; Khoobi, M; Foroumadi, A; Nadri, H; Moradi, A; Sakhteman, A; Ghandi, M; Shafiee, A University College of Science http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50402590 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50402590&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71452367 163351614 CHEMBL2205576 ZINC95561871 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50981876 COc1cccc2cc(C(=O)\C=C\c3cc[n+](Cc4ccccc4F)cc3)c(=O)oc12 InChI=1S/C25H19FNO4/c1-30-23-8-4-6-18-15-20(25(29)31-24(18)23)22(28)10-9-17-11-13-27(14-12-17)16-19-5-2-3-7-21(19)26/h2-15H,16H2,1H3/q+1/b10-9+ DBAJLGFEYKGXEK-MDZDMXLPSA-N 50402591 CHEMBL2205575 Cholinesterase 329 ChEMBL 10.1016/j.bmc.2012.08.052 10.7270/Q2SQ91J0 23140986 Alipour, M; Khoobi, M; Foroumadi, A; Nadri, H; Moradi, A; Sakhteman, A; Ghandi, M; Shafiee, A University College of Science http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50402591 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50402591&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71455874 163351615 CHEMBL2205575 ZINC95561487 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50981877 Fc1ccc(C[n+]2ccc(\C=C\C(=O)c3cc4ccccc4oc3=O)cc2)cc1 InChI=1S/C24H17FNO3/c25-20-8-5-18(6-9-20)16-26-13-11-17(12-14-26)7-10-22(27)21-15-19-3-1-2-4-23(19)29-24(21)28/h1-15H,16H2/q+1/b10-7+ COYYPMBTZNLQNZ-JXMROGBWSA-N 50402592 CHEMBL2205574 Cholinesterase 910 ChEMBL 10.1016/j.bmc.2012.08.052 10.7270/Q2SQ91J0 23140986 Alipour, M; Khoobi, M; Foroumadi, A; Nadri, H; Moradi, A; Sakhteman, A; Ghandi, M; Shafiee, A University College of Science http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50402592 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50402592&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71452365 163351616 CHEMBL2205574 ZINC95558903 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50981878 Fc1ccccc1C[n+]1ccc(\C=C\C(=O)c2cc3ccccc3oc2=O)cc1 InChI=1S/C24H17FNO3/c25-21-7-3-1-6-19(21)16-26-13-11-17(12-14-26)9-10-22(27)20-15-18-5-2-4-8-23(18)29-24(20)28/h1-15H,16H2/q+1/b10-9+ AUZHLZDHUNJGJP-MDZDMXLPSA-N 50402593 CHEMBL2205573 Cholinesterase 848 ChEMBL 10.1016/j.bmc.2012.08.052 10.7270/Q2SQ91J0 23140986 Alipour, M; Khoobi, M; Foroumadi, A; Nadri, H; Moradi, A; Sakhteman, A; Ghandi, M; Shafiee, A University College of Science http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50402593 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50402593&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71452363 163351617 CHEMBL2205573 ZINC95559827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50978211 NCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C19H27N3/c20-13-7-1-2-8-14-21-19-15-9-3-5-11-17(15)22-18-12-6-4-10-16(18)19/h3,5,9,11H,1-2,4,6-8,10,12-14,20H2,(H,21,22) VDSDQAGBQNPBFH-UHFFFAOYSA-N 50396135 CHEMBL2171328 Cholinesterase 2 ChEMBL 10.1021/jm300246n 10.7270/Q2X06868 22624880 Chen, X; Zenger, K; Lupp, A; Kling, B; Heilmann, J; Fleck, C; Kraus, B; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396135 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396135&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11645075 163345159 CHEMBL2171328 ZINC35994946 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50978212 NCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C19H27N3/c20-13-7-1-2-8-14-21-19-15-9-3-5-11-17(15)22-18-12-6-4-10-16(18)19/h3,5,9,11H,1-2,4,6-8,10,12-14,20H2,(H,21,22) VDSDQAGBQNPBFH-UHFFFAOYSA-N 50396135 CHEMBL2171328 Cholinesterase 2.04 ChEMBL 10.1021/jm300246n 10.7270/Q2X06868 22624880 Chen, X; Zenger, K; Lupp, A; Kling, B; Heilmann, J; Fleck, C; Kraus, B; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50396135 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50396135&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11645075 163345159 CHEMBL2171328 ZINC35994946 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50978213 OC(=O)CCC(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C23H31N3O3/c27-21(13-14-22(28)29)24-15-7-1-2-8-16-25-23-17-9-3-5-11-19(17)26-20-12-6-4-10-18(20)23/h3,5,9,11H,1-2,4,6-8,10,12-16H2,(H,24,27)(H,25,26)(H,28,29) YFQNCPFXYSSUEF-UHFFFAOYSA-N 50401096 CHEMBL2204448 Cholinesterase 361.3 ChEMBL 10.1021/jm300246n 10.7270/Q2X06868 22624880 Chen, X; Zenger, K; Lupp, A; Kling, B; Heilmann, J; Fleck, C; Kraus, B; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50401096 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50401096&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71462951 163350120 CHEMBL2204448 ZINC95564320 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50978214 OC(=O)CCC(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C23H31N3O3/c27-21(13-14-22(28)29)24-15-7-1-2-8-16-25-23-17-9-3-5-11-19(17)26-20-12-6-4-10-18(20)23/h3,5,9,11H,1-2,4,6-8,10,12-16H2,(H,24,27)(H,25,26)(H,28,29) YFQNCPFXYSSUEF-UHFFFAOYSA-N 50401096 CHEMBL2204448 Cholinesterase 363.08 ChEMBL 10.1021/jm300246n 10.7270/Q2X06868 22624880 Chen, X; Zenger, K; Lupp, A; Kling, B; Heilmann, J; Fleck, C; Kraus, B; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50401096 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50401096&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71462951 163350120 CHEMBL2204448 ZINC95564320 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50978215 COc1cc(ccc1O)[C@@H]1Oc2cc(ccc2O[C@H]1COC(=O)CCC(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12)[C@H]1Oc2cc(O)cc(O)c2C(O)C1=O InChI=1S/C48H51N3O12/c1-59-37-22-27(14-16-34(37)53)47-40(61-36-17-15-28(23-38(36)62-47)48-46(58)45(57)43-35(54)24-29(52)25-39(43)63-48)26-60-42(56)19-18-41(55)49-20-8-2-3-9-21-50-44-30-10-4-6-12-32(30)51-33-13-7-5-11-31(33)44/h4,6,10,12,14-17,22-25,40,45,47-48,52-54,57H,2-3,5,7-9,11,13,18-21,26H2,1H3,(H,49,55)(H,50,51)/t40-,45?,47-,48+/m0/s1 IOTRVAALHUOPTG-OUBBASQLSA-N 50401095 CHEMBL2204447 Cholinesterase 49.7 ChEMBL 10.1021/jm300246n 10.7270/Q2X06868 22624880 Chen, X; Zenger, K; Lupp, A; Kling, B; Heilmann, J; Fleck, C; Kraus, B; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50401095 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50401095&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91928429 163350119 CHEMBL2204447 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50978216 COc1cc(ccc1O)[C@@H]1Oc2cc(ccc2O[C@H]1COC(=O)CCC(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12)[C@H]1Oc2cc(O)cc(O)c2C(O)C1=O InChI=1S/C48H51N3O12/c1-59-37-22-27(14-16-34(37)53)47-40(61-36-17-15-28(23-38(36)62-47)48-46(58)45(57)43-35(54)24-29(52)25-39(43)63-48)26-60-42(56)19-18-41(55)49-20-8-2-3-9-21-50-44-30-10-4-6-12-32(30)51-33-13-7-5-11-31(33)44/h4,6,10,12,14-17,22-25,40,45,47-48,52-54,57H,2-3,5,7-9,11,13,18-21,26H2,1H3,(H,49,55)(H,50,51)/t40-,45?,47-,48+/m0/s1 IOTRVAALHUOPTG-OUBBASQLSA-N 50401095 CHEMBL2204447 Cholinesterase 50.12 ChEMBL 10.1021/jm300246n 10.7270/Q2X06868 22624880 Chen, X; Zenger, K; Lupp, A; Kling, B; Heilmann, J; Fleck, C; Kraus, B; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50401095 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50401095&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91928429 163350119 CHEMBL2204447 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50978217 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 5.13 ChEMBL 10.1021/jm300246n 10.7270/Q2X06868 22624880 Chen, X; Zenger, K; Lupp, A; Kling, B; Heilmann, J; Fleck, C; Kraus, B; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50978218 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 3.2 ChEMBL 10.1021/jm300246n 10.7270/Q2X06868 22624880 Chen, X; Zenger, K; Lupp, A; Kling, B; Heilmann, J; Fleck, C; Kraus, B; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51053803 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 7520 ChEMBL 10.1016/j.ejmech.2012.12.060 10.7270/Q27S7Q4V 23376249 Skrzypek, A; Matysiak, J; Niewiadomy, A; Bajda, M; Szymanski, P University of Life Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51053804 CN(C)C(=O)Oc1cccc(c1)[N+](C)(C)C InChI=1S/C12H19N2O2/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5/h6-9H,1-5H3/q+1 ALWKGYPQUAPLQC-UHFFFAOYSA-N 50022775 (m-Hydroxyphenyl)trimethylammonium dimethylcarbamate::3-Trimethylammoniumphenyl N,N-dimethylcarbamate::3-[(dimethylcarbamoyl)oxy]-N,N,N-trimethylanilinium::CHEMBL211471::CHEMBL278020::Eustigmin::Eustigmine::NEOSTIGMINE::Neostigmine (2)::Prostigmine::Vagostigmine::m-Trimethylammoniumphenyldimethylcarbamate Cholinesterase 70 ChEMBL 10.1016/j.ejmech.2012.12.060 10.7270/Q27S7Q4V 23376249 Skrzypek, A; Matysiak, J; Niewiadomy, A; Bajda, M; Szymanski, P University of Life Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50022775 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50022775&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 4456 103933337 7514 CHEMBL278020CHEMBL211471 DB01400 C08200 ZINC00001792 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51053805 Cc1cc(ccc1[N+]([O-])=O)-c1nnc(s1)-c1ccc(O)cc1O InChI=1S/C15H11N3O4S/c1-8-6-9(2-5-12(8)18(21)22)14-16-17-15(23-14)11-4-3-10(19)7-13(11)20/h2-7,19-20H,1H3 GGDVNWXKQVVDGB-UHFFFAOYSA-N 50429791 CHEMBL2337270 Cholinesterase 147620 ChEMBL 10.1016/j.ejmech.2012.12.060 10.7270/Q27S7Q4V 23376249 Skrzypek, A; Matysiak, J; Niewiadomy, A; Bajda, M; Szymanski, P University of Life Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50429791 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50429791&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71653900 164158666 CHEMBL2337270 ZINC95592719 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51053806 Oc1ccc(-c2nnc(s2)-c2cccc(c2)[N+]([O-])=O)c(O)c1 InChI=1S/C14H9N3O4S/c18-10-4-5-11(12(19)7-10)14-16-15-13(22-14)8-2-1-3-9(6-8)17(20)21/h1-7,18-19H PAJJDXNZWMLNFJ-UHFFFAOYSA-N 50429792 CHEMBL2337269 Cholinesterase 32140 ChEMBL 10.1016/j.ejmech.2012.12.060 10.7270/Q27S7Q4V 23376249 Skrzypek, A; Matysiak, J; Niewiadomy, A; Bajda, M; Szymanski, P University of Life Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50429792 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50429792&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71718903 164158667 CHEMBL2337269 ZINC95588861 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51053807 Oc1ccc(-c2nnc(s2)-c2ccccc2[N+]([O-])=O)c(O)c1 InChI=1S/C14H9N3O4S/c18-8-5-6-10(12(19)7-8)14-16-15-13(22-14)9-3-1-2-4-11(9)17(20)21/h1-7,18-19H YNBINMFGXHGNKW-UHFFFAOYSA-N 50429793 CHEMBL2337268 Cholinesterase 57320 ChEMBL 10.1016/j.ejmech.2012.12.060 10.7270/Q27S7Q4V 23376249 Skrzypek, A; Matysiak, J; Niewiadomy, A; Bajda, M; Szymanski, P University of Life Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50429793 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50429793&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71653899 164158668 CHEMBL2337268 ZINC95589354 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51053808 Nc1cccc(c1)-c1nnc(s1)-c1ccc(O)cc1O InChI=1S/C14H11N3O2S/c15-9-3-1-2-8(6-9)13-16-17-14(20-13)11-5-4-10(18)7-12(11)19/h1-7,18-19H,15H2 OUYOREWJDHTKEJ-UHFFFAOYSA-N 50429794 CHEMBL2337267 Cholinesterase 84320 ChEMBL 10.1016/j.ejmech.2012.12.060 10.7270/Q27S7Q4V 23376249 Skrzypek, A; Matysiak, J; Niewiadomy, A; Bajda, M; Szymanski, P University of Life Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50429794 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50429794&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71653898 164158669 CHEMBL2337267 ZINC95586638 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51053809 COc1cc(ccc1O)-c1nnc(s1)-c1ccc(O)cc1O InChI=1S/C15H12N2O4S/c1-21-13-6-8(2-5-11(13)19)14-16-17-15(22-14)10-4-3-9(18)7-12(10)20/h2-7,18-20H,1H3 IKDWXYVMBFCAJV-UHFFFAOYSA-N 50429795 CHEMBL2337266 Cholinesterase 112410 ChEMBL 10.1016/j.ejmech.2012.12.060 10.7270/Q27S7Q4V 23376249 Skrzypek, A; Matysiak, J; Niewiadomy, A; Bajda, M; Szymanski, P University of Life Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50429795 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50429795&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71717688 164158670 CHEMBL2337266 ZINC95590272 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51053810 Oc1ccc(-c2nnc(s2)-c2ccc(O)c(O)c2)c(O)c1 InChI=1S/C14H10N2O4S/c17-8-2-3-9(11(19)6-8)14-16-15-13(21-14)7-1-4-10(18)12(20)5-7/h1-6,17-20H WCWJMCVRJVZEQB-UHFFFAOYSA-N 50429796 CHEMBL2337265 Cholinesterase 2160 ChEMBL 10.1016/j.ejmech.2012.12.060 10.7270/Q27S7Q4V 23376249 Skrzypek, A; Matysiak, J; Niewiadomy, A; Bajda, M; Szymanski, P University of Life Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50429796 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50429796&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71653897 164158671 CHEMBL2337265 ZINC95590234 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51053811 Oc1ccc(-c2nnc(s2)-c2ccc(O)cc2O)c(O)c1 InChI=1S/C14H10N2O4S/c17-7-1-3-9(11(19)5-7)13-15-16-14(21-13)10-4-2-8(18)6-12(10)20/h1-6,17-20H ZPXVWGPPMJPIGF-UHFFFAOYSA-N 50429797 CHEMBL243254 Cholinesterase 26740 ChEMBL 10.1016/j.ejmech.2012.12.060 10.7270/Q27S7Q4V 23376249 Skrzypek, A; Matysiak, J; Niewiadomy, A; Bajda, M; Szymanski, P University of Life Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50429797 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50429797&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44428151 164158672 CHEMBL243254 ZINC28712186 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51053812 COc1cc(cc(OC)c1OC)-c1nnc(s1)-c1ccc(O)cc1O InChI=1S/C17H16N2O5S/c1-22-13-6-9(7-14(23-2)15(13)24-3)16-18-19-17(25-16)11-5-4-10(20)8-12(11)21/h4-8,20-21H,1-3H3 WDXDNEUERBHCDA-UHFFFAOYSA-N 50429798 CHEMBL2337264 Cholinesterase 196210 ChEMBL 10.1016/j.ejmech.2012.12.060 10.7270/Q27S7Q4V 23376249 Skrzypek, A; Matysiak, J; Niewiadomy, A; Bajda, M; Szymanski, P University of Life Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50429798 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50429798&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71653896 164158673 CHEMBL2337264 ZINC95586115 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51053813 COc1ccc(OC)c(c1)-c1nnc(s1)-c1ccc(O)cc1O InChI=1S/C16H14N2O4S/c1-21-10-4-6-14(22-2)12(8-10)16-18-17-15(23-16)11-5-3-9(19)7-13(11)20/h3-8,19-20H,1-2H3 ACIGSJRBBBHKIQ-UHFFFAOYSA-N 50429799 CHEMBL2337263 Cholinesterase 63280 ChEMBL 10.1016/j.ejmech.2012.12.060 10.7270/Q27S7Q4V 23376249 Skrzypek, A; Matysiak, J; Niewiadomy, A; Bajda, M; Szymanski, P University of Life Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50429799 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50429799&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71653895 164158674 CHEMBL2337263 ZINC95591966 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51053814 COc1ccc(cc1OC)-c1nnc(s1)-c1ccc(O)cc1O InChI=1S/C16H14N2O4S/c1-21-13-6-3-9(7-14(13)22-2)15-17-18-16(23-15)11-5-4-10(19)8-12(11)20/h3-8,19-20H,1-2H3 PFZQQMFQCCXHTG-UHFFFAOYSA-N 50429800 CHEMBL2337262 Cholinesterase >500000 ChEMBL 10.1016/j.ejmech.2012.12.060 10.7270/Q27S7Q4V 23376249 Skrzypek, A; Matysiak, J; Niewiadomy, A; Bajda, M; Szymanski, P University of Life Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50429800 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50429800&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71653894 164158675 CHEMBL2337262 ZINC95592283 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51053815 COc1ccc(cc1)-c1nnc(s1)-c1ccc(O)cc1O InChI=1S/C15H12N2O3S/c1-20-11-5-2-9(3-6-11)14-16-17-15(21-14)12-7-4-10(18)8-13(12)19/h2-8,18-19H,1H3 VPIWBAQUZNZAAJ-UHFFFAOYSA-N 50429801 CHEMBL2337261 Cholinesterase 96340 ChEMBL 10.1016/j.ejmech.2012.12.060 10.7270/Q27S7Q4V 23376249 Skrzypek, A; Matysiak, J; Niewiadomy, A; Bajda, M; Szymanski, P University of Life Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50429801 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50429801&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71653893 164158676 CHEMBL2337261 ZINC95587999 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51046010 CCOc1ccc(\C=N\NC(=O)CN2CCC(Cc3ccccc3)CC2)cc1 InChI=1S/C23H29N3O2/c1-2-28-22-10-8-21(9-11-22)17-24-25-23(27)18-26-14-12-20(13-15-26)16-19-6-4-3-5-7-19/h3-11,17,20H,2,12-16,18H2,1H3,(H,25,27)/b24-17+ PZUITVNJLUHHRJ-JJIBRWJFSA-N 50426838 CHEMBL2323356 Cholinesterase 31500 ChEMBL 10.1016/j.bmcl.2012.11.064 10.7270/Q2CN757F 23273219 OzturanOzer, E; Tan, OU; Ozadali, K; Kucukkilinc, T; Balkan, A; Ucar, G Baskent University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50426838 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50426838&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71533433 164155713 CHEMBL2323356 ZINC95581488 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51046012 COc1ccc(\C=N\NC(=O)CN2CCC(Cc3ccccc3)CC2)cc1 InChI=1S/C22H27N3O2/c1-27-21-9-7-20(8-10-21)16-23-24-22(26)17-25-13-11-19(12-14-25)15-18-5-3-2-4-6-18/h2-10,16,19H,11-15,17H2,1H3,(H,24,26)/b23-16+ IFJBHFDNYBNAFZ-XQNSMLJCSA-N 50426839 CHEMBL2323355 Cholinesterase 30500 ChEMBL 10.1016/j.bmcl.2012.11.064 10.7270/Q2CN757F 23273219 OzturanOzer, E; Tan, OU; Ozadali, K; Kucukkilinc, T; Balkan, A; Ucar, G Baskent University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50426839 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50426839&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71533432 164155714 CHEMBL2323355 ZINC95583972 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51046013 CCOc1ccc(\C=N\NC(=O)CN2CCC(Cc3ccccc3)CC2)cc1 InChI=1S/C23H29N3O2/c1-2-28-22-10-8-21(9-11-22)17-24-25-23(27)18-26-14-12-20(13-15-26)16-19-6-4-3-5-7-19/h3-11,17,20H,2,12-16,18H2,1H3,(H,25,27)/b24-17+ PZUITVNJLUHHRJ-JJIBRWJFSA-N 50426838 CHEMBL2323356 Cholinesterase 67300 ChEMBL 10.1016/j.bmcl.2012.11.064 10.7270/Q2CN757F 23273219 OzturanOzer, E; Tan, OU; Ozadali, K; Kucukkilinc, T; Balkan, A; Ucar, G Baskent University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50426838 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50426838&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71533433 164155713 CHEMBL2323356 ZINC95581488 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51046014 COc1ccc(\C=N\NC(=O)CN2CCC(Cc3ccccc3)CC2)cc1 InChI=1S/C22H27N3O2/c1-27-21-9-7-20(8-10-21)16-23-24-22(26)17-25-13-11-19(12-14-25)15-18-5-3-2-4-6-18/h2-10,16,19H,11-15,17H2,1H3,(H,24,26)/b23-16+ IFJBHFDNYBNAFZ-XQNSMLJCSA-N 50426839 CHEMBL2323355 Cholinesterase 48800 ChEMBL 10.1016/j.bmcl.2012.11.064 10.7270/Q2CN757F 23273219 OzturanOzer, E; Tan, OU; Ozadali, K; Kucukkilinc, T; Balkan, A; Ucar, G Baskent University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50426839 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50426839&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71533432 164155714 CHEMBL2323355 ZINC95583972 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51046015 COc1ccc(\C=N\NC(=O)CN2CCC(Cc3ccccc3)CC2)cc1OC InChI=1S/C23H29N3O3/c1-28-21-9-8-20(15-22(21)29-2)16-24-25-23(27)17-26-12-10-19(11-13-26)14-18-6-4-3-5-7-18/h3-9,15-16,19H,10-14,17H2,1-2H3,(H,25,27)/b24-16+ FZCCLKVTVDSYDK-LFVJCYFKSA-N 50426840 CHEMBL2323354 Cholinesterase 55100 ChEMBL 10.1016/j.bmcl.2012.11.064 10.7270/Q2CN757F 23273219 OzturanOzer, E; Tan, OU; Ozadali, K; Kucukkilinc, T; Balkan, A; Ucar, G Baskent University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50426840 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50426840&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71540497 164155715 CHEMBL2323354 ZINC95582130 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51046016 CCOc1ccc(\C=N\NC(=O)CN2CCN(Cc3ccccc3)CC2)cc1 InChI=1S/C22H28N4O2/c1-2-28-21-10-8-19(9-11-21)16-23-24-22(27)18-26-14-12-25(13-15-26)17-20-6-4-3-5-7-20/h3-11,16H,2,12-15,17-18H2,1H3,(H,24,27)/b23-16+ UPMKYKMAAXFDGH-XQNSMLJCSA-N 50426841 CHEMBL2323353 Cholinesterase 98800 ChEMBL 10.1016/j.bmcl.2012.11.064 10.7270/Q2CN757F 23273219 OzturanOzer, E; Tan, OU; Ozadali, K; Kucukkilinc, T; Balkan, A; Ucar, G Baskent University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50426841 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50426841&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 9638193 164155716 CHEMBL2323353 ZINC20081430 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51046017 COc1ccc(\C=N\NC(=O)CN2CCN(Cc3ccccc3)CC2)cc1 InChI=1S/C21H26N4O2/c1-27-20-9-7-18(8-10-20)15-22-23-21(26)17-25-13-11-24(12-14-25)16-19-5-3-2-4-6-19/h2-10,15H,11-14,16-17H2,1H3,(H,23,26)/b22-15+ QQIVBXRWKHVREW-PXLXIMEGSA-N 50426842 CHEMBL2323352 Cholinesterase 88300 ChEMBL 10.1016/j.bmcl.2012.11.064 10.7270/Q2CN757F 23273219 OzturanOzer, E; Tan, OU; Ozadali, K; Kucukkilinc, T; Balkan, A; Ucar, G Baskent University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50426842 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50426842&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 6884840 164155717 CHEMBL2323352 ZINC22930914 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51046018 COc1ccc(\C=N\NC(=O)CN2CCN(Cc3ccccc3)CC2)cc1OC InChI=1S/C22H28N4O3/c1-28-20-9-8-19(14-21(20)29-2)15-23-24-22(27)17-26-12-10-25(11-13-26)16-18-6-4-3-5-7-18/h3-9,14-15H,10-13,16-17H2,1-2H3,(H,24,27)/b23-15+ ADTIYFNFCNVIJB-HZHRSRAPSA-N 50426843 CHEMBL2323351 Cholinesterase 71700 ChEMBL 10.1016/j.bmcl.2012.11.064 10.7270/Q2CN757F 23273219 OzturanOzer, E; Tan, OU; Ozadali, K; Kucukkilinc, T; Balkan, A; Ucar, G Baskent University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50426843 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50426843&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 9625548 164155718 CHEMBL2323351 ZINC19833696 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51053816 COc1cccc(c1)-c1nnc(s1)-c1ccc(O)cc1O InChI=1S/C15H12N2O3S/c1-20-11-4-2-3-9(7-11)14-16-17-15(21-14)12-6-5-10(18)8-13(12)19/h2-8,18-19H,1H3 MJKXTXVMNWICJB-UHFFFAOYSA-N 50429802 CHEMBL2337280 Cholinesterase 27320 ChEMBL 10.1016/j.ejmech.2012.12.060 10.7270/Q27S7Q4V 23376249 Skrzypek, A; Matysiak, J; Niewiadomy, A; Bajda, M; Szymanski, P University of Life Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50429802 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50429802&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71653742 164158677 CHEMBL2337280 ZINC95586899 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51053817 COc1ccccc1-c1nnc(s1)-c1ccc(O)cc1O InChI=1S/C15H12N2O3S/c1-20-13-5-3-2-4-11(13)15-17-16-14(21-15)10-7-6-9(18)8-12(10)19/h2-8,18-19H,1H3 JKHQRBJYLPJJLG-UHFFFAOYSA-N 50429803 CHEMBL2337279 Cholinesterase 212380 ChEMBL 10.1016/j.ejmech.2012.12.060 10.7270/Q27S7Q4V 23376249 Skrzypek, A; Matysiak, J; Niewiadomy, A; Bajda, M; Szymanski, P University of Life Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50429803 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50429803&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71653741 164158678 CHEMBL2337279 ZINC95591930 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51053818 Oc1ccc(-c2nnc(s2)-c2ccc(cc2)C(F)(F)F)c(O)c1 InChI=1S/C15H9F3N2O2S/c16-15(17,18)9-3-1-8(2-4-9)13-19-20-14(23-13)11-6-5-10(21)7-12(11)22/h1-7,21-22H PBCQAAJDSLTJNM-UHFFFAOYSA-N 50429804 CHEMBL2337278 Cholinesterase 26490 ChEMBL 10.1016/j.ejmech.2012.12.060 10.7270/Q27S7Q4V 23376249 Skrzypek, A; Matysiak, J; Niewiadomy, A; Bajda, M; Szymanski, P University of Life Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50429804 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50429804&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71653740 164158679 CHEMBL2337278 ZINC95591765 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51053819 Oc1ccc(-c2nnc(s2)-c2cc(Cl)cc(Cl)c2)c(O)c1 InChI=1S/C14H8Cl2N2O2S/c15-8-3-7(4-9(16)5-8)13-17-18-14(21-13)11-2-1-10(19)6-12(11)20/h1-6,19-20H PUTIZXDUMKWUNA-UHFFFAOYSA-N 50429805 CHEMBL2337277 Cholinesterase >500000 ChEMBL 10.1016/j.ejmech.2012.12.060 10.7270/Q27S7Q4V 23376249 Skrzypek, A; Matysiak, J; Niewiadomy, A; Bajda, M; Szymanski, P University of Life Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50429805 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50429805&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71653739 164158680 CHEMBL2337277 ZINC95589732 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51053820 Oc1ccc(-c2nnc(s2)-c2cc(Cl)ccc2Cl)c(O)c1 InChI=1S/C14H8Cl2N2O2S/c15-7-1-4-11(16)10(5-7)14-18-17-13(21-14)9-3-2-8(19)6-12(9)20/h1-6,19-20H RJSYSUGJKUEMIH-UHFFFAOYSA-N 50429806 CHEMBL2337276 Cholinesterase 19060 ChEMBL 10.1016/j.ejmech.2012.12.060 10.7270/Q27S7Q4V 23376249 Skrzypek, A; Matysiak, J; Niewiadomy, A; Bajda, M; Szymanski, P University of Life Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50429806 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50429806&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71653738 164158681 CHEMBL2337276 ZINC95589809 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51053821 Oc1ccc(-c2nnc(s2)-c2ccc(Cl)cc2Cl)c(O)c1 InChI=1S/C14H8Cl2N2O2S/c15-7-1-3-9(11(16)5-7)13-17-18-14(21-13)10-4-2-8(19)6-12(10)20/h1-6,19-20H NXJATMASDMKVEZ-UHFFFAOYSA-N 50429785 CHEMBL2337275 Cholinesterase >500000 ChEMBL 10.1016/j.ejmech.2012.12.060 10.7270/Q27S7Q4V 23376249 Skrzypek, A; Matysiak, J; Niewiadomy, A; Bajda, M; Szymanski, P University of Life Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50429785 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50429785&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71653737 164158660 CHEMBL2337275 ZINC95586854 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51053822 Oc1ccc(-c2nnc(s2)-c2ccccc2Br)c(O)c1 InChI=1S/C14H9BrN2O2S/c15-11-4-2-1-3-9(11)13-16-17-14(20-13)10-6-5-8(18)7-12(10)19/h1-7,18-19H ABEOGPVWBZTVJD-UHFFFAOYSA-N 50429786 CHEMBL396226 Cholinesterase 290 ChEMBL 10.1016/j.ejmech.2012.12.060 10.7270/Q27S7Q4V 23376249 Skrzypek, A; Matysiak, J; Niewiadomy, A; Bajda, M; Szymanski, P University of Life Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50429786 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50429786&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44428145 164158661 CHEMBL396226 ZINC28712180 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51053823 Oc1ccc(-c2nnc(s2)-c2ccccc2Cl)c(O)c1 InChI=1S/C14H9ClN2O2S/c15-11-4-2-1-3-9(11)13-16-17-14(20-13)10-6-5-8(18)7-12(10)19/h1-7,18-19H WTGWMDGYJWJQKS-UHFFFAOYSA-N 50429787 CHEMBL2337274 Cholinesterase 196240 ChEMBL 10.1016/j.ejmech.2012.12.060 10.7270/Q27S7Q4V 23376249 Skrzypek, A; Matysiak, J; Niewiadomy, A; Bajda, M; Szymanski, P University of Life Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50429787 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50429787&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71653736 164158662 CHEMBL2337274 ZINC95589386 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51053824 Oc1ccc(-c2nnc(s2)-c2ccccc2F)c(O)c1 InChI=1S/C14H9FN2O2S/c15-11-4-2-1-3-9(11)13-16-17-14(20-13)10-6-5-8(18)7-12(10)19/h1-7,18-19H GVQJVTUXQYBGOP-UHFFFAOYSA-N 50429788 CHEMBL2337273 Cholinesterase >500000 ChEMBL 10.1016/j.ejmech.2012.12.060 10.7270/Q27S7Q4V 23376249 Skrzypek, A; Matysiak, J; Niewiadomy, A; Bajda, M; Szymanski, P University of Life Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50429788 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50429788&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71720762 164158663 CHEMBL2337273 ZINC95590244 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51053825 Cc1cccc(c1)-c1nnc(s1)-c1ccc(O)cc1O InChI=1S/C15H12N2O2S/c1-9-3-2-4-10(7-9)14-16-17-15(20-14)12-6-5-11(18)8-13(12)19/h2-8,18-19H,1H3 LUUBFKSVLSVPHF-UHFFFAOYSA-N 50429789 CHEMBL2337272 Cholinesterase 17020 ChEMBL 10.1016/j.ejmech.2012.12.060 10.7270/Q27S7Q4V 23376249 Skrzypek, A; Matysiak, J; Niewiadomy, A; Bajda, M; Szymanski, P University of Life Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50429789 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50429789&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71653735 164158664 CHEMBL2337272 ZINC95590491 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038772 COc1ccc2nccc([C@H](O)[C@H]3C[C@@H]4CCN3C[C@@H]4C=C)c2c1 InChI=1S/C20H24N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3/t13-,14-,19+,20-/m0/s1 LOUPRKONTZGTKE-LHHVKLHASA-N 50121975 (6-Methoxy-quinolin-4-yl)-(5-vinyl-1-aza-bicyclo[2.2.2]oct-2-yl)-methanol::CARDIOQUIN::CHEMBL1294::CIN-QUIN::DURAQUIN::QUINACT::QUINAGLUTE::QUINALAN::QUINATIME::QUINIDEX::QUINIDINE::QUINORA::US9402878, Quinidine Cholinesterase 7370 ChEMBL 10.1016/j.bmc.2012.09.040 10.7270/Q2ZG6TBT 23062825 Brunhofer, G; Fallarero, A; Karlsson, D; Batista-Gonzalez, A; Shinde, P; Gopi Mohan, C; Vuorela, P Abo Akademi University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50121975 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50121975&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search QDN 6LQA,4WNU 441074 104014718 28593 CHEMBL1294 DB00908 2342 C06527 ZINC03831405 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51039175 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 1900 ChEMBL 10.1016/j.bmc.2012.10.045 10.7270/Q2QV3NTH 23199476 Catto, M; Pisani, L; Leonetti, F; Nicolotti, O; Pesce, P; Stefanachi, A; Cellamare, S; Carotti, A Universit£ degli Studi di Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51039176 COc1cc2cc(OCC3CCN(Cc4ccccc4)CC3)c(=O)oc2cc1OC InChI=1S/C24H27NO5/c1-27-21-12-19-13-23(24(26)30-20(19)14-22(21)28-2)29-16-18-8-10-25(11-9-18)15-17-6-4-3-5-7-17/h3-7,12-14,18H,8-11,15-16H2,1-2H3 IYQZVACOXVKLHS-UHFFFAOYSA-N 50424042 CHEMBL2314731 Cholinesterase 3900 ChEMBL 10.1016/j.bmc.2012.10.045 10.7270/Q2QV3NTH 23199476 Catto, M; Pisani, L; Leonetti, F; Nicolotti, O; Pesce, P; Stefanachi, A; Cellamare, S; Carotti, A Universit£ degli Studi di Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50424042 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50424042&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71508468 164152917 CHEMBL2314731 ZINC95598396 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51039177 O=c1oc2ccccc2cc1OC1CCN(Cc2ccccc2)CC1 InChI=1S/C21H21NO3/c23-21-20(14-17-8-4-5-9-19(17)25-21)24-18-10-12-22(13-11-18)15-16-6-2-1-3-7-16/h1-9,14,18H,10-13,15H2 DVFZOOLUKVYDFJ-UHFFFAOYSA-N 50424043 CHEMBL2314728 Cholinesterase 7900 ChEMBL 10.1016/j.bmc.2012.10.045 10.7270/Q2QV3NTH 23199476 Catto, M; Pisani, L; Leonetti, F; Nicolotti, O; Pesce, P; Stefanachi, A; Cellamare, S; Carotti, A Universit£ degli Studi di Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50424043 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50424043&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71508423 164152918 CHEMBL2314728 ZINC95595756 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51039178 CN(CCCOc1cc2ccccc2oc1=O)Cc1ccccc1 InChI=1S/C20H21NO3/c1-21(15-16-8-3-2-4-9-16)12-7-13-23-19-14-17-10-5-6-11-18(17)24-20(19)22/h2-6,8-11,14H,7,12-13,15H2,1H3 QIXRQPHEQBAFPH-UHFFFAOYSA-N 50424044 CHEMBL2314727 Cholinesterase 4000 ChEMBL 10.1016/j.bmc.2012.10.045 10.7270/Q2QV3NTH 23199476 Catto, M; Pisani, L; Leonetti, F; Nicolotti, O; Pesce, P; Stefanachi, A; Cellamare, S; Carotti, A Universit£ degli Studi di Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50424044 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50424044&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71508422 164152919 CHEMBL2314727 ZINC95595886 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51039179 COc1cc2cc(NC(=O)[C@H]3CCC[C@H](C3)NCc3ccccc3)c(=O)oc2cc1OC InChI=1S/C25H28N2O5/c1-30-22-13-18-12-20(25(29)32-21(18)14-23(22)31-2)27-24(28)17-9-6-10-19(11-17)26-15-16-7-4-3-5-8-16/h3-5,7-8,12-14,17,19,26H,6,9-11,15H2,1-2H3,(H,27,28)/t17-,19+/m0/s1 UGTGSTDFYWUXNH-PKOBYXMFSA-N 50424045 CHEMBL2314726 Cholinesterase 33000 ChEMBL 10.1016/j.bmc.2012.10.045 10.7270/Q2QV3NTH 23199476 Catto, M; Pisani, L; Leonetti, F; Nicolotti, O; Pesce, P; Stefanachi, A; Cellamare, S; Carotti, A Universit£ degli Studi di Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50424045 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50424045&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71716757 164152920 CHEMBL2314726 ZINC95595629 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51039180 COc1cc2cc(C(=O)OCC3CCN(Cc4ccccc4)CC3)c(=O)oc2cc1OC InChI=1S/C25H27NO6/c1-29-22-13-19-12-20(25(28)32-21(19)14-23(22)30-2)24(27)31-16-18-8-10-26(11-9-18)15-17-6-4-3-5-7-17/h3-7,12-14,18H,8-11,15-16H2,1-2H3 PUJKZFISJDXMJD-UHFFFAOYSA-N 50424046 CHEMBL2314721 Cholinesterase 4700 ChEMBL 10.1016/j.bmc.2012.10.045 10.7270/Q2QV3NTH 23199476 Catto, M; Pisani, L; Leonetti, F; Nicolotti, O; Pesce, P; Stefanachi, A; Cellamare, S; Carotti, A Universit£ degli Studi di Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50424046 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50424046&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71508367 164152921 CHEMBL2314721 ZINC95598057 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055924 Fc1ccccc1\C=C1/CN(C\C(=C/c2ccccc2F)C1=O)C(=O)C[C@H]1C[C@H]2CCCN2[C@]11C(=O)Nc2ccccc12 InChI=1S/C35H31F2N3O3/c36-29-12-4-1-8-22(29)16-24-20-39(21-25(33(24)42)17-23-9-2-5-13-30(23)37)32(41)19-26-18-27-10-7-15-40(27)35(26)28-11-3-6-14-31(28)38-34(35)43/h1-6,8-9,11-14,16-17,26-27H,7,10,15,18-21H2,(H,38,43)/b24-16+,25-17+/t26-,27-,35-/m1/s1 AILPIHZZISVMTB-QEGZUFBXSA-N 50430652 CHEMBL2332975 Cholinesterase 3500 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430652 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430652&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71716985 164159527 CHEMBL2332975 ZINC95586590 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055925 Clc1ccccc1\C=C1/CN(C\C(=C/c2ccccc2Cl)C1=O)C(=O)C[C@H]1C[C@H]2CCCN2[C@]11C(=O)Nc2ccccc12 InChI=1S/C35H31Cl2N3O3/c36-29-12-4-1-8-22(29)16-24-20-39(21-25(33(24)42)17-23-9-2-5-13-30(23)37)32(41)19-26-18-27-10-7-15-40(27)35(26)28-11-3-6-14-31(28)38-34(35)43/h1-6,8-9,11-14,16-17,26-27H,7,10,15,18-21H2,(H,38,43)/b24-16+,25-17+/t26-,27-,35-/m1/s1 LJOVCRKSFLGXBZ-QEGZUFBXSA-N 50430653 CHEMBL2332974 Cholinesterase 19730 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430653 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430653&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71718831 164159528 CHEMBL2332974 ZINC95586384 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055926 COc1ccccc1\C=C1/CN(C\C(=C/c2ccccc2OC)C1=O)C(=O)C[C@H]1C[C@H]2CCCN2[C@]11C(=O)Nc2ccccc12 InChI=1S/C37H37N3O5/c1-44-32-15-7-3-10-24(32)18-26-22-39(23-27(35(26)42)19-25-11-4-8-16-33(25)45-2)34(41)21-28-20-29-12-9-17-40(29)37(28)30-13-5-6-14-31(30)38-36(37)43/h3-8,10-11,13-16,18-19,28-29H,9,12,17,20-23H2,1-2H3,(H,38,43)/b26-18+,27-19+/t28-,29-,37-/m1/s1 UGCUKCYPAMRIBT-PJIGKQEJSA-N 50430654 CHEMBL2332550 Cholinesterase 9410 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430654 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430654&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71716974 164159529 CHEMBL2332550 ZINC95590747 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055927 Cc1ccccc1\C=C1/CN(C\C(=C/c2ccccc2C)C1=O)C(=O)C[C@H]1C[C@H]2CCCN2[C@]11C(=O)Nc2ccccc12 InChI=1S/C37H37N3O3/c1-24-10-3-5-12-26(24)18-28-22-39(23-29(35(28)42)19-27-13-6-4-11-25(27)2)34(41)21-30-20-31-14-9-17-40(31)37(30)32-15-7-8-16-33(32)38-36(37)43/h3-8,10-13,15-16,18-19,30-31H,9,14,17,20-23H2,1-2H3,(H,38,43)/b28-18+,29-19+/t30-,31-,37-/m1/s1 ZFPYELATDAFWFI-NSQNZTPSSA-N 50430655 CHEMBL2332549 Cholinesterase 17820 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430655 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430655&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71716973 164159530 CHEMBL2332549 ZINC95590171 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055928 O=C(C[C@H]1C[C@H]2CCCN2[C@]11C(=O)Nc2ccccc12)N1C\C(=C/c2ccccc2)C(=O)\C(C1)=C\c1ccccc1 InChI=1S/C35H33N3O3/c39-32(21-28-20-29-14-9-17-38(29)35(28)30-15-7-8-16-31(30)36-34(35)41)37-22-26(18-24-10-3-1-4-11-24)33(40)27(23-37)19-25-12-5-2-6-13-25/h1-8,10-13,15-16,18-19,28-29H,9,14,17,20-23H2,(H,36,41)/b26-18+,27-19+/t28-,29-,35-/m1/s1 ZXNYKJWIZZJZPB-UEJDYGPVSA-N 50430656 CHEMBL2332548 Cholinesterase 16290 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430656 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430656&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71718814 164159531 CHEMBL2332548 ZINC95588824 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055929 C=CC(=O)N1C\C(=C/c2cccc3ccccc23)C(=O)\C(C1)=C\c1cccc2ccccc12 InChI=1S/C30H23NO2/c1-2-29(32)31-19-25(17-23-13-7-11-21-9-3-5-15-27(21)23)30(33)26(20-31)18-24-14-8-12-22-10-4-6-16-28(22)24/h2-18H,1,19-20H2/b25-17+,26-18+ MTRUEVQGINMHEH-RPCRKUJJSA-N 50430657 CHEMBL2332547 Cholinesterase 23120 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430657 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430657&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71614508 164159532 CHEMBL2332547 ZINC95590965 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055930 Fc1ccc(\C=C2/CN(C\C(=C/c3ccc(F)cc3)C2=O)C(=O)C=C)cc1 InChI=1S/C22H17F2NO2/c1-2-21(26)25-13-17(11-15-3-7-19(23)8-4-15)22(27)18(14-25)12-16-5-9-20(24)10-6-16/h2-12H,1,13-14H2/b17-11+,18-12+ JTMAQMMHQYJZRV-JYFOCSDGSA-N 50430658 CHEMBL350032 Cholinesterase 30580 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430658 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430658&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5469427 164159533 CHEMBL350032 ZINC05838758 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055931 Clc1ccc(\C=C2/CN(C\C(=C/c3ccc(Cl)cc3)C2=O)C(=O)C=C)cc1 InChI=1S/C22H17Cl2NO2/c1-2-21(26)25-13-17(11-15-3-7-19(23)8-4-15)22(27)18(14-25)12-16-5-9-20(24)10-6-16/h2-12H,1,13-14H2/b17-11+,18-12+ UANWMDUDDVNHJV-JYFOCSDGSA-N 50430659 CHEMBL152675 Cholinesterase 38190 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430659 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430659&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5351434 164159534 CHEMBL152675 ZINC05838751 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055932 Cc1ccc(\C=C2/CN(C\C(=C/c3ccc(C)cc3)C2=O)C(=O)C=C)cc1 InChI=1S/C24H23NO2/c1-4-23(26)25-15-21(13-19-9-5-17(2)6-10-19)24(27)22(16-25)14-20-11-7-18(3)8-12-20/h4-14H,1,15-16H2,2-3H3/b21-13+,22-14+ PBKYTQAWPQYYBI-JFMUQQRKSA-N 50430660 CHEMBL454594 Cholinesterase 35070 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430660 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430660&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 24796898 164159535 CHEMBL454594 ZINC40846956 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055933 Clc1ccc(\C=C2/CN(C\C(=C/c3ccc(Cl)cc3Cl)C2=O)C(=O)C=C)c(Cl)c1 InChI=1S/C22H15Cl4NO2/c1-2-21(28)27-11-15(7-13-3-5-17(23)9-19(13)25)22(29)16(12-27)8-14-4-6-18(24)10-20(14)26/h2-10H,1,11-12H2/b15-7+,16-8+ FISLRWJREXCZGZ-BGPOSVGRSA-N 50430661 CHEMBL2332546 Cholinesterase 29370 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430661 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430661&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71720637 164159536 CHEMBL2332546 ZINC95590664 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055934 [O-][N+](=O)c1cccc(\C=C2/CN(C\C(=C/c3cccc(c3)[N+]([O-])=O)C2=O)C(=O)C=C)c1 InChI=1S/C22H17N3O6/c1-2-21(26)23-13-17(9-15-5-3-7-19(11-15)24(28)29)22(27)18(14-23)10-16-6-4-8-20(12-16)25(30)31/h2-12H,1,13-14H2/b17-9+,18-10+ CDXLEFQOEJSRAZ-BEQMOXJMSA-N 50430662 CHEMBL2332537 Cholinesterase 51160 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430662 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430662&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71584436 164159537 CHEMBL2332537 ZINC95592336 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055935 Fc1ccccc1\C=C1/CN(C\C(=C/c2ccccc2F)C1=O)C(=O)C=C InChI=1S/C22H17F2NO2/c1-2-21(26)25-13-17(11-15-7-3-5-9-19(15)23)22(27)18(14-25)12-16-8-4-6-10-20(16)24/h2-12H,1,13-14H2/b17-11+,18-12+ UAALLHXUCALBPS-JYFOCSDGSA-N 50430663 CHEMBL2332536 Cholinesterase 54040 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430663 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430663&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71584435 164159538 CHEMBL2332536 ZINC95587646 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055936 Clc1ccccc1\C=C1/CN(C\C(=C/c2ccccc2Cl)C1=O)C(=O)C=C InChI=1S/C22H17Cl2NO2/c1-2-21(26)25-13-17(11-15-7-3-5-9-19(15)23)22(27)18(14-25)12-16-8-4-6-10-20(16)24/h2-12H,1,13-14H2/b17-11+,18-12+ TWKRFLWDMHZWHO-JYFOCSDGSA-N 50430664 CHEMBL2332535 Cholinesterase 36620 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430664 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430664&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71718812 164159539 CHEMBL2332535 ZINC95587223 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055937 COc1ccccc1\C=C1/CN(C\C(=C/c2ccccc2OC)C1=O)C(=O)C=C InChI=1S/C24H23NO4/c1-4-23(26)25-15-19(13-17-9-5-7-11-21(17)28-2)24(27)20(16-25)14-18-10-6-8-12-22(18)29-3/h4-14H,1,15-16H2,2-3H3/b19-13+,20-14+ ANDKTBBSVHIHPD-IWGRKNQJSA-N 50430665 CHEMBL2332539 Cholinesterase 28920 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430665 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430665&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71584434 164159540 CHEMBL2332539 ZINC95588902 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055938 Cc1ccccc1\C=C1/CN(C\C(=C/c2ccccc2C)C1=O)C(=O)C=C InChI=1S/C24H23NO2/c1-4-23(26)25-15-21(13-19-11-7-5-9-17(19)2)24(27)22(16-25)14-20-12-8-6-10-18(20)3/h4-14H,1,15-16H2,2-3H3/b21-13+,22-14+ YYTCOYCBTWTKEO-JFMUQQRKSA-N 50430666 CHEMBL2332538 Cholinesterase 30020 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430666 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430666&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71584433 164159541 CHEMBL2332538 ZINC95588268 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055939 C=CC(=O)N1C\C(=C/c2ccccc2)C(=O)\C(C1)=C\c1ccccc1 InChI=1S/C22H19NO2/c1-2-21(24)23-15-19(13-17-9-5-3-6-10-17)22(25)20(16-23)14-18-11-7-4-8-12-18/h2-14H,1,15-16H2/b19-13+,20-14+ FYXRGLSUYBQDPY-IWGRKNQJSA-N 50430667 CHEMBL156016 Cholinesterase 22060 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430667 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430667&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5351364 164159542 CHEMBL156016 ZINC17195935 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055957 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 19340 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055958 O=C(C[C@H]1C[C@H]2CCCN2[C@]11C(=O)Nc2ccccc12)N1C\C(=C/c2cccc3ccccc23)C(=O)[C@]2(C[C@H]3CCCN3[C@@]22C(=O)Nc3ccccc23)C1 InChI=1S/C45H43N5O4/c51-39(24-31-23-32-13-8-20-49(32)44(31)35-16-3-5-18-37(35)46-41(44)53)48-26-30(22-29-12-7-11-28-10-1-2-15-34(28)29)40(52)43(27-48)25-33-14-9-21-50(33)45(43)36-17-4-6-19-38(36)47-42(45)54/h1-7,10-12,15-19,22,31-33H,8-9,13-14,20-21,23-27H2,(H,46,53)(H,47,54)/b30-22+/t31-,32-,33-,43+,44-,45+/m1/s1 QJDKSLPODCPDIR-UZJWSWILSA-N 50430668 CHEMBL2332981 Cholinesterase 6420 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430668 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430668&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71716383 164159543 CHEMBL2332981 ZINC95589520 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055959 Fc1ccc(\C=C2/CN(C[C@@]3(C[C@H]4CCCN4[C@@]33C(=O)Nc4ccccc34)C2=O)C(=O)C[C@H]2C[C@H]3CCCN3[C@]22C(=O)Nc3ccccc23)cc1 InChI=1S/C41H40FN5O4/c42-28-15-13-25(14-16-28)19-26-23-45(35(48)21-27-20-29-7-5-17-46(29)40(27)31-9-1-3-11-33(31)43-37(40)50)24-39(36(26)49)22-30-8-6-18-47(30)41(39)32-10-2-4-12-34(32)44-38(41)51/h1-4,9-16,19,27,29-30H,5-8,17-18,20-24H2,(H,43,50)(H,44,51)/b26-19+/t27-,29-,30-,39+,40-,41+/m1/s1 UKJSHSBQBOLBRO-QVLSZIRFSA-N 50430669 CHEMBL2332540 Cholinesterase 8290 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430669 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430669&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71720009 164159544 CHEMBL2332540 ZINC95587579 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055960 Clc1ccc(\C=C2/CN(C[C@@]3(C[C@H]4CCCN4[C@@]33C(=O)Nc4ccccc34)C2=O)C(=O)C[C@H]2C[C@H]3CCCN3[C@]22C(=O)Nc3ccccc23)cc1 InChI=1S/C41H40ClN5O4/c42-28-15-13-25(14-16-28)19-26-23-45(35(48)21-27-20-29-7-5-17-46(29)40(27)31-9-1-3-11-33(31)43-37(40)50)24-39(36(26)49)22-30-8-6-18-47(30)41(39)32-10-2-4-12-34(32)44-38(41)51/h1-4,9-16,19,27,29-30H,5-8,17-18,20-24H2,(H,43,50)(H,44,51)/b26-19+/t27-,29-,30-,39+,40-,41+/m1/s1 VONAWRRNWCSFFR-QVLSZIRFSA-N 50430670 CHEMBL2332541 Cholinesterase 10890 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430670 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430670&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71717595 164159545 CHEMBL2332541 ZINC95592550 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055961 Cc1ccc(\C=C2/CN(C[C@@]3(C[C@H]4CCCN4[C@@]33C(=O)Nc4ccccc34)C2=O)C(=O)C[C@H]2C[C@H]3CCCN3[C@]22C(=O)Nc3ccccc23)cc1 InChI=1S/C42H43N5O4/c1-26-14-16-27(17-15-26)20-28-24-45(36(48)22-29-21-30-8-6-18-46(30)41(29)32-10-2-4-12-34(32)43-38(41)50)25-40(37(28)49)23-31-9-7-19-47(31)42(40)33-11-3-5-13-35(33)44-39(42)51/h2-5,10-17,20,29-31H,6-9,18-19,21-25H2,1H3,(H,43,50)(H,44,51)/b28-20+/t29-,30-,31-,40+,41-,42+/m1/s1 KSUCZTJZFOROGX-IFFGZHMQSA-N 50430671 CHEMBL2332530 Cholinesterase 17880 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430671 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430671&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71718212 164159546 CHEMBL2332530 ZINC95590348 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055962 Clc1ccc(\C=C2/CN(C[C@@]3(C[C@H]4CCCN4[C@@]33C(=O)Nc4ccccc34)C2=O)C(=O)C[C@H]2C[C@H]3CCCN3[C@]22C(=O)Nc3ccccc23)c(Cl)c1 InChI=1S/C41H39Cl2N5O4/c42-27-14-13-24(32(43)20-27)17-25-22-46(35(49)19-26-18-28-7-5-15-47(28)40(26)30-9-1-3-11-33(30)44-37(40)51)23-39(36(25)50)21-29-8-6-16-48(29)41(39)31-10-2-4-12-34(31)45-38(41)52/h1-4,9-14,17,20,26,28-29H,5-8,15-16,18-19,21-23H2,(H,44,51)(H,45,52)/b25-17+/t26-,28-,29-,39+,40-,41+/m1/s1 LJVOIVPCWUJLKZ-AVGIRGRJSA-N 50430672 CHEMBL2332531 Cholinesterase 9450 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430672 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430672&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71719411 164159547 CHEMBL2332531 ZINC95591558 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055963 [O-][N+](=O)c1cccc(\C=C2/CN(C[C@@]3(C[C@H]4CCCN4[C@@]33C(=O)Nc4ccccc34)C2=O)C(=O)C[C@H]2C[C@H]3CCCN3[C@]22C(=O)Nc3ccccc23)c1 InChI=1S/C41H40N6O6/c48-35(21-27-20-28-10-6-16-45(28)40(27)31-12-1-3-14-33(31)42-37(40)50)44-23-26(18-25-8-5-9-29(19-25)47(52)53)36(49)39(24-44)22-30-11-7-17-46(30)41(39)32-13-2-4-15-34(32)43-38(41)51/h1-5,8-9,12-15,18-19,27-28,30H,6-7,10-11,16-17,20-24H2,(H,42,50)(H,43,51)/b26-18+/t27-,28-,30-,39+,40-,41+/m1/s1 MKAYDZNCHVJHQA-FKJQTBCWSA-N 50430673 CHEMBL2332532 Cholinesterase 24290 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430673 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430673&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71716370 164159548 CHEMBL2332532 ZINC95587441 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055964 Fc1ccccc1\C=C1/CN(C[C@@]2(C[C@H]3CCCN3[C@@]22C(=O)Nc3ccccc23)C1=O)C(=O)C[C@H]1C[C@H]2CCCN2[C@]11C(=O)Nc2ccccc12 InChI=1S/C41H40FN5O4/c42-32-14-4-1-9-25(32)19-26-23-45(35(48)21-27-20-28-10-7-17-46(28)40(27)30-12-2-5-15-33(30)43-37(40)50)24-39(36(26)49)22-29-11-8-18-47(29)41(39)31-13-3-6-16-34(31)44-38(41)51/h1-6,9,12-16,19,27-29H,7-8,10-11,17-18,20-24H2,(H,43,50)(H,44,51)/b26-19+/t27-,28-,29-,39+,40-,41+/m1/s1 PGOMKJLRFYXFBY-JLOSPDJYSA-N 50430674 CHEMBL2332533 Cholinesterase 9090 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430674 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430674&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71716371 164159549 CHEMBL2332533 ZINC95588976 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055965 Clc1ccccc1\C=C1/CN(C[C@@]2(C[C@H]3CCCN3[C@@]22C(=O)Nc3ccccc23)C1=O)C(=O)C[C@H]1C[C@H]2CCCN2[C@]11C(=O)Nc2ccccc12 InChI=1S/C41H40ClN5O4/c42-32-14-4-1-9-25(32)19-26-23-45(35(48)21-27-20-28-10-7-17-46(28)40(27)30-12-2-5-15-33(30)43-37(40)50)24-39(36(26)49)22-29-11-8-18-47(29)41(39)31-13-3-6-16-34(31)44-38(41)51/h1-6,9,12-16,19,27-29H,7-8,10-11,17-18,20-24H2,(H,43,50)(H,44,51)/b26-19+/t27-,28-,29-,39+,40-,41+/m1/s1 NDMFPONKHVEFKT-JLOSPDJYSA-N 50430675 CHEMBL2332534 Cholinesterase 11740 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430675 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430675&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71720635 164159550 CHEMBL2332534 ZINC95592636 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055966 COc1ccccc1\C=C1/CN(C[C@@]2(C[C@H]3CCCN3[C@@]22C(=O)Nc3ccccc23)C1=O)C(=O)C[C@H]1C[C@H]2CCCN2[C@]11C(=O)Nc2ccccc12 InChI=1S/C42H43N5O5/c1-52-35-17-7-2-10-26(35)20-27-24-45(36(48)22-28-21-29-11-8-18-46(29)41(28)31-13-3-5-15-33(31)43-38(41)50)25-40(37(27)49)23-30-12-9-19-47(30)42(40)32-14-4-6-16-34(32)44-39(42)51/h2-7,10,13-17,20,28-30H,8-9,11-12,18-19,21-25H2,1H3,(H,43,50)(H,44,51)/b27-20+/t28-,29-,30-,40+,41-,42+/m1/s1 GRNVKQKRRGMSRY-LCXIOLFPSA-N 50430676 CHEMBL2332542 Cholinesterase 19210 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430676 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430676&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71719412 164159551 CHEMBL2332542 ZINC95592741 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055967 Cc1ccccc1\C=C1/CN(C[C@@]2(C[C@H]3CCCN3[C@@]22C(=O)Nc3ccccc23)C1=O)C(=O)C[C@H]1C[C@H]2CCCN2[C@]11C(=O)Nc2ccccc12 InChI=1S/C42H43N5O4/c1-26-10-2-3-11-27(26)20-28-24-45(36(48)22-29-21-30-12-8-18-46(30)41(29)32-14-4-6-16-34(32)43-38(41)50)25-40(37(28)49)23-31-13-9-19-47(31)42(40)33-15-5-7-17-35(33)44-39(42)51/h2-7,10-11,14-17,20,29-31H,8-9,12-13,18-19,21-25H2,1H3,(H,43,50)(H,44,51)/b28-20+/t29-,30-,31-,40+,41-,42+/m1/s1 JLNJZGPYRYXGAE-IFFGZHMQSA-N 50430677 CHEMBL2332543 Cholinesterase 12960 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430677 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430677&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71720636 164159552 CHEMBL2332543 ZINC95591001 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055968 O=C(C[C@H]1C[C@H]2CCCN2[C@]11C(=O)Nc2ccccc12)N1C\C(=C/c2ccccc2)C(=O)[C@]2(C[C@H]3CCCN3[C@@]22C(=O)Nc3ccccc23)C1 InChI=1S/C41H41N5O4/c47-35(22-28-21-29-12-8-18-45(29)40(28)31-14-4-6-16-33(31)42-37(40)49)44-24-27(20-26-10-2-1-3-11-26)36(48)39(25-44)23-30-13-9-19-46(30)41(39)32-15-5-7-17-34(32)43-38(41)50/h1-7,10-11,14-17,20,28-30H,8-9,12-13,18-19,21-25H2,(H,42,49)(H,43,50)/b27-20+/t28-,29-,30-,39+,40-,41+/m1/s1 YPJPJVJYEPAABA-QKHZYRMWSA-N 50430678 CHEMBL2332544 Cholinesterase 18210 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430678 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430678&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71720010 164159553 CHEMBL2332544 ZINC95586228 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055969 O=C(C[C@H]1C[C@H]2CCCN2[C@]11C(=O)Nc2ccccc12)N1C\C(=C/c2cccc3ccccc23)C(=O)\C(C1)=C\c1cccc2ccccc12 InChI=1S/C43H37N3O3/c47-40(25-34-24-35-16-9-21-46(35)43(34)38-19-5-6-20-39(38)44-42(43)49)45-26-32(22-30-14-7-12-28-10-1-3-17-36(28)30)41(48)33(27-45)23-31-15-8-13-29-11-2-4-18-37(29)31/h1-8,10-15,17-20,22-23,34-35H,9,16,21,24-27H2,(H,44,49)/b32-22+,33-23+/t34-,35-,43-/m1/s1 ZGNYWDUENAFLJX-SYYPJRJYSA-N 50430679 CHEMBL2332545 Cholinesterase 11790 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430679 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430679&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71718813 164159554 CHEMBL2332545 ZINC95589224 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055970 Fc1ccc(\C=C2/CN(C\C(=C/c3ccc(F)cc3)C2=O)C(=O)C[C@H]2C[C@H]3CCCN3[C@]22C(=O)Nc3ccccc23)cc1 InChI=1S/C35H31F2N3O3/c36-27-11-7-22(8-12-27)16-24-20-39(21-25(33(24)42)17-23-9-13-28(37)14-10-23)32(41)19-26-18-29-4-3-15-40(29)35(26)30-5-1-2-6-31(30)38-34(35)43/h1-2,5-14,16-17,26,29H,3-4,15,18-21H2,(H,38,43)/b24-16+,25-17+/t26-,29-,35-/m1/s1 YQYQXYGTARGZSC-AMURHSJLSA-N 50430680 CHEMBL2332980 Cholinesterase 3990 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430680 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430680&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71720017 164159555 CHEMBL2332980 ZINC95587594 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055971 Clc1ccc(\C=C2/CN(C\C(=C/c3ccc(Cl)cc3)C2=O)C(=O)C[C@H]2C[C@H]3CCCN3[C@]22C(=O)Nc3ccccc23)cc1 InChI=1S/C35H31Cl2N3O3/c36-27-11-7-22(8-12-27)16-24-20-39(21-25(33(24)42)17-23-9-13-28(37)14-10-23)32(41)19-26-18-29-4-3-15-40(29)35(26)30-5-1-2-6-31(30)38-34(35)43/h1-2,5-14,16-17,26,29H,3-4,15,18-21H2,(H,38,43)/b24-16+,25-17+/t26-,29-,35-/m1/s1 CAGSYCPJEBZNQR-AMURHSJLSA-N 50430681 CHEMBL2332979 Cholinesterase 32270 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430681 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430681&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71716987 164159556 CHEMBL2332979 ZINC95586707 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055972 Cc1ccc(\C=C2/CN(C\C(=C/c3ccc(C)cc3)C2=O)C(=O)C[C@H]2C[C@H]3CCCN3[C@]22C(=O)Nc3ccccc23)cc1 InChI=1S/C37H37N3O3/c1-24-9-13-26(14-10-24)18-28-22-39(23-29(35(28)42)19-27-15-11-25(2)12-16-27)34(41)21-30-20-31-6-5-17-40(31)37(30)32-7-3-4-8-33(32)38-36(37)43/h3-4,7-16,18-19,30-31H,5-6,17,20-23H2,1-2H3,(H,38,43)/b28-18+,29-19+/t30-,31-,37-/m1/s1 CNWZEGLWLSHLKT-NSQNZTPSSA-N 50430682 CHEMBL2332978 Cholinesterase 25200 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71719421 164159557 CHEMBL2332978 ZINC95591299 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055973 Clc1ccc(\C=C2/CN(C\C(=C/c3ccc(Cl)cc3Cl)C2=O)C(=O)C[C@H]2C[C@H]3CCCN3[C@]22C(=O)Nc3ccccc23)c(Cl)c1 InChI=1S/C35H29Cl4N3O3/c36-25-9-7-20(29(38)16-25)12-22-18-41(19-23(33(22)44)13-21-8-10-26(37)17-30(21)39)32(43)15-24-14-27-4-3-11-42(27)35(24)28-5-1-2-6-31(28)40-34(35)45/h1-2,5-10,12-13,16-17,24,27H,3-4,11,14-15,18-19H2,(H,40,45)/b22-12+,23-13+/t24-,27-,35-/m1/s1 VTDKVLOPDSWYSF-RUQYIBFVSA-N 50430683 CHEMBL2332977 Cholinesterase 21160 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430683 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430683&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71716986 164159558 CHEMBL2332977 ZINC95591633 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055974 [O-][N+](=O)c1cccc(\C=C2/CN(C\C(=C/c3cccc(c3)[N+]([O-])=O)C2=O)C(=O)C[C@H]2C[C@H]3CCCN3[C@]22C(=O)Nc3ccccc23)c1 InChI=1S/C35H31N5O7/c41-32(19-26-18-27-10-5-13-38(27)35(26)30-11-1-2-12-31(30)36-34(35)43)37-20-24(14-22-6-3-8-28(16-22)39(44)45)33(42)25(21-37)15-23-7-4-9-29(17-23)40(46)47/h1-4,6-9,11-12,14-17,26-27H,5,10,13,18-21H2,(H,36,43)/b24-14+,25-15+/t26-,27-,35-/m1/s1 NUGLIROFZZXZSJ-WEMBUXJDSA-N 50430651 CHEMBL2332976 Cholinesterase 18140 ChEMBL 10.1016/j.bmc.2013.01.066 10.7270/Q2RJ4KVQ 23454132 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Wahab, HA; Bing, CS Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430651 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430651&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71720016 164159526 CHEMBL2332976 ZINC95586968 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50523885 COc1cccc2cc(C(=O)NCCc3c[nH]c4ccccc34)c(=O)oc12 InChI=1S/C21H18N2O4/c1-26-18-8-4-5-13-11-16(21(25)27-19(13)18)20(24)22-10-9-14-12-23-17-7-3-2-6-15(14)17/h2-8,11-12,23H,9-10H2,1H3,(H,22,24) DRJJBMDKAMCMNT-UHFFFAOYSA-N 50197932 CHEMBL1366414 Cholinesterase 20100 ChEMBL 10.1016/j.ejmech.2016.05.014 10.7270/Q2XS5XBG 27214510 Ghanei-Nasab, S; Khoobi, M; Hadizadeh, F; Marjani, A; Moradi, A; Nadri, H; Emami, S; Foroumadi, A; Shafiee, A Islamic Azad University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50197932 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50197932&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1448466 375978082 CHEMBL1366414 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50523886 O=C(NCCc1c[nH]c2ccccc12)c1cc2ccc(OCc3ccccc3)cc2oc1=O InChI=1S/C27H22N2O4/c30-26(28-13-12-20-16-29-24-9-5-4-8-22(20)24)23-14-19-10-11-21(15-25(19)33-27(23)31)32-17-18-6-2-1-3-7-18/h1-11,14-16,29H,12-13,17H2,(H,28,30) DQNKUQIJGZEASY-UHFFFAOYSA-N 50197933 CHEMBL3948863 Cholinesterase 16200 ChEMBL 10.1016/j.ejmech.2016.05.014 10.7270/Q2XS5XBG 27214510 Ghanei-Nasab, S; Khoobi, M; Hadizadeh, F; Marjani, A; Moradi, A; Nadri, H; Emami, S; Foroumadi, A; Shafiee, A Islamic Azad University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50197933 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50197933&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134147955 375978083 CHEMBL3948863 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50523887 Fc1ccc(COc2ccc3cc(C(=O)NCCc4c[nH]c5ccccc45)c(=O)oc3c2)cc1 InChI=1S/C27H21FN2O4/c28-20-8-5-17(6-9-20)16-33-21-10-7-18-13-23(27(32)34-25(18)14-21)26(31)29-12-11-19-15-30-24-4-2-1-3-22(19)24/h1-10,13-15,30H,11-12,16H2,(H,29,31) VWTKPEFXBYNDFD-UHFFFAOYSA-N 50197934 CHEMBL3889532 Cholinesterase 29700 ChEMBL 10.1016/j.ejmech.2016.05.014 10.7270/Q2XS5XBG 27214510 Ghanei-Nasab, S; Khoobi, M; Hadizadeh, F; Marjani, A; Moradi, A; Nadri, H; Emami, S; Foroumadi, A; Shafiee, A Islamic Azad University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50197934 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50197934&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134130635 375978084 CHEMBL3889532 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50523888 COc1ccc2cc(C(=O)NCCc3c[nH]c4ccccc34)c(=O)oc2c1 InChI=1S/C21H18N2O4/c1-26-15-7-6-13-10-17(21(25)27-19(13)11-15)20(24)22-9-8-14-12-23-18-5-3-2-4-16(14)18/h2-7,10-12,23H,8-9H2,1H3,(H,22,24) UVHAKOXFRYOFMQ-UHFFFAOYSA-N 50197935 CHEMBL3938998 Cholinesterase 34600 ChEMBL 10.1016/j.ejmech.2016.05.014 10.7270/Q2XS5XBG 27214510 Ghanei-Nasab, S; Khoobi, M; Hadizadeh, F; Marjani, A; Moradi, A; Nadri, H; Emami, S; Foroumadi, A; Shafiee, A Islamic Azad University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50197935 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50197935&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134149513 375978085 CHEMBL3938998 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50523889 Brc1ccc2oc(=O)c(cc2c1)C(=O)NCCc1c[nH]c2ccccc12 InChI=1S/C20H15BrN2O3/c21-14-5-6-18-13(9-14)10-16(20(25)26-18)19(24)22-8-7-12-11-23-17-4-2-1-3-15(12)17/h1-6,9-11,23H,7-8H2,(H,22,24) LTLXXDAVHCHQAX-UHFFFAOYSA-N 50197936 CHEMBL3968400 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2016.05.014 10.7270/Q2XS5XBG 27214510 Ghanei-Nasab, S; Khoobi, M; Hadizadeh, F; Marjani, A; Moradi, A; Nadri, H; Emami, S; Foroumadi, A; Shafiee, A Islamic Azad University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50197936 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50197936&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134150415 375978086 CHEMBL3968400 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50523891 Clc1cccc(COc2ccc3cc(C(=O)NCCc4c[nH]c5ccccc45)c(=O)oc3c2)c1Cl InChI=1S/C27H20Cl2N2O4/c28-22-6-3-4-18(25(22)29)15-34-19-9-8-16-12-21(27(33)35-24(16)13-19)26(32)30-11-10-17-14-31-23-7-2-1-5-20(17)23/h1-9,12-14,31H,10-11,15H2,(H,30,32) SBZXDGSYVACVTQ-UHFFFAOYSA-N 50197931 CHEMBL3940086 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2016.05.014 10.7270/Q2XS5XBG 27214510 Ghanei-Nasab, S; Khoobi, M; Hadizadeh, F; Marjani, A; Moradi, A; Nadri, H; Emami, S; Foroumadi, A; Shafiee, A Islamic Azad University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50197931 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50197931&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134148858 375978081 CHEMBL3940086 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50523898 O=C(NCCc1c[nH]c2ccccc12)c1cc2ccccc2oc1=O InChI=1S/C20H16N2O3/c23-19(16-11-13-5-1-4-8-18(13)25-20(16)24)21-10-9-14-12-22-17-7-3-2-6-15(14)17/h1-8,11-12,22H,9-10H2,(H,21,23) DUDOVKSOMFTHKL-UHFFFAOYSA-N 50197937 CHEMBL1543615 Cholinesterase 50500 ChEMBL 10.1016/j.ejmech.2016.05.014 10.7270/Q2XS5XBG 27214510 Ghanei-Nasab, S; Khoobi, M; Hadizadeh, F; Marjani, A; Moradi, A; Nadri, H; Emami, S; Foroumadi, A; Shafiee, A Islamic Azad University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50197937 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50197937&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 2340492 375978087 CHEMBL1543615 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50523899 CCOc1ccc2cc(C(=O)NCCc3c[nH]c4ccccc34)c(=O)oc2c1 InChI=1S/C22H20N2O4/c1-2-27-16-8-7-14-11-18(22(26)28-20(14)12-16)21(25)23-10-9-15-13-24-19-6-4-3-5-17(15)19/h3-8,11-13,24H,2,9-10H2,1H3,(H,23,25) DZSGSEFRADGHDP-UHFFFAOYSA-N 50197943 CHEMBL3957520 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2016.05.014 10.7270/Q2XS5XBG 27214510 Ghanei-Nasab, S; Khoobi, M; Hadizadeh, F; Marjani, A; Moradi, A; Nadri, H; Emami, S; Foroumadi, A; Shafiee, A Islamic Azad University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50197943 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50197943&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134155007 104079064 CHEMBL3957520 ZINC28641179 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50523900 CCCOc1ccc2cc(C(=O)NCCc3c[nH]c4ccccc34)c(=O)oc2c1 InChI=1S/C23H22N2O4/c1-2-11-28-17-8-7-15-12-19(23(27)29-21(15)13-17)22(26)24-10-9-16-14-25-20-6-4-3-5-18(16)20/h3-8,12-14,25H,2,9-11H2,1H3,(H,24,26) GLPUNFLVYZTRNX-UHFFFAOYSA-N 50197946 CHEMBL3929967 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2016.05.014 10.7270/Q2XS5XBG 27214510 Ghanei-Nasab, S; Khoobi, M; Hadizadeh, F; Marjani, A; Moradi, A; Nadri, H; Emami, S; Foroumadi, A; Shafiee, A Islamic Azad University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50197946 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50197946&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134138941 104079067 CHEMBL3929967 ZINC28641931 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50523901 Clc1ccc(COc2ccc3cc(C(=O)NCCc4c[nH]c5ccccc45)c(=O)oc3c2)cc1 InChI=1S/C27H21ClN2O4/c28-20-8-5-17(6-9-20)16-33-21-10-7-18-13-23(27(32)34-25(18)14-21)26(31)29-12-11-19-15-30-24-4-2-1-3-22(19)24/h1-10,13-15,30H,11-12,16H2,(H,29,31) MLLRRAMYAPSPBI-UHFFFAOYSA-N 50197949 CHEMBL3912096 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2016.05.014 10.7270/Q2XS5XBG 27214510 Ghanei-Nasab, S; Khoobi, M; Hadizadeh, F; Marjani, A; Moradi, A; Nadri, H; Emami, S; Foroumadi, A; Shafiee, A Islamic Azad University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50197949 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50197949&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134133020 104079070 CHEMBL3912096 ZINC28641368 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50523902 Fc1cccc(COc2ccc3cc(C(=O)NCCc4c[nH]c5ccccc45)c(=O)oc3c2)c1 InChI=1S/C27H21FN2O4/c28-20-5-3-4-17(12-20)16-33-21-9-8-18-13-23(27(32)34-25(18)14-21)26(31)29-11-10-19-15-30-24-7-2-1-6-22(19)24/h1-9,12-15,30H,10-11,16H2,(H,29,31) RAAWXZAXUPYBBL-UHFFFAOYSA-N 50197951 CHEMBL3956598 Cholinesterase 27800 ChEMBL 10.1016/j.ejmech.2016.05.014 10.7270/Q2XS5XBG 27214510 Ghanei-Nasab, S; Khoobi, M; Hadizadeh, F; Marjani, A; Moradi, A; Nadri, H; Emami, S; Foroumadi, A; Shafiee, A Islamic Azad University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50197951 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50197951&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134144774 375978089 CHEMBL3956598 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50523903 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 7400 ChEMBL 10.1016/j.ejmech.2016.05.014 10.7270/Q2XS5XBG 27214510 Ghanei-Nasab, S; Khoobi, M; Hadizadeh, F; Marjani, A; Moradi, A; Nadri, H; Emami, S; Foroumadi, A; Shafiee, A Islamic Azad University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50523906 Fc1ccccc1COc1ccc2cc(C(=O)NCCc3c[nH]c4ccccc34)c(=O)oc2c1 InChI=1S/C27H21FN2O4/c28-23-7-3-1-5-19(23)16-33-20-10-9-17-13-22(27(32)34-25(17)14-20)26(31)29-12-11-18-15-30-24-8-4-2-6-21(18)24/h1-10,13-15,30H,11-12,16H2,(H,29,31) YIGYSVTZTGHTLM-UHFFFAOYSA-N 50197939 CHEMBL3976042 Cholinesterase 27500 ChEMBL 10.1016/j.ejmech.2016.05.014 10.7270/Q2XS5XBG 27214510 Ghanei-Nasab, S; Khoobi, M; Hadizadeh, F; Marjani, A; Moradi, A; Nadri, H; Emami, S; Foroumadi, A; Shafiee, A Islamic Azad University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50197939 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50197939&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134152051 104079060 CHEMBL3976042 ZINC28641748 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095877 COc1ccc2c(c1)[nH]c1cccc(CN(C(C)C)C(=O)CCO[N+]([O-])=O)c21 InChI=1S/C20H23N3O5/c1-13(2)22(19(24)9-10-28-23(25)26)12-14-5-4-6-17-20(14)16-8-7-15(27-3)11-18(16)21-17/h4-8,11,13,21H,9-10,12H2,1-3H3 HWCYNJSCBMFYMY-UHFFFAOYSA-N 50449392 CHEMBL3127220 Cholinesterase 2500 ChEMBL 10.1016/j.ejmech.2014.02.035 10.7270/Q2W097FT 24594525 Fang, L; Fang, X; Gou, S; Lupp, A; Lenhardt, I; Sun, Y; Huang, Z; Chen, Y; Zhang, Y; Fleck, C Southeast University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449392 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449392&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76318249 194947288 CHEMBL3127220 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095878 CC(C)NCc1cccc2[nH]c3cc(O)ccc3c12 InChI=1S/C16H18N2O/c1-10(2)17-9-11-4-3-5-14-16(11)13-7-6-12(19)8-15(13)18-14/h3-8,10,17-19H,9H2,1-2H3 GKPBCVPXONGCPA-UHFFFAOYSA-N 50449393 CHEMBL3127219 Cholinesterase 17270 ChEMBL 10.1016/j.ejmech.2014.02.035 10.7270/Q2W097FT 24594525 Fang, L; Fang, X; Gou, S; Lupp, A; Lenhardt, I; Sun, Y; Huang, Z; Chen, Y; Zhang, Y; Fleck, C Southeast University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449393 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449393&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76336414 194947289 CHEMBL3127219 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095879 COc1ccc2c(c1)[nH]c1cccc(CNCc3ccccc3)c21 InChI=1S/C21H20N2O/c1-24-17-10-11-18-20(12-17)23-19-9-5-8-16(21(18)19)14-22-13-15-6-3-2-4-7-15/h2-12,22-23H,13-14H2,1H3 LPYACEILBZFXJH-UHFFFAOYSA-N 50449394 CHEMBL3127218 Cholinesterase 29900 ChEMBL 10.1016/j.ejmech.2014.02.035 10.7270/Q2W097FT 24594525 Fang, L; Fang, X; Gou, S; Lupp, A; Lenhardt, I; Sun, Y; Huang, Z; Chen, Y; Zhang, Y; Fleck, C Southeast University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449394 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449394&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76321937 194947290 CHEMBL3127218 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095880 CCN(CC)Cc1cccc2[nH]c3cc(OC)ccc3c12 InChI=1S/C18H22N2O/c1-4-20(5-2)12-13-7-6-8-16-18(13)15-10-9-14(21-3)11-17(15)19-16/h6-11,19H,4-5,12H2,1-3H3 YKIZLFFFHDCFQL-UHFFFAOYSA-N 50449395 CHEMBL3127217 Cholinesterase 14880 ChEMBL 10.1016/j.ejmech.2014.02.035 10.7270/Q2W097FT 24594525 Fang, L; Fang, X; Gou, S; Lupp, A; Lenhardt, I; Sun, Y; Huang, Z; Chen, Y; Zhang, Y; Fleck, C Southeast University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449395 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449395&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76329134 194947291 CHEMBL3127217 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095893 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 39030 ChEMBL 10.1016/j.ejmech.2014.02.035 10.7270/Q2W097FT 24594525 Fang, L; Fang, X; Gou, S; Lupp, A; Lenhardt, I; Sun, Y; Huang, Z; Chen, Y; Zhang, Y; Fleck, C Southeast University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095894 COc1ccc2c(c1)oc1cccc(CNC(C)C)c21 InChI=1S/C17H19NO2/c1-11(2)18-10-12-5-4-6-15-17(12)14-8-7-13(19-3)9-16(14)20-15/h4-9,11,18H,10H2,1-3H3 IGFHLBTUVSKECP-UHFFFAOYSA-N 50449396 CHEMBL3127040 Cholinesterase 13500 ChEMBL 10.1016/j.ejmech.2014.02.035 10.7270/Q2W097FT 24594525 Fang, L; Fang, X; Gou, S; Lupp, A; Lenhardt, I; Sun, Y; Huang, Z; Chen, Y; Zhang, Y; Fleck, C Southeast University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449396 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449396&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76336399 194947292 CHEMBL3127040 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095895 CCNCc1cccc2oc3cc(OC)ccc3c12 InChI=1S/C16H17NO2/c1-3-17-10-11-5-4-6-14-16(11)13-8-7-12(18-2)9-15(13)19-14/h4-9,17H,3,10H2,1-2H3 FGGONMAZRHFUPU-UHFFFAOYSA-N 50449397 CHEMBL3127041 Cholinesterase 22180 ChEMBL 10.1016/j.ejmech.2014.02.035 10.7270/Q2W097FT 24594525 Fang, L; Fang, X; Gou, S; Lupp, A; Lenhardt, I; Sun, Y; Huang, Z; Chen, Y; Zhang, Y; Fleck, C Southeast University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449397 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449397&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76321928 194947293 CHEMBL3127041 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095896 CCN(CC)Cc1cccc2oc3cc(OC)ccc3c12 InChI=1S/C18H21NO2/c1-4-19(5-2)12-13-7-6-8-16-18(13)15-10-9-14(20-3)11-17(15)21-16/h6-11H,4-5,12H2,1-3H3 PKRJYQBHUXGYND-UHFFFAOYSA-N 50449399 CHEMBL3127043 Cholinesterase 27390 ChEMBL 10.1016/j.ejmech.2014.02.035 10.7270/Q2W097FT 24594525 Fang, L; Fang, X; Gou, S; Lupp, A; Lenhardt, I; Sun, Y; Huang, Z; Chen, Y; Zhang, Y; Fleck, C Southeast University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449399 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449399&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76318239 194947295 CHEMBL3127043 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095897 COc1ccc2c(c1)oc1cccc(CNCc3ccccc3)c21 InChI=1S/C21H19NO2/c1-23-17-10-11-18-20(12-17)24-19-9-5-8-16(21(18)19)14-22-13-15-6-3-2-4-7-15/h2-12,22H,13-14H2,1H3 PQBKEUKZUAKYBM-UHFFFAOYSA-N 50449400 CHEMBL3127213 Cholinesterase 18100 ChEMBL 10.1016/j.ejmech.2014.02.035 10.7270/Q2W097FT 24594525 Fang, L; Fang, X; Gou, S; Lupp, A; Lenhardt, I; Sun, Y; Huang, Z; Chen, Y; Zhang, Y; Fleck, C Southeast University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449400 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449400&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76336413 194947296 CHEMBL3127213 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095898 CC(C)NCc1cccc2oc3cc(O)ccc3c12 InChI=1S/C16H17NO2/c1-10(2)17-9-11-4-3-5-14-16(11)13-7-6-12(18)8-15(13)19-14/h3-8,10,17-18H,9H2,1-2H3 YSJSMIKDJYOSGL-UHFFFAOYSA-N 50449403 CHEMBL3127214 Cholinesterase 18360 ChEMBL 10.1016/j.ejmech.2014.02.035 10.7270/Q2W097FT 24594525 Fang, L; Fang, X; Gou, S; Lupp, A; Lenhardt, I; Sun, Y; Huang, Z; Chen, Y; Zhang, Y; Fleck, C Southeast University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449403 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449403&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76311049 194947299 CHEMBL3127214 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095899 COc1ccc2c(c1)oc1cccc(CN(C(C)C)C(=O)CCO[N+]([O-])=O)c21 InChI=1S/C20H22N2O6/c1-13(2)21(19(23)9-10-27-22(24)25)12-14-5-4-6-17-20(14)16-8-7-15(26-3)11-18(16)28-17/h4-8,11,13H,9-10,12H2,1-3H3 KCSKFSLGEVSWQS-UHFFFAOYSA-N 50449401 CHEMBL3127215 Cholinesterase 14300 ChEMBL 10.1016/j.ejmech.2014.02.035 10.7270/Q2W097FT 24594525 Fang, L; Fang, X; Gou, S; Lupp, A; Lenhardt, I; Sun, Y; Huang, Z; Chen, Y; Zhang, Y; Fleck, C Southeast University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449401 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449401&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76321936 194947297 CHEMBL3127215 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51095900 COc1ccc2c(c1)[nH]c1cccc(CNC(C)C)c21 InChI=1S/C17H20N2O/c1-11(2)18-10-12-5-4-6-15-17(12)14-8-7-13(20-3)9-16(14)19-15/h4-9,11,18-19H,10H2,1-3H3 RQGBNHOWYVIADD-UHFFFAOYSA-N 50449402 CHEMBL3127216 Cholinesterase 10080 ChEMBL 10.1016/j.ejmech.2014.02.035 10.7270/Q2W097FT 24594525 Fang, L; Fang, X; Gou, S; Lupp, A; Lenhardt, I; Sun, Y; Huang, Z; Chen, Y; Zhang, Y; Fleck, C Southeast University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50449402 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50449402&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76329133 194947298 CHEMBL3127216 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50517949 CN1CC[C@@H]2C[C@H](O)[C@H]3OC(=O)c4c(O)c5OCOc5cc4[C@H]3[C@H]12 InChI=1S/C17H19NO6/c1-18-3-2-7-4-9(19)15-11(13(7)18)8-5-10-16(23-6-22-10)14(20)12(8)17(21)24-15/h5,7,9,11,13,15,19-20H,2-4,6H2,1H3/t7-,9+,11+,13-,15-/m1/s1 BLDWBTXUTAIWSY-TZBUPLKMSA-N 50190650 CHEMBL3906484 Cholinesterase 67300 ChEMBL 10.1021/acs.jnatprod.5b00785 10.7270/Q2WM1GBJ 27096334 Ortiz, JE; Pigni, NB; Andujar, SA; Roitman, G; Suvire, FD; Enriz, RD; Tapia, A; Bastida, J; Feresin, GE Universidad Nacional de San Juan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50190650 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50190650&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134135954 375075565 CHEMBL3906484 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50517950 CO[C@H]1C=C2[C@H]3CN(Cc4cc5OCOc5cc34)[C@H]2C[C@@H]1O InChI=1S/C17H19NO4/c1-20-15-4-11-12-7-18(13(11)5-14(15)19)6-9-2-16-17(3-10(9)12)22-8-21-16/h2-4,12-15,19H,5-8H2,1H3/t12-,13-,14-,15-/m0/s1 MKYLOMHWHWEFCT-AJNGGQMLSA-N 50190649 Montanine Cholinesterase >200000 ChEMBL 10.1021/acs.jnatprod.5b00785 10.7270/Q2WM1GBJ 27096334 Ortiz, JE; Pigni, NB; Andujar, SA; Roitman, G; Suvire, FD; Enriz, RD; Tapia, A; Bastida, J; Feresin, GE Universidad Nacional de San Juan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50190649 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50190649&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11087935 375075564 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50517951 CO[C@H]1[C@@H]2N3C[C@H](C2=CC[C@@H]1O)c1cc2OCOc2cc1C3 InChI=1S/C17H19NO4/c1-20-17-13(19)3-2-10-12-7-18(16(10)17)6-9-4-14-15(5-11(9)12)22-8-21-14/h2,4-5,12-13,16-17,19H,3,6-8H2,1H3/t12-,13+,16-,17-/m1/s1 GNFWHIIHHNOQMS-DLTLXFJOSA-N 50190651 CHEMBL3956367 Cholinesterase >200000 ChEMBL 10.1021/acs.jnatprod.5b00785 10.7270/Q2WM1GBJ 27096334 Ortiz, JE; Pigni, NB; Andujar, SA; Roitman, G; Suvire, FD; Enriz, RD; Tapia, A; Bastida, J; Feresin, GE Universidad Nacional de San Juan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50190651 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50190651&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134144967 375075566 CHEMBL3956367 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50517953 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 22390 ChEMBL 10.1021/acs.jnatprod.5b00785 10.7270/Q2WM1GBJ 27096334 Ortiz, JE; Pigni, NB; Andujar, SA; Roitman, G; Suvire, FD; Enriz, RD; Tapia, A; Bastida, J; Feresin, GE Universidad Nacional de San Juan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50520021 CCOC(=O)c1cnc2c(F)cccc2c1N1CCN(CC1)c1ncccc1C#N InChI=1S/C22H20FN5O2/c1-2-30-22(29)17-14-26-19-16(6-3-7-18(19)23)20(17)27-9-11-28(12-10-27)21-15(13-24)5-4-8-25-21/h3-8,14H,2,9-12H2,1H3 ZSZYIUCQLLRTDR-UHFFFAOYSA-N 50193128 CHEMBL3944310 Cholinesterase 890 ChEMBL 10.1016/j.ejmech.2016.04.053 10.7270/Q2319XT7 27227482 Kumar, J; Meena, P; Singh, A; Jameel, E; Maqbool, M; Mobashir, M; Shandilya, A; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50193128 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50193128&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134146336 375076137 CHEMBL3944310 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50520022 CCOC(=O)c1cnc2cc(ccc2c1N1CCN(CC1)c1cc(C)nc2ncnn12)C(F)(F)F InChI=1S/C23H22F3N7O2/c1-3-35-21(34)17-12-27-18-11-15(23(24,25)26)4-5-16(18)20(17)32-8-6-31(7-9-32)19-10-14(2)30-22-28-13-29-33(19)22/h4-5,10-13H,3,6-9H2,1-2H3 JXKDISIZWSCVQA-UHFFFAOYSA-N 50193129 CHEMBL3962563 Cholinesterase 780 ChEMBL 10.1016/j.ejmech.2016.04.053 10.7270/Q2319XT7 27227482 Kumar, J; Meena, P; Singh, A; Jameel, E; Maqbool, M; Mobashir, M; Shandilya, A; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50193129 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50193129&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134152719 375076138 CHEMBL3962563 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50520025 CCOC(=O)c1cnc2ccc(C)cc2c1N1CCN(CC1)c1ncccc1C#N InChI=1S/C23H23N5O2/c1-3-30-23(29)19-15-26-20-7-6-16(2)13-18(20)21(19)27-9-11-28(12-10-27)22-17(14-24)5-4-8-25-22/h4-8,13,15H,3,9-12H2,1-2H3 MEIMCVWECVOLRF-UHFFFAOYSA-N 50193131 CHEMBL3897201 Cholinesterase 3000 ChEMBL 10.1016/j.ejmech.2016.04.053 10.7270/Q2319XT7 27227482 Kumar, J; Meena, P; Singh, A; Jameel, E; Maqbool, M; Mobashir, M; Shandilya, A; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50193131 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50193131&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134133221 375076140 CHEMBL3897201 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50520027 CCOC(=O)c1cnc2ccc(C)cc2c1N1CCN(CC1)c1cc(C)nc2ncnn12 InChI=1S/C23H25N7O2/c1-4-32-22(31)18-13-24-19-6-5-15(2)11-17(19)21(18)29-9-7-28(8-10-29)20-12-16(3)27-23-25-14-26-30(20)23/h5-6,11-14H,4,7-10H2,1-3H3 BTNKGBXQMMYQGD-UHFFFAOYSA-N 50193132 CHEMBL3953816 Cholinesterase 4090 ChEMBL 10.1016/j.ejmech.2016.04.053 10.7270/Q2319XT7 27227482 Kumar, J; Meena, P; Singh, A; Jameel, E; Maqbool, M; Mobashir, M; Shandilya, A; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50193132 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50193132&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 133359663 375076141 CHEMBL3953816 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50520028 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 15800 ChEMBL 10.1016/j.ejmech.2016.04.053 10.7270/Q2319XT7 27227482 Kumar, J; Meena, P; Singh, A; Jameel, E; Maqbool, M; Mobashir, M; Shandilya, A; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50520029 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 2580 ChEMBL 10.1016/j.ejmech.2016.04.053 10.7270/Q2319XT7 27227482 Kumar, J; Meena, P; Singh, A; Jameel, E; Maqbool, M; Mobashir, M; Shandilya, A; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50520030 CCOC(=O)c1cnc2ccc(F)cc2c1N1CCN(CC1)c1ncccc1C#N InChI=1S/C22H20FN5O2/c1-2-30-22(29)18-14-26-19-6-5-16(23)12-17(19)20(18)27-8-10-28(11-9-27)21-15(13-24)4-3-7-25-21/h3-7,12,14H,2,8-11H2,1H3 SVLZNUGVKFIWNW-UHFFFAOYSA-N 50193133 CHEMBL3957322 Cholinesterase 1230 ChEMBL 10.1016/j.ejmech.2016.04.053 10.7270/Q2319XT7 27227482 Kumar, J; Meena, P; Singh, A; Jameel, E; Maqbool, M; Mobashir, M; Shandilya, A; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50193133 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50193133&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134154720 375076142 CHEMBL3957322 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50520031 CCOC(=O)c1cnc2ccc(OC)cc2c1N1CCN(CC1)c1ncccc1C#N InChI=1S/C23H23N5O3/c1-3-31-23(29)19-15-26-20-7-6-17(30-2)13-18(20)21(19)27-9-11-28(12-10-27)22-16(14-24)5-4-8-25-22/h4-8,13,15H,3,9-12H2,1-2H3 QYMJYFAIRXKEJM-UHFFFAOYSA-N 50193134 CHEMBL3968318 Cholinesterase 1900 ChEMBL 10.1016/j.ejmech.2016.04.053 10.7270/Q2319XT7 27227482 Kumar, J; Meena, P; Singh, A; Jameel, E; Maqbool, M; Mobashir, M; Shandilya, A; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50193134 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50193134&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134151017 375076143 CHEMBL3968318 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50520032 CCOC(=O)c1cnc2c(F)cccc2c1N1CCN(CC1)c1cc(C)nc2ncnn12 InChI=1S/C22H22FN7O2/c1-3-32-21(31)16-12-24-19-15(5-4-6-17(19)23)20(16)29-9-7-28(8-10-29)18-11-14(2)27-22-25-13-26-30(18)22/h4-6,11-13H,3,7-10H2,1-2H3 BMEQASZPVWYVCK-UHFFFAOYSA-N 50193135 CHEMBL3936155 Cholinesterase 180 ChEMBL 10.1016/j.ejmech.2016.04.053 10.7270/Q2319XT7 27227482 Kumar, J; Meena, P; Singh, A; Jameel, E; Maqbool, M; Mobashir, M; Shandilya, A; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50193135 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50193135&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134149744 375076144 CHEMBL3936155 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50523912 Oc1ccc2cc(C(=O)NCCc3c[nH]c4ccccc34)c(=O)oc2c1 InChI=1S/C20H16N2O4/c23-14-6-5-12-9-16(20(25)26-18(12)10-14)19(24)21-8-7-13-11-22-17-4-2-1-3-15(13)17/h1-6,9-11,22-23H,7-8H2,(H,21,24) YBABOPMSIRMYNQ-UHFFFAOYSA-N 50197930 CHEMBL3968527 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2016.05.014 10.7270/Q2XS5XBG 27214510 Ghanei-Nasab, S; Khoobi, M; Hadizadeh, F; Marjani, A; Moradi, A; Nadri, H; Emami, S; Foroumadi, A; Shafiee, A Islamic Azad University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50197930 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50197930&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134150507 375978080 CHEMBL3968527 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50523913 Clc1ccccc1COc1ccc2cc(C(=O)NCCc3c[nH]c4ccccc34)c(=O)oc2c1 InChI=1S/C27H21ClN2O4/c28-23-7-3-1-5-19(23)16-33-20-10-9-17-13-22(27(32)34-25(17)14-20)26(31)29-12-11-18-15-30-24-8-4-2-6-21(18)24/h1-10,13-15,30H,11-12,16H2,(H,29,31) QPECHOKXOVXFLK-UHFFFAOYSA-N 50197938 CHEMBL3921055 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2016.05.014 10.7270/Q2XS5XBG 27214510 Ghanei-Nasab, S; Khoobi, M; Hadizadeh, F; Marjani, A; Moradi, A; Nadri, H; Emami, S; Foroumadi, A; Shafiee, A Islamic Azad University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50197938 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50197938&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134139986 375978088 CHEMBL3921055 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50523914 Clc1ccc(COc2ccc3cc(C(=O)NCCc4c[nH]c5ccccc45)c(=O)oc3c2)cc1Cl InChI=1S/C27H20Cl2N2O4/c28-22-8-5-16(11-23(22)29)15-34-19-7-6-17-12-21(27(33)35-25(17)13-19)26(32)30-10-9-18-14-31-24-4-2-1-3-20(18)24/h1-8,11-14,31H,9-10,15H2,(H,30,32) MZXFNUWEBXGNSC-UHFFFAOYSA-N 50197952 CHEMBL3905250 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2016.05.014 10.7270/Q2XS5XBG 27214510 Ghanei-Nasab, S; Khoobi, M; Hadizadeh, F; Marjani, A; Moradi, A; Nadri, H; Emami, S; Foroumadi, A; Shafiee, A Islamic Azad University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50197952 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50197952&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134135930 375978090 CHEMBL3905250 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50520039 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 11682 2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::Rivastigmine.tartrate::US9586925, Rivastigmine Cholinesterase 1320 ChEMBL 10.1016/j.ejmech.2016.04.053 10.7270/Q2319XT7 27227482 Kumar, J; Meena, P; Singh, A; Jameel, E; Maqbool, M; Mobashir, M; Shandilya, A; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=11682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=11682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46512204 DB00989 C11766 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50520041 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 54 ChEMBL 10.1016/j.ejmech.2016.04.053 10.7270/Q2319XT7 27227482 Kumar, J; Meena, P; Singh, A; Jameel, E; Maqbool, M; Mobashir, M; Shandilya, A; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50520042 CCOC(=O)c1cnc2cc(ccc2c1N1CCN(CC1)c1ncccc1C#N)C(F)(F)F InChI=1S/C23H20F3N5O2/c1-2-33-22(32)18-14-29-19-12-16(23(24,25)26)5-6-17(19)20(18)30-8-10-31(11-9-30)21-15(13-27)4-3-7-28-21/h3-7,12,14H,2,8-11H2,1H3 FOWCNGSZRSCYIF-UHFFFAOYSA-N 50193136 CHEMBL3986008 Cholinesterase 980 ChEMBL 10.1016/j.ejmech.2016.04.053 10.7270/Q2319XT7 27227482 Kumar, J; Meena, P; Singh, A; Jameel, E; Maqbool, M; Mobashir, M; Shandilya, A; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50193136 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50193136&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134157892 375076145 CHEMBL3986008 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50520043 CCOC(=O)c1cnc2ccc(OC)cc2c1N1CCN(CC1)c1cc(C)nc2ncnn12 InChI=1S/C23H25N7O3/c1-4-33-22(31)18-13-24-19-6-5-16(32-3)12-17(19)21(18)29-9-7-28(8-10-29)20-11-15(2)27-23-25-14-26-30(20)23/h5-6,11-14H,4,7-10H2,1-3H3 LCVWGURXKMSYQV-UHFFFAOYSA-N 50193137 CHEMBL3935074 Cholinesterase 2010 ChEMBL 10.1016/j.ejmech.2016.04.053 10.7270/Q2319XT7 27227482 Kumar, J; Meena, P; Singh, A; Jameel, E; Maqbool, M; Mobashir, M; Shandilya, A; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50193137 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50193137&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134149052 375076146 CHEMBL3935074 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50520047 Cc1cc(N2CCN(CC2)c2ncccc2C#N)n2ncnc2n1 InChI=1S/C16H16N8/c1-12-9-14(24-16(21-12)19-11-20-24)22-5-7-23(8-6-22)15-13(10-17)3-2-4-18-15/h2-4,9,11H,5-8H2,1H3 IFFRIAVWVXMAOC-UHFFFAOYSA-N 50193138 CHEMBL3974494 Cholinesterase 780 ChEMBL 10.1016/j.ejmech.2016.04.053 10.7270/Q2319XT7 27227482 Kumar, J; Meena, P; Singh, A; Jameel, E; Maqbool, M; Mobashir, M; Shandilya, A; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50193138 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50193138&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 51282820 375076147 CHEMBL3974494 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50520049 CCOC(=O)c1cnc2ccc(F)cc2c1N1CCN(CC1)c1cc(C)nc2ncnn12 InChI=1S/C22H22FN7O2/c1-3-32-21(31)17-12-24-18-5-4-15(23)11-16(18)20(17)29-8-6-28(7-9-29)19-10-14(2)27-22-25-13-26-30(19)22/h4-5,10-13H,3,6-9H2,1-2H3 NHUYKRWOSFLPHU-UHFFFAOYSA-N 50193130 CHEMBL3908209 Cholinesterase 510 ChEMBL 10.1016/j.ejmech.2016.04.053 10.7270/Q2319XT7 27227482 Kumar, J; Meena, P; Singh, A; Jameel, E; Maqbool, M; Mobashir, M; Shandilya, A; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50193130 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50193130&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134131941 375076139 CHEMBL3908209 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51014486 CN1CCC=C(C1)c1nsnc1OCCCOCCCCC(=O)NCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C37H54N6O3S/c1-43-24-14-16-29(28-43)35-37(42-47-41-35)46-27-15-26-45-25-13-10-21-34(44)38-22-11-4-2-3-5-12-23-39-36-30-17-6-8-19-32(30)40-33-20-9-7-18-31(33)36/h6,8,16-17,19H,2-5,7,9-15,18,20-28H2,1H3,(H,38,44)(H,39,40) SJCQMSFAOMNDNV-UHFFFAOYSA-N 50415461 CHEMBL589352 Cholinesterase 5.89 ChEMBL 10.1021/jm901616h 10.7270/Q2KW5H8J 20158205 Fang, L; Jumpertz, S; Zhang, Y; Appenroth, D; Fleck, C; Mohr, K; Trankle, C; Decker, M China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50415461 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50415461&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 45139786 163364485 CHEMBL589352 ZINC49746758 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51014487 CN1CCC=C(C1)c1nsnc1OCCCOCCCC(=O)NCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C36H52N6O3S/c1-42-23-12-15-28(27-42)34-36(41-46-40-34)45-26-14-25-44-24-13-20-33(43)37-21-10-4-2-3-5-11-22-38-35-29-16-6-8-18-31(29)39-32-19-9-7-17-30(32)35/h6,8,15-16,18H,2-5,7,9-14,17,19-27H2,1H3,(H,37,43)(H,38,39) RJLWTIWBORUOFS-UHFFFAOYSA-N 50415462 CHEMBL589384 Cholinesterase 5.01 ChEMBL 10.1021/jm901616h 10.7270/Q2KW5H8J 20158205 Fang, L; Jumpertz, S; Zhang, Y; Appenroth, D; Fleck, C; Mohr, K; Trankle, C; Decker, M China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50415462 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50415462&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 45139785 163364486 CHEMBL589384 ZINC49746049 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51014488 CN1CCC=C(C1)c1nsnc1OCCCOCCC(=O)NCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C35H50N6O3S/c1-41-22-12-14-27(26-41)33-35(40-45-39-33)44-24-13-23-43-25-19-32(42)36-20-10-4-2-3-5-11-21-37-34-28-15-6-8-17-30(28)38-31-18-9-7-16-29(31)34/h6,8,14-15,17H,2-5,7,9-13,16,18-26H2,1H3,(H,36,42)(H,37,38) CFWKOGVQRHXYDF-UHFFFAOYSA-N 50415463 CHEMBL589495 Cholinesterase 13.18 ChEMBL 10.1021/jm901616h 10.7270/Q2KW5H8J 20158205 Fang, L; Jumpertz, S; Zhang, Y; Appenroth, D; Fleck, C; Mohr, K; Trankle, C; Decker, M China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50415463 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50415463&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 45139603 163364487 CHEMBL589495 ZINC49745829 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51014489 CN1CCC=C(C1)c1nsnc1OCCCOCC(=O)NCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C34H48N6O3S/c1-40-21-12-14-26(24-40)32-34(39-44-38-32)43-23-13-22-42-25-31(41)35-19-10-4-2-3-5-11-20-36-33-27-15-6-8-17-29(27)37-30-18-9-7-16-28(30)33/h6,8,14-15,17H,2-5,7,9-13,16,18-25H2,1H3,(H,35,41)(H,36,37) GFHYQYKEVCHEJJ-UHFFFAOYSA-N 50415464 CHEMBL589405 Cholinesterase 5.13 ChEMBL 10.1021/jm901616h 10.7270/Q2KW5H8J 20158205 Fang, L; Jumpertz, S; Zhang, Y; Appenroth, D; Fleck, C; Mohr, K; Trankle, C; Decker, M China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50415464 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50415464&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 45139602 163364488 CHEMBL589405 ZINC49746651 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51014490 CN1CCC=C(C1)c1nsnc1OCCCOCCCCC(=O)NCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C33H46N6O3S/c1-39-20-10-12-25(24-39)31-33(38-43-37-31)42-23-11-22-41-21-9-6-17-30(40)34-18-7-8-19-35-32-26-13-2-4-15-28(26)36-29-16-5-3-14-27(29)32/h2,4,12-13,15H,3,5-11,14,16-24H2,1H3,(H,34,40)(H,35,36) FTWKOTDTSQWSAL-UHFFFAOYSA-N 50415465 CHEMBL589409 Cholinesterase 5.89 ChEMBL 10.1021/jm901616h 10.7270/Q2KW5H8J 20158205 Fang, L; Jumpertz, S; Zhang, Y; Appenroth, D; Fleck, C; Mohr, K; Trankle, C; Decker, M China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50415465 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50415465&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 45139601 163364489 CHEMBL589409 ZINC49746763 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51014491 CN1CCC=C(C1)c1nsnc1OCCCOCCC(=O)NCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C31H42N6O3S/c1-37-18-8-10-23(22-37)29-31(36-41-35-29)40-20-9-19-39-21-15-28(38)32-16-6-7-17-33-30-24-11-2-4-13-26(24)34-27-14-5-3-12-25(27)30/h2,4,10-11,13H,3,5-9,12,14-22H2,1H3,(H,32,38)(H,33,34) UFDWCHMFGTWGGU-UHFFFAOYSA-N 50415466 CHEMBL589419 Cholinesterase 9.12 ChEMBL 10.1021/jm901616h 10.7270/Q2KW5H8J 20158205 Fang, L; Jumpertz, S; Zhang, Y; Appenroth, D; Fleck, C; Mohr, K; Trankle, C; Decker, M China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50415466 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50415466&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 45139421 163364490 CHEMBL589419 ZINC49746956 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51014492 CN1CCC=C(C1)c1nsnc1OCCCOCC(=O)NCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C30H40N6O3S/c1-36-17-8-10-22(20-36)28-30(35-40-34-28)39-19-9-18-38-21-27(37)31-15-6-7-16-32-29-23-11-2-4-13-25(23)33-26-14-5-3-12-24(26)29/h2,4,10-11,13H,3,5-9,12,14-21H2,1H3,(H,31,37)(H,32,33) MKCGPASFXDHNRR-UHFFFAOYSA-N 50415467 CHEMBL597801 Cholinesterase 10.72 ChEMBL 10.1021/jm901616h 10.7270/Q2KW5H8J 20158205 Fang, L; Jumpertz, S; Zhang, Y; Appenroth, D; Fleck, C; Mohr, K; Trankle, C; Decker, M China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50415467 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50415467&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 45139420 163364491 CHEMBL597801 ZINC49762363 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51014493 CN1CCC=C(C1)c1nsnc1OCCCOCCCCC(=O)NCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C32H44N6O3S/c1-38-19-8-11-24(23-38)30-32(37-42-36-30)41-22-10-21-40-20-7-6-16-29(39)33-17-9-18-34-31-25-12-2-4-14-27(25)35-28-15-5-3-13-26(28)31/h2,4,11-12,14H,3,5-10,13,15-23H2,1H3,(H,33,39)(H,34,35) OOGJFMGCOJHKAP-UHFFFAOYSA-N 50415468 CHEMBL590059 Cholinesterase 8.91 ChEMBL 10.1021/jm901616h 10.7270/Q2KW5H8J 20158205 Fang, L; Jumpertz, S; Zhang, Y; Appenroth, D; Fleck, C; Mohr, K; Trankle, C; Decker, M China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50415468 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50415468&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 45139419 163364492 CHEMBL590059 ZINC49745588 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51014494 CN1CCC=C(C1)c1nsnc1OCCCOCCCC(=O)NCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C31H42N6O3S/c1-37-18-6-10-23(22-37)29-31(36-41-35-29)40-21-9-20-39-19-7-15-28(38)32-16-8-17-33-30-24-11-2-4-13-26(24)34-27-14-5-3-12-25(27)30/h2,4,10-11,13H,3,5-9,12,14-22H2,1H3,(H,32,38)(H,33,34) JTFYAHITKTWTLJ-UHFFFAOYSA-N 50415469 CHEMBL590055 Cholinesterase 10 ChEMBL 10.1021/jm901616h 10.7270/Q2KW5H8J 20158205 Fang, L; Jumpertz, S; Zhang, Y; Appenroth, D; Fleck, C; Mohr, K; Trankle, C; Decker, M China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50415469 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50415469&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 45139418 163364493 CHEMBL590055 ZINC49756045 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51014495 CN1CCC=C(C1)c1nsnc1OCCCOCCC(=O)NCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C30H40N6O3S/c1-36-17-6-9-22(21-36)28-30(35-40-34-28)39-19-8-18-38-20-14-27(37)31-15-7-16-32-29-23-10-2-4-12-25(23)33-26-13-5-3-11-24(26)29/h2,4,9-10,12H,3,5-8,11,13-21H2,1H3,(H,31,37)(H,32,33) NQOJKHOPNJCSSZ-UHFFFAOYSA-N 50415470 CHEMBL599243 Cholinesterase 10.72 ChEMBL 10.1021/jm901616h 10.7270/Q2KW5H8J 20158205 Fang, L; Jumpertz, S; Zhang, Y; Appenroth, D; Fleck, C; Mohr, K; Trankle, C; Decker, M China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50415470 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50415470&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 45139417 163364494 CHEMBL599243 ZINC49762837 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51014496 CN1CCC=C(C1)c1nsnc1OCCCOCC(=O)NCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C29H38N6O3S/c1-35-16-6-9-21(19-35)27-29(34-39-33-27)38-18-8-17-37-20-26(36)30-14-7-15-31-28-22-10-2-4-12-24(22)32-25-13-5-3-11-23(25)28/h2,4,9-10,12H,3,5-8,11,13-20H2,1H3,(H,30,36)(H,31,32) TWBSOPHBKGTCSD-UHFFFAOYSA-N 50415471 CHEMBL599652 Cholinesterase 9.77 ChEMBL 10.1021/jm901616h 10.7270/Q2KW5H8J 20158205 Fang, L; Jumpertz, S; Zhang, Y; Appenroth, D; Fleck, C; Mohr, K; Trankle, C; Decker, M China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50415471 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50415471&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 45142235 163364495 CHEMBL599652 ZINC49762840 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51014497 CN1CCC=C(C1)c1nsnc1OCCCCNCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C33H48N6OS/c1-39-23-14-15-26(25-39)31-33(38-41-37-31)40-24-13-12-21-34-20-10-4-2-3-5-11-22-35-32-27-16-6-8-18-29(27)36-30-19-9-7-17-28(30)32/h6,8,15-16,18,34H,2-5,7,9-14,17,19-25H2,1H3,(H,35,36) FWWHROPNFJVMDD-UHFFFAOYSA-N 50415472 CHEMBL589978 Cholinesterase 13.49 ChEMBL 10.1021/jm901616h 10.7270/Q2KW5H8J 20158205 Fang, L; Jumpertz, S; Zhang, Y; Appenroth, D; Fleck, C; Mohr, K; Trankle, C; Decker, M China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50415472 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50415472&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46228715 163364496 CHEMBL589978 ZINC49746460 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51014498 CN1CCC=C(C1)c1nsnc1OCCCCNCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C30H42N6OS/c1-36-20-11-12-23(22-36)28-30(35-38-34-28)37-21-10-9-18-31-17-7-2-8-19-32-29-24-13-3-5-15-26(24)33-27-16-6-4-14-25(27)29/h3,5,12-13,15,31H,2,4,6-11,14,16-22H2,1H3,(H,32,33) AUCWQMMKRXKOPQ-UHFFFAOYSA-N 50415473 CHEMBL599651 Cholinesterase 12.3 ChEMBL 10.1021/jm901616h 10.7270/Q2KW5H8J 20158205 Fang, L; Jumpertz, S; Zhang, Y; Appenroth, D; Fleck, C; Mohr, K; Trankle, C; Decker, M China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50415473 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50415473&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46228714 163364497 CHEMBL599651 ZINC45368841 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51014499 CN1CCC=C(C1)c1nsnc1OCCCCNCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C29H40N6OS/c1-35-19-10-11-22(21-35)27-29(34-37-33-27)36-20-9-8-17-30-16-6-7-18-31-28-23-12-2-4-14-25(23)32-26-15-5-3-13-24(26)28/h2,4,11-12,14,30H,3,5-10,13,15-21H2,1H3,(H,31,32) MCTLLLGXTWSHKF-UHFFFAOYSA-N 50415474 CHEMBL599650 Cholinesterase 16.22 ChEMBL 10.1021/jm901616h 10.7270/Q2KW5H8J 20158205 Fang, L; Jumpertz, S; Zhang, Y; Appenroth, D; Fleck, C; Mohr, K; Trankle, C; Decker, M China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50415474 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50415474&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46228713 163364498 CHEMBL599650 ZINC45368836 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51014500 CN1CCC=C(C1)c1nsnc1OCCCCNCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C28H38N6OS/c1-34-18-8-10-21(20-34)26-28(33-36-32-26)35-19-7-6-15-29-16-9-17-30-27-22-11-2-4-13-24(22)31-25-14-5-3-12-23(25)27/h2,4,10-11,13,29H,3,5-9,12,14-20H2,1H3,(H,30,31) DVECOLWIOOJDML-UHFFFAOYSA-N 50415475 CHEMBL597192 Cholinesterase 28.84 ChEMBL 10.1021/jm901616h 10.7270/Q2KW5H8J 20158205 Fang, L; Jumpertz, S; Zhang, Y; Appenroth, D; Fleck, C; Mohr, K; Trankle, C; Decker, M China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50415475 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50415475&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46228684 163364499 CHEMBL597192 ZINC45366550 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51014501 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 5.13 ChEMBL 10.1021/jm901616h 10.7270/Q2KW5H8J 20158205 Fang, L; Jumpertz, S; Zhang, Y; Appenroth, D; Fleck, C; Mohr, K; Trankle, C; Decker, M China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51014519 CN1CCC=C(C1)c1nsnc1OCCCOCCCC(=O)NCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C32H44N6O3S/c1-38-19-8-11-24(23-38)30-32(37-42-36-30)41-22-10-21-40-20-9-16-29(39)33-17-6-7-18-34-31-25-12-2-4-14-27(25)35-28-15-5-3-13-26(28)31/h2,4,11-12,14H,3,5-10,13,15-23H2,1H3,(H,33,39)(H,34,35) WSQWFQGNZPVTQC-UHFFFAOYSA-N 50415476 CHEMBL589496 Cholinesterase 6.76 ChEMBL 10.1021/jm901616h 10.7270/Q2KW5H8J 20158205 Fang, L; Jumpertz, S; Zhang, Y; Appenroth, D; Fleck, C; Mohr, K; Trankle, C; Decker, M China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50415476 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50415476&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 45139600 163364500 CHEMBL589496 ZINC49745832 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51019434 CCCCNC(=O)Oc1ccc(CC(=O)NC2CCN(Cc3ccccc3)CC2)cc1 InChI=1S/C25H33N3O3/c1-2-3-15-26-25(30)31-23-11-9-20(10-12-23)18-24(29)27-22-13-16-28(17-14-22)19-21-7-5-4-6-8-21/h4-12,22H,2-3,13-19H2,1H3,(H,26,30)(H,27,29) SVXXZBLSJBBBKW-UHFFFAOYSA-N 50417521 CHEMBL1632336 Cholinesterase 11748.98 ChEMBL 10.1016/j.ejmech.2010.09.010 10.7270/Q2ZP47CJ 20926161 Wieckowska, A; Bajda, M; Guzior, N; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50417521 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50417521&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 24894146 163366545 CHEMBL1632336 ZINC66262583 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51019435 CCCNC(=O)Oc1ccc(CC(=O)NC2CCN(Cc3ccccc3)CC2)cc1 InChI=1S/C24H31N3O3/c1-2-14-25-24(29)30-22-10-8-19(9-11-22)17-23(28)26-21-12-15-27(16-13-21)18-20-6-4-3-5-7-20/h3-11,21H,2,12-18H2,1H3,(H,25,29)(H,26,28) RCHNWNONXBVBRJ-UHFFFAOYSA-N 50417522 CHEMBL1629775 Cholinesterase 9332.54 ChEMBL 10.1016/j.ejmech.2010.09.010 10.7270/Q2ZP47CJ 20926161 Wieckowska, A; Bajda, M; Guzior, N; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50417522 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50417522&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 50906632 163366546 CHEMBL1629775 ZINC66263016 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51019436 CC(C)NC(=O)Oc1ccc(CC(=O)NC2CCN(Cc3ccccc3)CC2)cc1 InChI=1S/C24H31N3O3/c1-18(2)25-24(29)30-22-10-8-19(9-11-22)16-23(28)26-21-12-14-27(15-13-21)17-20-6-4-3-5-7-20/h3-11,18,21H,12-17H2,1-2H3,(H,25,29)(H,26,28) VEDNYBRZFUMIPL-UHFFFAOYSA-N 50417523 CHEMBL1629776 Cholinesterase 18197.01 ChEMBL 10.1016/j.ejmech.2010.09.010 10.7270/Q2ZP47CJ 20926161 Wieckowska, A; Bajda, M; Guzior, N; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50417523 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50417523&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 50906633 163366547 CHEMBL1629776 ZINC66263018 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51019437 CCNC(=O)Oc1ccc(CC(=O)NC2CCN(Cc3ccccc3)CC2)cc1 InChI=1S/C23H29N3O3/c1-2-24-23(28)29-21-10-8-18(9-11-21)16-22(27)25-20-12-14-26(15-13-20)17-19-6-4-3-5-7-19/h3-11,20H,2,12-17H2,1H3,(H,24,28)(H,25,27) PICZSNSCGRFHTC-UHFFFAOYSA-N 50417524 CHEMBL1629774 Cholinesterase 10715.19 ChEMBL 10.1016/j.ejmech.2010.09.010 10.7270/Q2ZP47CJ 20926161 Wieckowska, A; Bajda, M; Guzior, N; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50417524 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50417524&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 50906634 163366548 CHEMBL1629774 ZINC66258337 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51019438 CCCCNC(=O)Oc1cccc(CC(=O)NC2CCN(Cc3ccccc3)CC2)c1 InChI=1S/C25H33N3O3/c1-2-3-14-26-25(30)31-23-11-7-10-21(17-23)18-24(29)27-22-12-15-28(16-13-22)19-20-8-5-4-6-9-20/h4-11,17,22H,2-3,12-16,18-19H2,1H3,(H,26,30)(H,27,29) DBHBDHZSFNXCAV-UHFFFAOYSA-N 50417525 CHEMBL1629779 Cholinesterase 5754.4 ChEMBL 10.1016/j.ejmech.2010.09.010 10.7270/Q2ZP47CJ 20926161 Wieckowska, A; Bajda, M; Guzior, N; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50417525 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50417525&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 50906845 163366549 CHEMBL1629779 ZINC66259596 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51019439 CC(C)NC(=O)Oc1cccc(CC(=O)NC2CCN(Cc3ccccc3)CC2)c1 InChI=1S/C24H31N3O3/c1-18(2)25-24(29)30-22-10-6-9-20(15-22)16-23(28)26-21-11-13-27(14-12-21)17-19-7-4-3-5-8-19/h3-10,15,18,21H,11-14,16-17H2,1-2H3,(H,25,29)(H,26,28) VNRAANSZUZZDQQ-UHFFFAOYSA-N 50417526 CHEMBL1629780 Cholinesterase 29512.09 ChEMBL 10.1016/j.ejmech.2010.09.010 10.7270/Q2ZP47CJ 20926161 Wieckowska, A; Bajda, M; Guzior, N; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50417526 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50417526&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 50906846 163366550 CHEMBL1629780 ZINC66259597 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51019440 CCNC(=O)Oc1cccc(CC(=O)NC2CCN(Cc3ccccc3)CC2)c1 InChI=1S/C23H29N3O3/c1-2-24-23(28)29-21-10-6-9-19(15-21)16-22(27)25-20-11-13-26(14-12-20)17-18-7-4-3-5-8-18/h3-10,15,20H,2,11-14,16-17H2,1H3,(H,24,28)(H,25,27) JGJCTTZJTMDYQZ-UHFFFAOYSA-N 50417527 CHEMBL1629781 Cholinesterase 37153.52 ChEMBL 10.1016/j.ejmech.2010.09.010 10.7270/Q2ZP47CJ 20926161 Wieckowska, A; Bajda, M; Guzior, N; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50417527 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50417527&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 50906847 163366551 CHEMBL1629781 ZINC66259598 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51019441 CN(C)C(=O)Oc1cccc(CC(=O)NC2CCN(Cc3ccccc3)CC2)c1 InChI=1S/C23H29N3O3/c1-25(2)23(28)29-21-10-6-9-19(15-21)16-22(27)24-20-11-13-26(14-12-20)17-18-7-4-3-5-8-18/h3-10,15,20H,11-14,16-17H2,1-2H3,(H,24,27) OFDFUWNLVWQILT-UHFFFAOYSA-N 50417528 CHEMBL1629782 Cholinesterase 21877.62 ChEMBL 10.1016/j.ejmech.2010.09.010 10.7270/Q2ZP47CJ 20926161 Wieckowska, A; Bajda, M; Guzior, N; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50417528 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50417528&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 50906848 163366552 CHEMBL1629782 ZINC66251828 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51019442 CCCCNC(=O)Oc1ccc(CC(=O)N2CCN(Cc3ccccc3)CC2)cc1 InChI=1S/C24H31N3O3/c1-2-3-13-25-24(29)30-22-11-9-20(10-12-22)18-23(28)27-16-14-26(15-17-27)19-21-7-5-4-6-8-21/h4-12H,2-3,13-19H2,1H3,(H,25,29) KRNOYPANFWHSGX-UHFFFAOYSA-N 50417529 CHEMBL1629784 Cholinesterase 16595.87 ChEMBL 10.1016/j.ejmech.2010.09.010 10.7270/Q2ZP47CJ 20926161 Wieckowska, A; Bajda, M; Guzior, N; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50417529 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50417529&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 50906850 163366553 CHEMBL1629784 ZINC66251830 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51019443 CCCNC(=O)Oc1ccc(CC(=O)N2CCN(Cc3ccccc3)CC2)cc1 InChI=1S/C23H29N3O3/c1-2-12-24-23(28)29-21-10-8-19(9-11-21)17-22(27)26-15-13-25(14-16-26)18-20-6-4-3-5-7-20/h3-11H,2,12-18H2,1H3,(H,24,28) NASCTMKWNGBKTM-UHFFFAOYSA-N 50417530 CHEMBL1629785 Cholinesterase 32359.37 ChEMBL 10.1016/j.ejmech.2010.09.010 10.7270/Q2ZP47CJ 20926161 Wieckowska, A; Bajda, M; Guzior, N; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50417530 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50417530&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 50907045 163366554 CHEMBL1629785 ZINC66251831 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51019444 CC(C)NC(=O)Oc1ccc(CC(=O)N2CCN(Cc3ccccc3)CC2)cc1 InChI=1S/C23H29N3O3/c1-18(2)24-23(28)29-21-10-8-19(9-11-21)16-22(27)26-14-12-25(13-15-26)17-20-6-4-3-5-7-20/h3-11,18H,12-17H2,1-2H3,(H,24,28) DLDSJXMOIAHUQV-UHFFFAOYSA-N 50417531 CHEMBL1629786 Cholinesterase 52480.75 ChEMBL 10.1016/j.ejmech.2010.09.010 10.7270/Q2ZP47CJ 20926161 Wieckowska, A; Bajda, M; Guzior, N; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50417531 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50417531&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 50907046 163366555 CHEMBL1629786 ZINC66252049 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51019445 CCNC(=O)Oc1ccc(CC(=O)N2CCN(Cc3ccccc3)CC2)cc1 InChI=1S/C22H27N3O3/c1-2-23-22(27)28-20-10-8-18(9-11-20)16-21(26)25-14-12-24(13-15-25)17-19-6-4-3-5-7-19/h3-11H,2,12-17H2,1H3,(H,23,27) VJBCCMPQUXMJAW-UHFFFAOYSA-N 50417532 CHEMBL1629787 Cholinesterase 43651.58 ChEMBL 10.1016/j.ejmech.2010.09.010 10.7270/Q2ZP47CJ 20926161 Wieckowska, A; Bajda, M; Guzior, N; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50417532 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50417532&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 50907047 163366556 CHEMBL1629787 ZINC66252050 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51019446 CCCCNC(=O)Oc1cccc(CC(=O)N2CCN(Cc3ccccc3)CC2)c1 InChI=1S/C24H31N3O3/c1-2-3-12-25-24(29)30-22-11-7-10-21(17-22)18-23(28)27-15-13-26(14-16-27)19-20-8-5-4-6-9-20/h4-11,17H,2-3,12-16,18-19H2,1H3,(H,25,29) XJMLVTCXHHVNIJ-UHFFFAOYSA-N 50417533 CHEMBL1629790 Cholinesterase 10000 ChEMBL 10.1016/j.ejmech.2010.09.010 10.7270/Q2ZP47CJ 20926161 Wieckowska, A; Bajda, M; Guzior, N; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50417533 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50417533&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 50907248 163366557 CHEMBL1629790 ZINC66251327 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51019447 CC(C)NC(=O)Oc1cccc(CC(=O)N2CCN(Cc3ccccc3)CC2)c1 InChI=1S/C23H29N3O3/c1-18(2)24-23(28)29-21-10-6-9-20(15-21)16-22(27)26-13-11-25(12-14-26)17-19-7-4-3-5-8-19/h3-10,15,18H,11-14,16-17H2,1-2H3,(H,24,28) BJNVNXAPSZVNOR-UHFFFAOYSA-N 50417534 CHEMBL1629791 Cholinesterase 35481.34 ChEMBL 10.1016/j.ejmech.2010.09.010 10.7270/Q2ZP47CJ 20926161 Wieckowska, A; Bajda, M; Guzior, N; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50417534 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50417534&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 50907249 163366558 CHEMBL1629791 ZINC66251328 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51019448 CCNC(=O)Oc1cccc(CC(=O)N2CCN(Cc3ccccc3)CC2)c1 InChI=1S/C22H27N3O3/c1-2-23-22(27)28-20-10-6-9-19(15-20)16-21(26)25-13-11-24(12-14-25)17-18-7-4-3-5-8-18/h3-10,15H,2,11-14,16-17H2,1H3,(H,23,27) CEHDTVYYGVUUHH-UHFFFAOYSA-N 50417535 CHEMBL1629792 Cholinesterase 54954.09 ChEMBL 10.1016/j.ejmech.2010.09.010 10.7270/Q2ZP47CJ 20926161 Wieckowska, A; Bajda, M; Guzior, N; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50417535 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50417535&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 50907250 163366559 CHEMBL1629792 ZINC66251329 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51019449 CN(C)C(=O)Oc1cccc(CC(=O)N2CCN(Cc3ccccc3)CC2)c1 InChI=1S/C22H27N3O3/c1-23(2)22(27)28-20-10-6-9-19(15-20)16-21(26)25-13-11-24(12-14-25)17-18-7-4-3-5-8-18/h3-10,15H,11-14,16-17H2,1-2H3 VFFXVSIUJKVLQP-UHFFFAOYSA-N 50417536 CHEMBL1629793 Cholinesterase 23442.29 ChEMBL 10.1016/j.ejmech.2010.09.010 10.7270/Q2ZP47CJ 20926161 Wieckowska, A; Bajda, M; Guzior, N; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50417536 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50417536&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 50907251 163366560 CHEMBL1629793 ZINC66251330 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51019450 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 4.9 ChEMBL 10.1016/j.ejmech.2010.09.010 10.7270/Q2ZP47CJ 20926161 Wieckowska, A; Bajda, M; Guzior, N; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51019451 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 10620 (S)-3-(1-(dimethylamino)ethyl)phenyl ethyl(methyl)carbamate::3-((1S)-1-(Dimethylamino)ethyl)phenyl N-ethyl N-methyl carbamate::3-(1-(dimethylamino)ethyl)phenyl ethyl(methyl)carbamate::3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::CHEMBL636::ENA-713::Ethyl-methyl-carbamic acid 3-((R)-1-dimethylamino-ethyl)-phenyl ester::Ethyl-methyl-carbamic acid 3-((S)-1-dimethylamino-ethyl)-phenyl ester::Ethyl-methyl-carbamic acid 3-(1-dimethylamino-ethyl)-phenyl ester::Exelon::Rivastigmine::Rivastigmine (1)::SDZ-212-713::SDZ-ENA-713 Cholinesterase 831.76 ChEMBL 10.1016/j.ejmech.2010.09.010 10.7270/Q2ZP47CJ 20926161 Wieckowska, A; Bajda, M; Guzior, N; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10620 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10620&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46511221 8874 CHEMBL636 DB00989 6602 C11766 ZINC00004413 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51019452 CN(C)C(=O)Oc1ccc(CC(=O)NC2CCN(Cc3ccccc3)CC2)cc1 InChI=1S/C23H29N3O3/c1-25(2)23(28)29-21-10-8-18(9-11-21)16-22(27)24-20-12-14-26(15-13-20)17-19-6-4-3-5-7-19/h3-11,20H,12-17H2,1-2H3,(H,24,27) VICLNIKHOVPNED-UHFFFAOYSA-N 50417537 CHEMBL1629777 Cholinesterase 8912.51 ChEMBL 10.1016/j.ejmech.2010.09.010 10.7270/Q2ZP47CJ 20926161 Wieckowska, A; Bajda, M; Guzior, N; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50417537 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50417537&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 50906635 163366561 CHEMBL1629777 ZINC66166774 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51070287 COc1cc(OC)cc(\C=C\c2ccc(NCc3cc(ccc3O)N(C)C)cc2)c1 InChI=1S/C25H28N2O3/c1-27(2)22-11-12-25(28)20(15-22)17-26-21-9-7-18(8-10-21)5-6-19-13-23(29-3)16-24(14-19)30-4/h5-16,26,28H,17H2,1-4H3/b6-5+ ARWNSSJFJLNQOG-AATRIKPKSA-N 50437193 CHEMBL2402067 Cholinesterase >50000 ChEMBL 10.1021/jm400567s 10.7270/Q2C53N8B 23799643 Lu, C; Guo, Y; Yan, J; Luo, Z; Luo, HB; Yan, M; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50437193 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50437193&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71764406 175449510 CHEMBL2402067 ZINC96273099 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51070288 CN(C)c1ccc(O)c(CNc2ccc(\C=C\c3cc(O)cc(O)c3)cc2)c1 InChI=1S/C23H24N2O3/c1-25(2)20-9-10-23(28)18(13-20)15-24-19-7-5-16(6-8-19)3-4-17-11-21(26)14-22(27)12-17/h3-14,24,26-28H,15H2,1-2H3/b4-3+ GYDUDZPNGRTASE-ONEGZZNKSA-N 50437194 CHEMBL2402160 Cholinesterase 21250 ChEMBL 10.1021/jm400567s 10.7270/Q2C53N8B 23799643 Lu, C; Guo, Y; Yan, J; Luo, Z; Luo, HB; Yan, M; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50437194 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50437194&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71764831 175449511 CHEMBL2402160 ZINC96273100 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067084 OC1(CCN(CC1)C(=O)CCCOc1cc(=O)oc2ccccc12)c1ccc(Br)cc1 InChI=1S/C24H24BrNO5/c25-18-9-7-17(8-10-18)24(29)11-13-26(14-12-24)22(27)6-3-15-30-21-16-23(28)31-20-5-2-1-4-19(20)21/h1-2,4-5,7-10,16,29H,3,6,11-15H2 OFHHZLOUFGBSEO-UHFFFAOYSA-N 50435585 CHEMBL2393512 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2013.03.021 10.7270/Q2ZG6TNV 23644208 Razavi, SF; Khoobi, M; Nadri, H; Sakhteman, A; Moradi, A; Emami, S; Foroumadi, A; Shafiee, A University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435585 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435585&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71698683 175447902 CHEMBL2393512 ZINC96271525 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067085 OC1(CCN(CC1)C(=O)COc1cc(=O)oc2ccccc12)c1ccc(Cl)cc1 InChI=1S/C22H20ClNO5/c23-16-7-5-15(6-8-16)22(27)9-11-24(12-10-22)20(25)14-28-19-13-21(26)29-18-4-2-1-3-17(18)19/h1-8,13,27H,9-12,14H2 OXLYGBFMBXURMS-UHFFFAOYSA-N 50435586 CHEMBL2393511 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2013.03.021 10.7270/Q2ZG6TNV 23644208 Razavi, SF; Khoobi, M; Nadri, H; Sakhteman, A; Moradi, A; Emami, S; Foroumadi, A; Shafiee, A University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435586 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435586&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71698682 175447903 CHEMBL2393511 ZINC96271526 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067086 OC1(CCN(CC1)C(=O)COc1cc(=O)oc2ccccc12)c1ccc(Br)cc1 InChI=1S/C22H20BrNO5/c23-16-7-5-15(6-8-16)22(27)9-11-24(12-10-22)20(25)14-28-19-13-21(26)29-18-4-2-1-3-17(18)19/h1-8,13,27H,9-12,14H2 SFCUHNJETIBXQM-UHFFFAOYSA-N 50435587 CHEMBL2393510 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2013.03.021 10.7270/Q2ZG6TNV 23644208 Razavi, SF; Khoobi, M; Nadri, H; Sakhteman, A; Moradi, A; Emami, S; Foroumadi, A; Shafiee, A University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435587 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435587&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71698681 175447904 CHEMBL2393510 ZINC96271527 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067087 O=C(CCCOc1cc(=O)oc2ccccc12)NC1CCN(Cc2ccccc2)CC1 InChI=1S/C25H28N2O4/c28-24(26-20-12-14-27(15-13-20)18-19-7-2-1-3-8-19)11-6-16-30-23-17-25(29)31-22-10-5-4-9-21(22)23/h1-5,7-10,17,20H,6,11-16,18H2,(H,26,28) OQQJACYMHXMQOJ-UHFFFAOYSA-N 50435588 CHEMBL2393509 Cholinesterase 41000 ChEMBL 10.1016/j.ejmech.2013.03.021 10.7270/Q2ZG6TNV 23644208 Razavi, SF; Khoobi, M; Nadri, H; Sakhteman, A; Moradi, A; Emami, S; Foroumadi, A; Shafiee, A University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435588 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435588&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71698592 175447905 CHEMBL2393509 ZINC96271528 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067088 O=C(COc1cc(=O)oc2ccccc12)NC1CCN(Cc2ccccc2)CC1 InChI=1S/C23H24N2O4/c26-22(16-28-21-14-23(27)29-20-9-5-4-8-19(20)21)24-18-10-12-25(13-11-18)15-17-6-2-1-3-7-17/h1-9,14,18H,10-13,15-16H2,(H,24,26) JFNNVUVYWSVONQ-UHFFFAOYSA-N 50435589 CHEMBL2393508 Cholinesterase 45000 ChEMBL 10.1016/j.ejmech.2013.03.021 10.7270/Q2ZG6TNV 23644208 Razavi, SF; Khoobi, M; Nadri, H; Sakhteman, A; Moradi, A; Emami, S; Foroumadi, A; Shafiee, A University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435589 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435589&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71698591 175447906 CHEMBL2393508 ZINC96271529 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067089 O=C(CCCOc1cc(=O)oc2ccccc12)N1CCC(Cc2ccccc2)CC1 InChI=1S/C25H27NO4/c27-24(26-14-12-20(13-15-26)17-19-7-2-1-3-8-19)11-6-16-29-23-18-25(28)30-22-10-5-4-9-21(22)23/h1-5,7-10,18,20H,6,11-17H2 WWCCTNJSLRMIRU-UHFFFAOYSA-N 50435590 CHEMBL2390982 Cholinesterase 76000 ChEMBL 10.1016/j.ejmech.2013.03.021 10.7270/Q2ZG6TNV 23644208 Razavi, SF; Khoobi, M; Nadri, H; Sakhteman, A; Moradi, A; Emami, S; Foroumadi, A; Shafiee, A University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435590 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435590&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71698590 175447907 CHEMBL2390982 ZINC96271530 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067090 O=C(COc1cc(=O)oc2ccccc12)N1CCC(Cc2ccccc2)CC1 InChI=1S/C23H23NO4/c25-22(16-27-21-15-23(26)28-20-9-5-4-8-19(20)21)24-12-10-18(11-13-24)14-17-6-2-1-3-7-17/h1-9,15,18H,10-14,16H2 PVZQZMAYZYAFRR-UHFFFAOYSA-N 50435591 CHEMBL2393507 Cholinesterase 65000 ChEMBL 10.1016/j.ejmech.2013.03.021 10.7270/Q2ZG6TNV 23644208 Razavi, SF; Khoobi, M; Nadri, H; Sakhteman, A; Moradi, A; Emami, S; Foroumadi, A; Shafiee, A University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435591 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435591&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71698589 175447908 CHEMBL2393507 ZINC96271531 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067091 Oc1ccccc1N1CCN(CC1)C(=O)CCCOc1cc(=O)oc2ccccc12 InChI=1S/C23H24N2O5/c26-19-8-3-2-7-18(19)24-11-13-25(14-12-24)22(27)10-5-15-29-21-16-23(28)30-20-9-4-1-6-17(20)21/h1-4,6-9,16,26H,5,10-15H2 FBPFFPKWWRMRCJ-UHFFFAOYSA-N 50435592 CHEMBL2393506 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2013.03.021 10.7270/Q2ZG6TNV 23644208 Razavi, SF; Khoobi, M; Nadri, H; Sakhteman, A; Moradi, A; Emami, S; Foroumadi, A; Shafiee, A University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435592 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435592&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71698588 175447909 CHEMBL2393506 ZINC96271532 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51074647 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCSc1ccccc1Cl InChI=1S/C27H23ClNO4S/c1-30-23-7-6-17-12-22-19-14-25-24(32-16-33-25)13-18(19)8-9-29(22)15-20(17)27(23)31-10-11-34-26-5-3-2-4-21(26)28/h2-7,12-15H,8-11,16H2,1H3/q+1 VNUKRHSBSQWOSO-UHFFFAOYSA-N 50439497 CHEMBL2418125 Cholinesterase 177 ChEMBL 10.1016/j.bmc.2013.07.011 10.7270/Q2VD70X8 23932451 Su, T; Xie, S; Wei, H; Yan, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439497 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439497&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72165105 175451814 CHEMBL2418125 ZINC96283232 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51074648 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCSc1ccccc1C InChI=1S/C28H26NO4S/c1-18-5-3-4-6-27(18)34-12-11-31-28-22-16-29-10-9-20-14-25-26(33-17-32-25)15-21(20)23(29)13-19(22)7-8-24(28)30-2/h3-8,13-16H,9-12,17H2,1-2H3/q+1 FHBNIGYBJLLYOQ-UHFFFAOYSA-N 50439500 CHEMBL2418122 Cholinesterase 299 ChEMBL 10.1016/j.bmc.2013.07.011 10.7270/Q2VD70X8 23932451 Su, T; Xie, S; Wei, H; Yan, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439500 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439500&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72165099 175451817 CHEMBL2418122 ZINC96283235 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51074651 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OC InChI=1S/C20H18NO4/c1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2/h3-4,7-10H,5-6,11H2,1-2H3/q+1 YBHILYKTIRIUTE-UHFFFAOYSA-N 50203126 3,4-dimethoxy-6,7-dihydro-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinolin-5-ylium::9,10-Dimethoxy-5,6-dihydro-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ylium::9,10-Dimethoxy-5,6-dihydro-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ylium chloride::9,10-dimethoxy-5,6-dihydro-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ylium; chloride::BERBERINE::Berberinechloride::CHEMBL12089::berberine dimer::cid_12456 Cholinesterase 18210 ChEMBL 10.1016/j.bmc.2013.07.011 10.7270/Q2VD70X8 23932451 Su, T; Xie, S; Wei, H; Yan, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50203126 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50203126&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search BER 7A3Y,1JUM,6JWD,3R6R,3VW2,4DBK,3BTI,7MSV,7X8M,3NP6,3D6Y,7X32,5Y0V,2QVD,7C34,7N7D,7N7E 12456 104082463 16118 CHEMBL12089 DB04115 C00757 ZINC03779067 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51074652 COc1ccccc1SCCOc1c(OC)ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc12 InChI=1S/C28H26NO5S/c1-30-23-5-3-4-6-27(23)35-12-11-32-28-21-16-29-10-9-19-14-25-26(34-17-33-25)15-20(19)22(29)13-18(21)7-8-24(28)31-2/h3-8,13-16H,9-12,17H2,1-2H3/q+1 IPSVUZJIOODGOP-UHFFFAOYSA-N 50439506 CHEMBL2418130 Cholinesterase 1092 ChEMBL 10.1016/j.bmc.2013.07.011 10.7270/Q2VD70X8 23932451 Su, T; Xie, S; Wei, H; Yan, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439506 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439506&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72163335 175451823 CHEMBL2418130 ZINC96283241 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51074653 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCSc1ccccc1F InChI=1S/C27H23FNO4S/c1-30-23-7-6-17-12-22-19-14-25-24(32-16-33-25)13-18(19)8-9-29(22)15-20(17)27(23)31-10-11-34-26-5-3-2-4-21(26)28/h2-7,12-15H,8-11,16H2,1H3/q+1 XCKUTSDGPCWQLI-UHFFFAOYSA-N 50439507 CHEMBL2418129 Cholinesterase 1756 ChEMBL 10.1016/j.bmc.2013.07.011 10.7270/Q2VD70X8 23932451 Su, T; Xie, S; Wei, H; Yan, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439507 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439507&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72163333 175451824 CHEMBL2418129 ZINC96283242 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51074654 CCc1ccccc1SCCOc1c(OC)ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc12 InChI=1S/C29H28NO4S/c1-3-19-6-4-5-7-28(19)35-13-12-32-29-23-17-30-11-10-21-15-26-27(34-18-33-26)16-22(21)24(30)14-20(23)8-9-25(29)31-2/h4-9,14-17H,3,10-13,18H2,1-2H3/q+1 LRHYLDPGYFNAMM-UHFFFAOYSA-N 50439508 CHEMBL2418128 Cholinesterase 1713 ChEMBL 10.1016/j.bmc.2013.07.011 10.7270/Q2VD70X8 23932451 Su, T; Xie, S; Wei, H; Yan, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439508 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439508&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72163331 175451825 CHEMBL2418128 ZINC96283243 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51074655 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCSc1ccc(Cl)cc1 InChI=1S/C27H23ClNO4S/c1-30-24-7-2-17-12-23-21-14-26-25(32-16-33-26)13-18(21)8-9-29(23)15-22(17)27(24)31-10-11-34-20-5-3-19(28)4-6-20/h2-7,12-15H,8-11,16H2,1H3/q+1 NDYPQGUMBWYLRL-UHFFFAOYSA-N 50439509 CHEMBL2418127 Cholinesterase 1401 ChEMBL 10.1016/j.bmc.2013.07.011 10.7270/Q2VD70X8 23932451 Su, T; Xie, S; Wei, H; Yan, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439509 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439509&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72163329 175451826 CHEMBL2418127 ZINC96283244 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51074656 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCSc1cccc(Cl)c1 InChI=1S/C27H23ClNO4S/c1-30-24-6-5-17-11-23-21-14-26-25(32-16-33-26)12-18(21)7-8-29(23)15-22(17)27(24)31-9-10-34-20-4-2-3-19(28)13-20/h2-6,11-15H,7-10,16H2,1H3/q+1 GAMODNZMRXQEOD-UHFFFAOYSA-N 50439510 CHEMBL2418126 Cholinesterase 1253 ChEMBL 10.1016/j.bmc.2013.07.011 10.7270/Q2VD70X8 23932451 Su, T; Xie, S; Wei, H; Yan, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439510 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439510&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72165107 175451827 CHEMBL2418126 ZINC96283245 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51074657 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCSc1ccccc1Cl InChI=1S/C27H23ClNO4S/c1-30-23-7-6-17-12-22-19-14-25-24(32-16-33-25)13-18(19)8-9-29(22)15-20(17)27(23)31-10-11-34-26-5-3-2-4-21(26)28/h2-7,12-15H,8-11,16H2,1H3/q+1 VNUKRHSBSQWOSO-UHFFFAOYSA-N 50439497 CHEMBL2418125 Cholinesterase 662 ChEMBL 10.1016/j.bmc.2013.07.011 10.7270/Q2VD70X8 23932451 Su, T; Xie, S; Wei, H; Yan, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439497 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439497&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72165105 175451814 CHEMBL2418125 ZINC96283232 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51074658 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCSc1ccc(C)cc1 InChI=1S/C28H26NO4S/c1-18-3-6-21(7-4-18)34-12-11-31-28-23-16-29-10-9-20-14-26-27(33-17-32-26)15-22(20)24(29)13-19(23)5-8-25(28)30-2/h3-8,13-16H,9-12,17H2,1-2H3/q+1 MTDXLJXTBWUGFE-UHFFFAOYSA-N 50439498 CHEMBL2418124 Cholinesterase 1794 ChEMBL 10.1016/j.bmc.2013.07.011 10.7270/Q2VD70X8 23932451 Su, T; Xie, S; Wei, H; Yan, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439498 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439498&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72165103 175451815 CHEMBL2418124 ZINC96283233 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51074659 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCSc1cccc(C)c1 InChI=1S/C28H26NO4S/c1-18-4-3-5-21(12-18)34-11-10-31-28-23-16-29-9-8-20-14-26-27(33-17-32-26)15-22(20)24(29)13-19(23)6-7-25(28)30-2/h3-7,12-16H,8-11,17H2,1-2H3/q+1 QJHWEYPNLCILFY-UHFFFAOYSA-N 50439499 CHEMBL2418123 Cholinesterase 1605 ChEMBL 10.1016/j.bmc.2013.07.011 10.7270/Q2VD70X8 23932451 Su, T; Xie, S; Wei, H; Yan, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439499 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439499&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72165101 175451816 CHEMBL2418123 ZINC96283234 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51074660 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCSc1ccccc1C InChI=1S/C28H26NO4S/c1-18-5-3-4-6-27(18)34-12-11-31-28-22-16-29-10-9-20-14-25-26(33-17-32-25)15-21(20)23(29)13-19(22)7-8-24(28)30-2/h3-8,13-16H,9-12,17H2,1-2H3/q+1 FHBNIGYBJLLYOQ-UHFFFAOYSA-N 50439500 CHEMBL2418122 Cholinesterase 1360 ChEMBL 10.1016/j.bmc.2013.07.011 10.7270/Q2VD70X8 23932451 Su, T; Xie, S; Wei, H; Yan, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439500 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439500&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72165099 175451817 CHEMBL2418122 ZINC96283235 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51074661 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCCCCSc1ccccc1 InChI=1S/C31H32NO4S/c1-33-28-12-11-22-17-27-25-19-30-29(35-21-36-30)18-23(25)13-14-32(27)20-26(22)31(28)34-15-7-2-3-8-16-37-24-9-5-4-6-10-24/h4-6,9-12,17-20H,2-3,7-8,13-16,21H2,1H3/q+1 JFNOLKIIOLBEKF-UHFFFAOYSA-N 50439501 CHEMBL2418121 Cholinesterase 1586 ChEMBL 10.1016/j.bmc.2013.07.011 10.7270/Q2VD70X8 23932451 Su, T; Xie, S; Wei, H; Yan, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439501 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439501&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72164967 175451818 CHEMBL2418121 ZINC96283236 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51074662 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCCCSc1ccccc1 InChI=1S/C30H30NO4S/c1-32-27-11-10-21-16-26-24-18-29-28(34-20-35-29)17-22(24)12-13-31(26)19-25(21)30(27)33-14-6-3-7-15-36-23-8-4-2-5-9-23/h2,4-5,8-11,16-19H,3,6-7,12-15,20H2,1H3/q+1 UKUKHSWKAJUWBG-UHFFFAOYSA-N 50439502 CHEMBL2418120 Cholinesterase 1661 ChEMBL 10.1016/j.bmc.2013.07.011 10.7270/Q2VD70X8 23932451 Su, T; Xie, S; Wei, H; Yan, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439502 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439502&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72164965 175451819 CHEMBL2418120 ZINC96283237 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51074663 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCCSc1ccccc1 InChI=1S/C29H28NO4S/c1-31-26-10-9-20-15-25-23-17-28-27(33-19-34-28)16-21(23)11-12-30(25)18-24(20)29(26)32-13-5-6-14-35-22-7-3-2-4-8-22/h2-4,7-10,15-18H,5-6,11-14,19H2,1H3/q+1 JRBYCLRDHJYKSN-UHFFFAOYSA-N 50439503 CHEMBL2418119 Cholinesterase 2185 ChEMBL 10.1016/j.bmc.2013.07.011 10.7270/Q2VD70X8 23932451 Su, T; Xie, S; Wei, H; Yan, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439503 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439503&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72164963 175451820 CHEMBL2418119 ZINC96283238 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51074664 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCCSc1ccccc1 InChI=1S/C28H26NO4S/c1-30-25-9-8-19-14-24-22-16-27-26(32-18-33-27)15-20(22)10-11-29(24)17-23(19)28(25)31-12-5-13-34-21-6-3-2-4-7-21/h2-4,6-9,14-17H,5,10-13,18H2,1H3/q+1 VMDBELURFYWYDP-UHFFFAOYSA-N 50439504 CHEMBL2418118 Cholinesterase 1494 ChEMBL 10.1016/j.bmc.2013.07.011 10.7270/Q2VD70X8 23932451 Su, T; Xie, S; Wei, H; Yan, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439504 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439504&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72164961 175451821 CHEMBL2418118 ZINC96283239 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51074665 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OCCSc1ccccc1 InChI=1S/C27H24NO4S/c1-29-24-8-7-18-13-23-21-15-26-25(31-17-32-26)14-19(21)9-10-28(23)16-22(18)27(24)30-11-12-33-20-5-3-2-4-6-20/h2-8,13-16H,9-12,17H2,1H3/q+1 LJLKKNZIPVUVJJ-UHFFFAOYSA-N 50439505 CHEMBL2418117 Cholinesterase 1521 ChEMBL 10.1016/j.bmc.2013.07.011 10.7270/Q2VD70X8 23932451 Su, T; Xie, S; Wei, H; Yan, J; Huang, L; Li, X Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439505 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439505&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72164959 175451822 CHEMBL2418117 ZINC96283240 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067092 Fc1ccccc1N1CCN(CC1)C(=O)CCCOc1cc(=O)oc2ccccc12 InChI=1S/C23H23FN2O4/c24-18-7-2-3-8-19(18)25-11-13-26(14-12-25)22(27)10-5-15-29-21-16-23(28)30-20-9-4-1-6-17(20)21/h1-4,6-9,16H,5,10-15H2 DZNHSCYZHTYTCH-UHFFFAOYSA-N 50435593 CHEMBL2393505 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2013.03.021 10.7270/Q2ZG6TNV 23644208 Razavi, SF; Khoobi, M; Nadri, H; Sakhteman, A; Moradi, A; Emami, S; Foroumadi, A; Shafiee, A University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435593 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435593&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71698587 175447910 CHEMBL2393505 ZINC96271533 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067093 Clc1ccc(cc1Cl)N1CCN(CC1)C(=O)CCCOc1cc(=O)oc2ccccc12 InChI=1S/C23H22Cl2N2O4/c24-18-8-7-16(14-19(18)25)26-9-11-27(12-10-26)22(28)6-3-13-30-21-15-23(29)31-20-5-2-1-4-17(20)21/h1-2,4-5,7-8,14-15H,3,6,9-13H2 PACATDLNKIJSMJ-UHFFFAOYSA-N 50435594 CHEMBL2393504 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2013.03.021 10.7270/Q2ZG6TNV 23644208 Razavi, SF; Khoobi, M; Nadri, H; Sakhteman, A; Moradi, A; Emami, S; Foroumadi, A; Shafiee, A University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435594 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435594&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71698505 175447911 CHEMBL2393504 ZINC96271534 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067094 O=C(CCCOc1cc(=O)oc2ccccc12)N1CCN(CC1)c1ccccc1 InChI=1S/C23H24N2O4/c26-22(25-14-12-24(13-15-25)18-7-2-1-3-8-18)11-6-16-28-21-17-23(27)29-20-10-5-4-9-19(20)21/h1-5,7-10,17H,6,11-16H2 SOZXYTKALVQKGY-UHFFFAOYSA-N 50435595 CHEMBL2393503 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2013.03.021 10.7270/Q2ZG6TNV 23644208 Razavi, SF; Khoobi, M; Nadri, H; Sakhteman, A; Moradi, A; Emami, S; Foroumadi, A; Shafiee, A University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435595 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435595&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71698504 175447912 CHEMBL2393503 ZINC96271535 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067095 Fc1ccc(cc1)N1CCN(CC1)C(=O)CCCOc1cc(=O)oc2ccccc12 InChI=1S/C23H23FN2O4/c24-17-7-9-18(10-8-17)25-11-13-26(14-12-25)22(27)6-3-15-29-21-16-23(28)30-20-5-2-1-4-19(20)21/h1-2,4-5,7-10,16H,3,6,11-15H2 RZCLLWVFGVZYFK-UHFFFAOYSA-N 50435596 CHEMBL2393502 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2013.03.021 10.7270/Q2ZG6TNV 23644208 Razavi, SF; Khoobi, M; Nadri, H; Sakhteman, A; Moradi, A; Emami, S; Foroumadi, A; Shafiee, A University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435596 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435596&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71698503 175447913 CHEMBL2393502 ZINC96271536 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067096 Oc1ccccc1N1CCN(CC1)C(=O)COc1cc(=O)oc2ccccc12 InChI=1S/C21H20N2O5/c24-17-7-3-2-6-16(17)22-9-11-23(12-10-22)20(25)14-27-19-13-21(26)28-18-8-4-1-5-15(18)19/h1-8,13,24H,9-12,14H2 YTDZILXNTXIXBP-UHFFFAOYSA-N 50435597 CHEMBL2393501 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2013.03.021 10.7270/Q2ZG6TNV 23644208 Razavi, SF; Khoobi, M; Nadri, H; Sakhteman, A; Moradi, A; Emami, S; Foroumadi, A; Shafiee, A University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435597 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435597&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71698502 175447914 CHEMBL2393501 ZINC96271537 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067097 Fc1ccc(cc1)N1CCN(CC1)C(=O)COc1cc(=O)oc2ccccc12 InChI=1S/C21H19FN2O4/c22-15-5-7-16(8-6-15)23-9-11-24(12-10-23)20(25)14-27-19-13-21(26)28-18-4-2-1-3-17(18)19/h1-8,13H,9-12,14H2 FPPPXTWVBWUUER-UHFFFAOYSA-N 50435598 CHEMBL2393500 Cholinesterase 76000 ChEMBL 10.1016/j.ejmech.2013.03.021 10.7270/Q2ZG6TNV 23644208 Razavi, SF; Khoobi, M; Nadri, H; Sakhteman, A; Moradi, A; Emami, S; Foroumadi, A; Shafiee, A University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435598 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435598&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71698501 175447915 CHEMBL2393500 ZINC96271538 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067098 Fc1ccccc1N1CCN(CC1)C(=O)COc1cc(=O)oc2ccccc12 InChI=1S/C21H19FN2O4/c22-16-6-2-3-7-17(16)23-9-11-24(12-10-23)20(25)14-27-19-13-21(26)28-18-8-4-1-5-15(18)19/h1-8,13H,9-12,14H2 QENLVZFJTAHMMQ-UHFFFAOYSA-N 50435599 CHEMBL2393499 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2013.03.021 10.7270/Q2ZG6TNV 23644208 Razavi, SF; Khoobi, M; Nadri, H; Sakhteman, A; Moradi, A; Emami, S; Foroumadi, A; Shafiee, A University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435599 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435599&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71698500 175447916 CHEMBL2393499 ZINC96271539 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067099 Clc1ccc(cc1Cl)N1CCN(CC1)C(=O)COc1cc(=O)oc2ccccc12 InChI=1S/C21H18Cl2N2O4/c22-16-6-5-14(11-17(16)23)24-7-9-25(10-8-24)20(26)13-28-19-12-21(27)29-18-4-2-1-3-15(18)19/h1-6,11-12H,7-10,13H2 PKKUPJBNYDTFOM-UHFFFAOYSA-N 50435600 CHEMBL2393498 Cholinesterase 89000 ChEMBL 10.1016/j.ejmech.2013.03.021 10.7270/Q2ZG6TNV 23644208 Razavi, SF; Khoobi, M; Nadri, H; Sakhteman, A; Moradi, A; Emami, S; Foroumadi, A; Shafiee, A University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435600 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435600&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71698422 175447917 CHEMBL2393498 ZINC96271540 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067100 O=C(COc1cc(=O)oc2ccccc12)N1CCN(CC1)c1ccccc1 InChI=1S/C21H20N2O4/c24-20(23-12-10-22(11-13-23)16-6-2-1-3-7-16)15-26-19-14-21(25)27-18-9-5-4-8-17(18)19/h1-9,14H,10-13,15H2 HTLYRLFRLVTNIN-UHFFFAOYSA-N 50435601 CHEMBL2393497 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2013.03.021 10.7270/Q2ZG6TNV 23644208 Razavi, SF; Khoobi, M; Nadri, H; Sakhteman, A; Moradi, A; Emami, S; Foroumadi, A; Shafiee, A University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435601 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435601&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71698421 175447918 CHEMBL2393497 ZINC96271541 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067121 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 5380 ChEMBL 10.1016/j.ejmech.2013.03.021 10.7270/Q2ZG6TNV 23644208 Razavi, SF; Khoobi, M; Nadri, H; Sakhteman, A; Moradi, A; Emami, S; Foroumadi, A; Shafiee, A University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067122 COc1ccc(CCNC(=O)CCCOc2cc(=O)oc3ccccc23)cc1OC InChI=1S/C23H25NO6/c1-27-19-10-9-16(14-21(19)28-2)11-12-24-22(25)8-5-13-29-20-15-23(26)30-18-7-4-3-6-17(18)20/h3-4,6-7,9-10,14-15H,5,8,11-13H2,1-2H3,(H,24,25) JRVLNTOUKTYYKN-UHFFFAOYSA-N 50435602 CHEMBL2390990 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2013.03.021 10.7270/Q2ZG6TNV 23644208 Razavi, SF; Khoobi, M; Nadri, H; Sakhteman, A; Moradi, A; Emami, S; Foroumadi, A; Shafiee, A University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435602 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435602&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71698685 175447919 CHEMBL2390990 ZINC96271542 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067123 OC1(CCN(CC1)C(=O)CCCOc1cc(=O)oc2ccccc12)c1ccc(Cl)cc1 InChI=1S/C24H24ClNO5/c25-18-9-7-17(8-10-18)24(29)11-13-26(14-12-24)22(27)6-3-15-30-21-16-23(28)31-20-5-2-1-4-19(20)21/h1-2,4-5,7-10,16,29H,3,6,11-15H2 RQCRMFIIAOLWJO-UHFFFAOYSA-N 50435603 CHEMBL2393513 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2013.03.021 10.7270/Q2ZG6TNV 23644208 Razavi, SF; Khoobi, M; Nadri, H; Sakhteman, A; Moradi, A; Emami, S; Foroumadi, A; Shafiee, A University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435603 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435603&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71698684 175447920 CHEMBL2393513 ZINC96271543 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062944 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 19340 ChEMBL 10.1016/j.bmcl.2013.03.027 10.7270/Q2057H97 23570788 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Razak, IA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062945 Clc1ccc2c(NC(=O)[C@@]22[C@H](C[C@H]3CCCN23)C(=O)N2C\C(=C/c3cccc4ccccc34)C(=O)\C(C2)=C\c2cccc3ccccc23)c1 InChI=1S/C42H34ClN3O3/c43-32-17-18-36-38(22-32)44-41(49)42(36)37(23-33-14-7-19-46(33)42)40(48)45-24-30(20-28-12-5-10-26-8-1-3-15-34(26)28)39(47)31(25-45)21-29-13-6-11-27-9-2-4-16-35(27)29/h1-6,8-13,15-18,20-22,33,37H,7,14,19,23-25H2,(H,44,49)/b30-20+,31-21+/t33-,37-,42+/m1/s1 ACEKJSVJSPWCFJ-QEJYEJBOSA-N 50433616 CHEMBL2380667 Cholinesterase 9650 ChEMBL 10.1016/j.bmcl.2013.03.027 10.7270/Q2057H97 23570788 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Razak, IA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433616 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433616&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71615101 175445933 CHEMBL2380667 ZINC96269745 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062946 Fc1ccc(\C=C2/CN(C\C(=C/c3ccc(F)cc3)C2=O)C(=O)[C@H]2C[C@H]3CCCN3[C@]22C(=O)Nc3cc(Cl)ccc23)cc1 InChI=1S/C34H28ClF2N3O3/c35-24-7-12-28-30(16-24)38-33(43)34(28)29(17-27-2-1-13-40(27)34)32(42)39-18-22(14-20-3-8-25(36)9-4-20)31(41)23(19-39)15-21-5-10-26(37)11-6-21/h3-12,14-16,27,29H,1-2,13,17-19H2,(H,38,43)/b22-14+,23-15+/t27-,29-,34+/m1/s1 LYOMGBOTTCNJOL-CALHOEHWSA-N 50433617 CHEMBL2380677 Cholinesterase 3640 ChEMBL 10.1016/j.bmcl.2013.03.027 10.7270/Q2057H97 23570788 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Razak, IA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433617 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433617&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71615100 175445934 CHEMBL2380677 ZINC96269746 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062947 Clc1ccc(\C=C2/CN(C\C(=C/c3ccc(Cl)cc3)C2=O)C(=O)[C@H]2C[C@H]3CCCN3[C@]22C(=O)Nc3cc(Cl)ccc23)cc1 InChI=1S/C34H28Cl3N3O3/c35-24-7-3-20(4-8-24)14-22-18-39(19-23(31(22)41)15-21-5-9-25(36)10-6-21)32(42)29-17-27-2-1-13-40(27)34(29)28-12-11-26(37)16-30(28)38-33(34)43/h3-12,14-16,27,29H,1-2,13,17-19H2,(H,38,43)/b22-14+,23-15+/t27-,29-,34+/m1/s1 UFZCTLXXZCRXSR-CALHOEHWSA-N 50433618 CHEMBL2380676 Cholinesterase 28160 ChEMBL 10.1016/j.bmcl.2013.03.027 10.7270/Q2057H97 23570788 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Razak, IA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433618 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433618&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71614901 175445935 CHEMBL2380676 ZINC96269747 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062948 Cc1ccc(\C=C2/CN(C\C(=C/c3ccc(C)cc3)C2=O)C(=O)[C@H]2C[C@H]3CCCN3[C@]22C(=O)Nc3cc(Cl)ccc23)cc1 InChI=1S/C36H34ClN3O3/c1-22-5-9-24(10-6-22)16-26-20-39(21-27(33(26)41)17-25-11-7-23(2)8-12-25)34(42)31-19-29-4-3-15-40(29)36(31)30-14-13-28(37)18-32(30)38-35(36)43/h5-14,16-18,29,31H,3-4,15,19-21H2,1-2H3,(H,38,43)/b26-16+,27-17+/t29-,31-,36+/m1/s1 KPQUHTNSXKRNNN-HUPMBETNSA-N 50433619 CHEMBL2380675 Cholinesterase 22170 ChEMBL 10.1016/j.bmcl.2013.03.027 10.7270/Q2057H97 23570788 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Razak, IA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433619 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433619&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71614900 175445936 CHEMBL2380675 ZINC96269748 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062949 Clc1ccc2c(NC(=O)[C@@]22[C@H](C[C@H]3CCCN23)C(=O)N2C\C(=C/c3ccc(Cl)cc3Cl)C(=O)\C(C2)=C\c2ccc(Cl)cc2Cl)c1 InChI=1S/C34H26Cl5N3O3/c35-22-5-3-18(28(38)12-22)10-20-16-41(17-21(31(20)43)11-19-4-6-23(36)13-29(19)39)32(44)27-15-25-2-1-9-42(25)34(27)26-8-7-24(37)14-30(26)40-33(34)45/h3-8,10-14,25,27H,1-2,9,15-17H2,(H,40,45)/b20-10+,21-11+/t25-,27-,34+/m1/s1 NVCJOKMKSQXMIZ-PASBQLHESA-N 50433620 CHEMBL2380674 Cholinesterase 20140 ChEMBL 10.1016/j.bmcl.2013.03.027 10.7270/Q2057H97 23570788 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Razak, IA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433620 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433620&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71614899 175445937 CHEMBL2380674 ZINC96269749 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062950 [O-][N+](=O)c1cccc(\C=C2/CN(C\C(=C/c3cccc(c3)[N+]([O-])=O)C2=O)C(=O)[C@H]2C[C@H]3CCCN3[C@]22C(=O)Nc3cc(Cl)ccc23)c1 InChI=1S/C34H28ClN5O7/c35-24-9-10-28-30(16-24)36-33(43)34(28)29(17-25-8-3-11-38(25)34)32(42)37-18-22(12-20-4-1-6-26(14-20)39(44)45)31(41)23(19-37)13-21-5-2-7-27(15-21)40(46)47/h1-2,4-7,9-10,12-16,25,29H,3,8,11,17-19H2,(H,36,43)/b22-12+,23-13+/t25-,29-,34+/m1/s1 FXQROPSWMDCKSN-GMTJZYHLSA-N 50433621 CHEMBL2380673 Cholinesterase 17210 ChEMBL 10.1016/j.bmcl.2013.03.027 10.7270/Q2057H97 23570788 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Razak, IA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433621 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433621&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71614898 175445938 CHEMBL2380673 ZINC96269750 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062951 Fc1ccccc1\C=C1/CN(C\C(=C/c2ccccc2F)C1=O)C(=O)[C@H]1C[C@H]2CCCN2[C@]11C(=O)Nc2cc(Cl)ccc12 InChI=1S/C34H28ClF2N3O3/c35-24-11-12-26-30(16-24)38-33(43)34(26)27(17-25-8-5-13-40(25)34)32(42)39-18-22(14-20-6-1-3-9-28(20)36)31(41)23(19-39)15-21-7-2-4-10-29(21)37/h1-4,6-7,9-12,14-16,25,27H,5,8,13,17-19H2,(H,38,43)/b22-14+,23-15+/t25-,27-,34+/m1/s1 DHHBSXMJIWJCNZ-WFUNVFJHSA-N 50433622 CHEMBL2380672 Cholinesterase 3130 ChEMBL 10.1016/j.bmcl.2013.03.027 10.7270/Q2057H97 23570788 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Razak, IA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433622 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433622&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71614700 175445939 CHEMBL2380672 ZINC96269751 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062952 Clc1ccc2c(NC(=O)[C@@]22[C@H](C[C@H]3CCCN23)C(=O)N2C\C(=C/c3ccccc3Cl)C(=O)\C(C2)=C\c2ccccc2Cl)c1 InChI=1S/C34H28Cl3N3O3/c35-24-11-12-26-30(16-24)38-33(43)34(26)27(17-25-8-5-13-40(25)34)32(42)39-18-22(14-20-6-1-3-9-28(20)36)31(41)23(19-39)15-21-7-2-4-10-29(21)37/h1-4,6-7,9-12,14-16,25,27H,5,8,13,17-19H2,(H,38,43)/b22-14+,23-15+/t25-,27-,34+/m1/s1 IEZUYXINOLBVPZ-WFUNVFJHSA-N 50433623 CHEMBL2380671 Cholinesterase 17420 ChEMBL 10.1016/j.bmcl.2013.03.027 10.7270/Q2057H97 23570788 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Razak, IA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433623 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433623&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71614699 175445940 CHEMBL2380671 ZINC96269752 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062953 COc1ccccc1\C=C1/CN(C\C(=C/c2ccccc2OC)C1=O)C(=O)[C@H]1C[C@H]2CCCN2[C@]11C(=O)Nc2cc(Cl)ccc12 InChI=1S/C36H34ClN3O5/c1-44-31-11-5-3-8-22(31)16-24-20-39(21-25(33(24)41)17-23-9-4-6-12-32(23)45-2)34(42)29-19-27-10-7-15-40(27)36(29)28-14-13-26(37)18-30(28)38-35(36)43/h3-6,8-9,11-14,16-18,27,29H,7,10,15,19-21H2,1-2H3,(H,38,43)/b24-16+,25-17+/t27-,29-,36+/m1/s1 PCOKXHPOHHOXLN-PFIPDXTLSA-N 50433624 CHEMBL2380670 Cholinesterase 7820 ChEMBL 10.1016/j.bmcl.2013.03.027 10.7270/Q2057H97 23570788 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Razak, IA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433624 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433624&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71614698 175445941 CHEMBL2380670 ZINC96269753 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062954 Cc1ccccc1\C=C1/CN(C\C(=C/c2ccccc2C)C1=O)C(=O)[C@H]1C[C@H]2CCCN2[C@]11C(=O)Nc2cc(Cl)ccc12 InChI=1S/C36H34ClN3O3/c1-22-8-3-5-10-24(22)16-26-20-39(21-27(33(26)41)17-25-11-6-4-9-23(25)2)34(42)31-19-29-12-7-15-40(29)36(31)30-14-13-28(37)18-32(30)38-35(36)43/h3-6,8-11,13-14,16-18,29,31H,7,12,15,19-21H2,1-2H3,(H,38,43)/b26-16+,27-17+/t29-,31-,36+/m1/s1 LJWWVVOSSRGRSB-HUPMBETNSA-N 50433625 CHEMBL2380669 Cholinesterase 15110 ChEMBL 10.1016/j.bmcl.2013.03.027 10.7270/Q2057H97 23570788 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Razak, IA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433625 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433625&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71614697 175445942 CHEMBL2380669 ZINC96269754 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062955 Clc1ccc2c(NC(=O)[C@@]22[C@H](C[C@H]3CCCN23)C(=O)N2C\C(=C/c3ccccc3)C(=O)\C(C2)=C\c2ccccc2)c1 InChI=1S/C34H30ClN3O3/c35-26-13-14-28-30(18-26)36-33(41)34(28)29(19-27-12-7-15-38(27)34)32(40)37-20-24(16-22-8-3-1-4-9-22)31(39)25(21-37)17-23-10-5-2-6-11-23/h1-6,8-11,13-14,16-18,27,29H,7,12,15,19-21H2,(H,36,41)/b24-16+,25-17+/t27-,29-,34+/m1/s1 ZUPYZAOBFKGYOS-KQARPPIHSA-N 50433626 CHEMBL2380668 Cholinesterase 15440 ChEMBL 10.1016/j.bmcl.2013.03.027 10.7270/Q2057H97 23570788 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Razak, IA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433626 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433626&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71614509 175445943 CHEMBL2380668 ZINC96269755 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062956 C=CC(=O)N1C\C(=C/c2cccc3ccccc23)C(=O)\C(C1)=C\c1cccc2ccccc12 InChI=1S/C30H23NO2/c1-2-29(32)31-19-25(17-23-13-7-11-21-9-3-5-15-27(21)23)30(33)26(20-31)18-24-14-8-12-22-10-4-6-16-28(22)24/h2-18H,1,19-20H2/b25-17+,26-18+ MTRUEVQGINMHEH-RPCRKUJJSA-N 50430657 CHEMBL2332547 Cholinesterase 23120 ChEMBL 10.1016/j.bmcl.2013.03.027 10.7270/Q2057H97 23570788 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Razak, IA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430657 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430657&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71614508 164159532 CHEMBL2332547 ZINC95590965 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062957 Fc1ccc(\C=C2/CN(C\C(=C/c3ccc(F)cc3)C2=O)C(=O)C=C)cc1 InChI=1S/C22H17F2NO2/c1-2-21(26)25-13-17(11-15-3-7-19(23)8-4-15)22(27)18(14-25)12-16-5-9-20(24)10-6-16/h2-12H,1,13-14H2/b17-11+,18-12+ JTMAQMMHQYJZRV-JYFOCSDGSA-N 50430658 CHEMBL350032 Cholinesterase 30580 ChEMBL 10.1016/j.bmcl.2013.03.027 10.7270/Q2057H97 23570788 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Razak, IA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430658 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430658&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5469427 164159533 CHEMBL350032 ZINC05838758 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062958 Clc1ccc(\C=C2/CN(C\C(=C/c3ccc(Cl)cc3)C2=O)C(=O)C=C)cc1 InChI=1S/C22H17Cl2NO2/c1-2-21(26)25-13-17(11-15-3-7-19(23)8-4-15)22(27)18(14-25)12-16-5-9-20(24)10-6-16/h2-12H,1,13-14H2/b17-11+,18-12+ UANWMDUDDVNHJV-JYFOCSDGSA-N 50430659 CHEMBL152675 Cholinesterase 38190 ChEMBL 10.1016/j.bmcl.2013.03.027 10.7270/Q2057H97 23570788 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Razak, IA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430659 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430659&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5351434 164159534 CHEMBL152675 ZINC05838751 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062959 Cc1ccc(\C=C2/CN(C\C(=C/c3ccc(C)cc3)C2=O)C(=O)C=C)cc1 InChI=1S/C24H23NO2/c1-4-23(26)25-15-21(13-19-9-5-17(2)6-10-19)24(27)22(16-25)14-20-11-7-18(3)8-12-20/h4-14H,1,15-16H2,2-3H3/b21-13+,22-14+ PBKYTQAWPQYYBI-JFMUQQRKSA-N 50430660 CHEMBL454594 Cholinesterase 35070 ChEMBL 10.1016/j.bmcl.2013.03.027 10.7270/Q2057H97 23570788 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Razak, IA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430660 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430660&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 24796898 164159535 CHEMBL454594 ZINC40846956 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062960 Clc1ccc(\C=C2/CN(C\C(=C/c3ccc(Cl)cc3Cl)C2=O)C(=O)C=C)c(Cl)c1 InChI=1S/C22H15Cl4NO2/c1-2-21(28)27-11-15(7-13-3-5-17(23)9-19(13)25)22(29)16(12-27)8-14-4-6-18(24)10-20(14)26/h2-10H,1,11-12H2/b15-7+,16-8+ FISLRWJREXCZGZ-BGPOSVGRSA-N 50430661 CHEMBL2332546 Cholinesterase 29370 ChEMBL 10.1016/j.bmcl.2013.03.027 10.7270/Q2057H97 23570788 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Razak, IA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430661 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430661&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71720637 164159536 CHEMBL2332546 ZINC95590664 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062961 [O-][N+](=O)c1cccc(\C=C2/CN(C\C(=C/c3cccc(c3)[N+]([O-])=O)C2=O)C(=O)C=C)c1 InChI=1S/C22H17N3O6/c1-2-21(26)23-13-17(9-15-5-3-7-19(11-15)24(28)29)22(27)18(14-23)10-16-6-4-8-20(12-16)25(30)31/h2-12H,1,13-14H2/b17-9+,18-10+ CDXLEFQOEJSRAZ-BEQMOXJMSA-N 50430662 CHEMBL2332537 Cholinesterase 51160 ChEMBL 10.1016/j.bmcl.2013.03.027 10.7270/Q2057H97 23570788 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Razak, IA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430662 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430662&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71584436 164159537 CHEMBL2332537 ZINC95592336 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062964 COc1ccccc1\C=C1/CN(C\C(=C/c2ccccc2OC)C1=O)C(=O)C=C InChI=1S/C24H23NO4/c1-4-23(26)25-15-19(13-17-9-5-7-11-21(17)28-2)24(27)20(16-25)14-18-10-6-8-12-22(18)29-3/h4-14H,1,15-16H2,2-3H3/b19-13+,20-14+ ANDKTBBSVHIHPD-IWGRKNQJSA-N 50430665 CHEMBL2332539 Cholinesterase 28920 ChEMBL 10.1016/j.bmcl.2013.03.027 10.7270/Q2057H97 23570788 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Razak, IA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430665 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430665&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71584434 164159540 CHEMBL2332539 ZINC95588902 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062965 Cc1ccccc1\C=C1/CN(C\C(=C/c2ccccc2C)C1=O)C(=O)C=C InChI=1S/C24H23NO2/c1-4-23(26)25-15-21(13-19-11-7-5-9-17(19)2)24(27)22(16-25)14-20-12-8-6-10-18(20)3/h4-14H,1,15-16H2,2-3H3/b21-13+,22-14+ YYTCOYCBTWTKEO-JFMUQQRKSA-N 50430666 CHEMBL2332538 Cholinesterase 30020 ChEMBL 10.1016/j.bmcl.2013.03.027 10.7270/Q2057H97 23570788 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Razak, IA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430666 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430666&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71584433 164159541 CHEMBL2332538 ZINC95588268 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062962 Fc1ccccc1\C=C1/CN(C\C(=C/c2ccccc2F)C1=O)C(=O)C=C InChI=1S/C22H17F2NO2/c1-2-21(26)25-13-17(11-15-7-3-5-9-19(15)23)22(27)18(14-25)12-16-8-4-6-10-20(16)24/h2-12H,1,13-14H2/b17-11+,18-12+ UAALLHXUCALBPS-JYFOCSDGSA-N 50430663 CHEMBL2332536 Cholinesterase 54040 ChEMBL 10.1016/j.bmcl.2013.03.027 10.7270/Q2057H97 23570788 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Razak, IA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430663 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430663&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71584435 164159538 CHEMBL2332536 ZINC95587646 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062963 Clc1ccccc1\C=C1/CN(C\C(=C/c2ccccc2Cl)C1=O)C(=O)C=C InChI=1S/C22H17Cl2NO2/c1-2-21(26)25-13-17(11-15-7-3-5-9-19(15)23)22(27)18(14-25)12-16-8-4-6-10-20(16)24/h2-12H,1,13-14H2/b17-11+,18-12+ TWKRFLWDMHZWHO-JYFOCSDGSA-N 50430664 CHEMBL2332535 Cholinesterase 36620 ChEMBL 10.1016/j.bmcl.2013.03.027 10.7270/Q2057H97 23570788 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Razak, IA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430664 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430664&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71718812 164159539 CHEMBL2332535 ZINC95587223 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062966 C=CC(=O)N1C\C(=C/c2ccccc2)C(=O)\C(C1)=C\c1ccccc1 InChI=1S/C22H19NO2/c1-2-21(24)23-15-19(13-17-9-5-3-6-10-17)22(25)20(16-23)14-18-11-7-4-8-12-18/h2-14H,1,15-16H2/b19-13+,20-14+ FYXRGLSUYBQDPY-IWGRKNQJSA-N 50430667 CHEMBL156016 Cholinesterase 22060 ChEMBL 10.1016/j.bmcl.2013.03.027 10.7270/Q2057H97 23570788 Kia, Y; Osman, H; Kumar, RS; Murugaiyah, V; Basiri, A; Perumal, S; Razak, IA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50430667 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50430667&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5351364 164159542 CHEMBL156016 ZINC17195935 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025428 COc1ccc2C(=O)C(CC3C=CN(Cc4ccccc4Cl)C=C3C(C)=O)CCc2c1 InChI=1S/C26H26ClNO3/c1-17(29)24-16-28(15-21-5-3-4-6-25(21)27)12-11-19(24)13-20-8-7-18-14-22(31-2)9-10-23(18)26(20)30/h3-6,9-12,14,16,19-20H,7-8,13,15H2,1-2H3 QZMOKFTXANCHGF-UHFFFAOYSA-N 50291627 CHEMBL4162692 Cholinesterase 5775 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291627 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291627&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44268357 104133179 ZINC36338521 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025433 COc1ccc2C(=O)C(CC3C=CN(Cc4cccc(C)c4)C=C3C(C)=O)CCc2c1 InChI=1S/C27H29NO3/c1-18-5-4-6-20(13-18)16-28-12-11-22(26(17-28)19(2)29)14-23-8-7-21-15-24(31-3)9-10-25(21)27(23)30/h4-6,9-13,15,17,22-23H,7-8,14,16H2,1-3H3 NIOXAGMXVCHNDQ-UHFFFAOYSA-N 50291629 CHEMBL4170614 Cholinesterase 4020 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291629 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291629&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44268310 104133181 ZINC36338515 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073859 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 19340 ChEMBL 10.1016/j.ejmech.2013.06.054 10.7270/Q2VH5Q78 23871902 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Awang, KB; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073860 Clc1ccc(C=C2CN(CCN3CCOCC3)CC3C(NC(=S)N=C23)c2ccc(Cl)cc2Cl)c(Cl)c1 InChI=1S/C26H26Cl4N4OS/c27-18-2-1-16(22(29)12-18)11-17-14-34(6-5-33-7-9-35-10-8-33)15-21-24(17)31-26(36)32-25(21)20-4-3-19(28)13-23(20)30/h1-4,11-13,21,25H,5-10,14-15H2,(H,32,36) DRZDTHUDRPPIOA-UHFFFAOYSA-N 50439085 CHEMBL2417676 Cholinesterase 5870 ChEMBL 10.1016/j.ejmech.2013.06.054 10.7270/Q2VH5Q78 23871902 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Awang, KB; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439085 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439085&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898748 175451402 CHEMBL2417676 ZINC96282903 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073861 Fc1ccc(C=C2CN(CCN3CCOCC3)CC3C(NC(=S)N=C23)c2ccc(F)cc2)cc1 InChI=1S/C26H28F2N4OS/c27-21-5-1-18(2-6-21)15-20-16-32(10-9-31-11-13-33-14-12-31)17-23-24(29-26(34)30-25(20)23)19-3-7-22(28)8-4-19/h1-8,15,23-24H,9-14,16-17H2,(H,29,34) LKIBMUXHXSBMPO-UHFFFAOYSA-N 50439086 CHEMBL2417675 Cholinesterase 3410 ChEMBL 10.1016/j.ejmech.2013.06.054 10.7270/Q2VH5Q78 23871902 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Awang, KB; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439086 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439086&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898749 175451403 CHEMBL2417675 ZINC96282905 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073862 Clc1ccc(C=C2CN(CCN3CCOCC3)CC3C(NC(=S)N=C23)c2ccc(Cl)cc2)cc1 InChI=1S/C26H28Cl2N4OS/c27-21-5-1-18(2-6-21)15-20-16-32(10-9-31-11-13-33-14-12-31)17-23-24(29-26(34)30-25(20)23)19-3-7-22(28)8-4-19/h1-8,15,23-24H,9-14,16-17H2,(H,29,34) ILRKBCAMZGMVJJ-UHFFFAOYSA-N 50439087 CHEMBL2417674 Cholinesterase 4280 ChEMBL 10.1016/j.ejmech.2013.06.054 10.7270/Q2VH5Q78 23871902 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Awang, KB; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439087 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439087&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898750 175451404 CHEMBL2417674 ZINC96282907 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073863 Cc1ccc(C=C2CN(CCN3CCOCC3)CC3C(NC(=S)N=C23)c2ccc(C)cc2)cc1 InChI=1S/C28H34N4OS/c1-20-3-7-22(8-4-20)17-24-18-32(12-11-31-13-15-33-16-14-31)19-25-26(29-28(34)30-27(24)25)23-9-5-21(2)6-10-23/h3-10,17,25-26H,11-16,18-19H2,1-2H3,(H,29,34) CWPXNFBMSPIURZ-UHFFFAOYSA-N 50439088 CHEMBL2417673 Cholinesterase 3580 ChEMBL 10.1016/j.ejmech.2013.06.054 10.7270/Q2VH5Q78 23871902 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Awang, KB; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439088 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439088&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898751 175451405 CHEMBL2417673 ZINC96282909 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073864 [O-][N+](=O)c1ccc(cc1)C1NC(=S)N=C2C1CN(CCN1CCOCC1)CC2=Cc1cccc(c1)[N+]([O-])=O InChI=1S/C26H28N6O5S/c33-31(34)21-6-4-19(5-7-21)24-23-17-30(9-8-29-10-12-37-13-11-29)16-20(25(23)28-26(38)27-24)14-18-2-1-3-22(15-18)32(35)36/h1-7,14-15,23-24H,8-13,16-17H2,(H,27,38) IHRZQOITDDWWTD-UHFFFAOYSA-N 50439089 CHEMBL2417672 Cholinesterase 5160 ChEMBL 10.1016/j.ejmech.2013.06.054 10.7270/Q2VH5Q78 23871902 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Awang, KB; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439089 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439089&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898752 175451406 CHEMBL2417672 ZINC96282911 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073865 COc1ccccc1C=C1CN(CCN2CCOCC2)CC2C(NC(=S)N=C12)c1ccccc1OC InChI=1S/C28H34N4O3S/c1-33-24-9-5-3-7-20(24)17-21-18-32(12-11-31-13-15-35-16-14-31)19-23-26(21)29-28(36)30-27(23)22-8-4-6-10-25(22)34-2/h3-10,17,23,27H,11-16,18-19H2,1-2H3,(H,30,36) FWKGZINORZSZBQ-UHFFFAOYSA-N 50439090 CHEMBL2417671 Cholinesterase 5930 ChEMBL 10.1016/j.ejmech.2013.06.054 10.7270/Q2VH5Q78 23871902 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Awang, KB; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439090 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439090&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898753 175451407 CHEMBL2417671 ZINC96282913 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073866 Fc1ccccc1C=C1CN(CCN2CCOCC2)CC2C(NC(=S)N=C12)c1ccccc1F InChI=1S/C26H28F2N4OS/c27-22-7-3-1-5-18(22)15-19-16-32(10-9-31-11-13-33-14-12-31)17-21-24(19)29-26(34)30-25(21)20-6-2-4-8-23(20)28/h1-8,15,21,25H,9-14,16-17H2,(H,30,34) YGBZHZLECDKKGU-UHFFFAOYSA-N 50439091 CHEMBL2417670 Cholinesterase 2970 ChEMBL 10.1016/j.ejmech.2013.06.054 10.7270/Q2VH5Q78 23871902 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Awang, KB; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439091 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439091&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898754 175451408 CHEMBL2417670 ZINC96282915 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073867 Clc1ccccc1C=C1CN(CCN2CCOCC2)CC2C(NC(=S)N=C12)c1ccccc1Cl InChI=1S/C26H28Cl2N4OS/c27-22-7-3-1-5-18(22)15-19-16-32(10-9-31-11-13-33-14-12-31)17-21-24(19)29-26(34)30-25(21)20-6-2-4-8-23(20)28/h1-8,15,21,25H,9-14,16-17H2,(H,30,34) KTQQSHYCNJKUMF-UHFFFAOYSA-N 50439092 CHEMBL2417669 Cholinesterase 2440 ChEMBL 10.1016/j.ejmech.2013.06.054 10.7270/Q2VH5Q78 23871902 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Awang, KB; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439092 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439092&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898755 175451409 CHEMBL2417669 ZINC96282917 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073868 Cc1ccccc1C=C1CN(CCN2CCOCC2)CC2C(NC(=S)N=C12)c1ccccc1C InChI=1S/C28H34N4OS/c1-20-7-3-5-9-22(20)17-23-18-32(12-11-31-13-15-33-16-14-31)19-25-26(23)29-28(34)30-27(25)24-10-6-4-8-21(24)2/h3-10,17,25,27H,11-16,18-19H2,1-2H3,(H,30,34) HKQOTSGLCBVUJL-UHFFFAOYSA-N 50439093 CHEMBL2417668 Cholinesterase 1890 ChEMBL 10.1016/j.ejmech.2013.06.054 10.7270/Q2VH5Q78 23871902 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Awang, KB; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439093 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439093&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898756 175451410 CHEMBL2417668 ZINC96282919 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073869 S=C1NC(C2CN(CCN3CCOCC3)CC(=Cc3ccccc3)C2=N1)c1ccccc1 InChI=1S/C26H30N4OS/c32-26-27-24(21-9-5-2-6-10-21)23-19-30(12-11-29-13-15-31-16-14-29)18-22(25(23)28-26)17-20-7-3-1-4-8-20/h1-10,17,23-24H,11-16,18-19H2,(H,27,32) VHMXDGHJKLMBPQ-UHFFFAOYSA-N 50439094 CHEMBL2417667 Cholinesterase 3230 ChEMBL 10.1016/j.ejmech.2013.06.054 10.7270/Q2VH5Q78 23871902 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Awang, KB; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439094 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439094&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898757 175451411 CHEMBL2417667 ZINC96282921 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073870 CCN1CC2C(NC(=S)N=C2C(C1)=Cc1ccc(Cl)cc1Cl)c1ccc(Cl)cc1Cl InChI=1S/C22H19Cl4N3S/c1-2-29-10-13(7-12-3-4-14(23)8-18(12)25)20-17(11-29)21(28-22(30)27-20)16-6-5-15(24)9-19(16)26/h3-9,17,21H,2,10-11H2,1H3,(H,28,30) HBSACISFBPIIQZ-UHFFFAOYSA-N 50439095 CHEMBL2417666 Cholinesterase 3610 ChEMBL 10.1016/j.ejmech.2013.06.054 10.7270/Q2VH5Q78 23871902 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Awang, KB; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439095 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439095&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898758 175451412 CHEMBL2417666 ZINC96282923 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073871 CCN1CC2C(NC(=S)N=C2C(C1)=Cc1ccc(F)cc1)c1ccc(F)cc1 InChI=1S/C22H21F2N3S/c1-2-27-12-16(11-14-3-7-17(23)8-4-14)21-19(13-27)20(25-22(28)26-21)15-5-9-18(24)10-6-15/h3-11,19-20H,2,12-13H2,1H3,(H,25,28) VZTXFHPADOIFMO-UHFFFAOYSA-N 50439096 CHEMBL2417665 Cholinesterase 5980 ChEMBL 10.1016/j.ejmech.2013.06.054 10.7270/Q2VH5Q78 23871902 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Awang, KB; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439096 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439096&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898759 175451413 CHEMBL2417665 ZINC96282925 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073872 CCN1CC2C(NC(=S)N=C2C(C1)=Cc1ccc(Cl)cc1)c1ccc(Cl)cc1 InChI=1S/C22H21Cl2N3S/c1-2-27-12-16(11-14-3-7-17(23)8-4-14)21-19(13-27)20(25-22(28)26-21)15-5-9-18(24)10-6-15/h3-11,19-20H,2,12-13H2,1H3,(H,25,28) HWVRGWFXUBMNJG-UHFFFAOYSA-N 50439097 CHEMBL1987383 Cholinesterase 5880 ChEMBL 10.1016/j.ejmech.2013.06.054 10.7270/Q2VH5Q78 23871902 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Awang, KB; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439097 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439097&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898760 175451414 CHEMBL1987383 ZINC73316851 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073873 CCN1CC2C(NC(=S)N=C2C(C1)=Cc1ccc(C)cc1)c1ccc(C)cc1 InChI=1S/C24H27N3S/c1-4-27-14-20(13-18-9-5-16(2)6-10-18)23-21(15-27)22(25-24(28)26-23)19-11-7-17(3)8-12-19/h5-13,21-22H,4,14-15H2,1-3H3,(H,25,28) OCIXNCJTHXCERG-UHFFFAOYSA-N 50439098 CHEMBL1276588 Cholinesterase 4730 ChEMBL 10.1016/j.ejmech.2013.06.054 10.7270/Q2VH5Q78 23871902 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Awang, KB; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439098 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439098&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898761 175451415 CHEMBL1276588 ZINC64448651 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073874 CCN1CC2C(NC(=S)N=C2C(C1)=Cc1cccc(c1)[N+]([O-])=O)c1cccc(c1)[N+]([O-])=O InChI=1S/C22H21N5O4S/c1-2-25-12-16(9-14-5-3-7-17(10-14)26(28)29)21-19(13-25)20(23-22(32)24-21)15-6-4-8-18(11-15)27(30)31/h3-11,19-20H,2,12-13H2,1H3,(H,23,32) HRPFHSUIZFGIJX-UHFFFAOYSA-N 50439099 CHEMBL2417664 Cholinesterase 5110 ChEMBL 10.1016/j.ejmech.2013.06.054 10.7270/Q2VH5Q78 23871902 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Awang, KB; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439099 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439099&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898762 175451416 CHEMBL2417664 ZINC96282927 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073875 CCN1CC2C(NC(=S)N=C2C(C1)=Cc1ccccc1OC)c1ccccc1OC InChI=1S/C24H27N3O2S/c1-4-27-14-17(13-16-9-5-7-11-20(16)28-2)22-19(15-27)23(26-24(30)25-22)18-10-6-8-12-21(18)29-3/h5-13,19,23H,4,14-15H2,1-3H3,(H,26,30) XNCKAKVIVQPWFX-UHFFFAOYSA-N 50439100 CHEMBL2417663 Cholinesterase 8130 ChEMBL 10.1016/j.ejmech.2013.06.054 10.7270/Q2VH5Q78 23871902 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Awang, KB; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439100 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439100&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898763 175451417 CHEMBL2417663 ZINC96282929 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073876 CCN1CC2C(NC(=S)N=C2C(C1)=Cc1ccccc1F)c1ccccc1F InChI=1S/C22H21F2N3S/c1-2-27-12-15(11-14-7-3-5-9-18(14)23)20-17(13-27)21(26-22(28)25-20)16-8-4-6-10-19(16)24/h3-11,17,21H,2,12-13H2,1H3,(H,26,28) YWHIVJAXFRWJPG-UHFFFAOYSA-N 50439101 CHEMBL2417662 Cholinesterase 4480 ChEMBL 10.1016/j.ejmech.2013.06.054 10.7270/Q2VH5Q78 23871902 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Awang, KB; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439101 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439101&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898764 175451418 CHEMBL2417662 ZINC96282931 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073877 CCN1CC2C(NC(=S)N=C2C(C1)=Cc1ccccc1Cl)c1ccccc1Cl InChI=1S/C22H21Cl2N3S/c1-2-27-12-15(11-14-7-3-5-9-18(14)23)20-17(13-27)21(26-22(28)25-20)16-8-4-6-10-19(16)24/h3-11,17,21H,2,12-13H2,1H3,(H,26,28) PIRMFWXZFCCSPO-UHFFFAOYSA-N 50439102 CHEMBL2417661 Cholinesterase 3570 ChEMBL 10.1016/j.ejmech.2013.06.054 10.7270/Q2VH5Q78 23871902 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Awang, KB; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439102 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439102&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898765 175451419 CHEMBL2417661 ZINC96282933 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073878 CCN1CC2C(NC(=S)N=C2C(C1)=Cc1ccccc1C)c1ccccc1C InChI=1S/C24H27N3S/c1-4-27-14-19(13-18-11-7-5-9-16(18)2)22-21(15-27)23(26-24(28)25-22)20-12-8-6-10-17(20)3/h5-13,21,23H,4,14-15H2,1-3H3,(H,26,28) GFDPAOBAVMFKNA-UHFFFAOYSA-N 50439103 CHEMBL2417660 Cholinesterase 3930 ChEMBL 10.1016/j.ejmech.2013.06.054 10.7270/Q2VH5Q78 23871902 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Awang, KB; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439103 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439103&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898766 175451420 CHEMBL2417660 ZINC96282935 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073879 CCN1CC2C(NC(=S)N=C2C(C1)=Cc1ccccc1)c1ccccc1 InChI=1S/C22H23N3S/c1-2-25-14-18(13-16-9-5-3-6-10-16)21-19(15-25)20(23-22(26)24-21)17-11-7-4-8-12-17/h3-13,19-20H,2,14-15H2,1H3,(H,23,26) RVGBXVNYSROBSW-UHFFFAOYSA-N 50439104 CHEMBL2417659 Cholinesterase 4200 ChEMBL 10.1016/j.ejmech.2013.06.054 10.7270/Q2VH5Q78 23871902 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Awang, KB; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50439104 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50439104&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91898767 175451421 CHEMBL2417659 ZINC96282937 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066302 Cc1c(OCCCCN2CCOCC2)ccc2c1oc(cc2=O)-c1ccccc1 InChI=1S/C24H27NO4/c1-18-22(28-14-6-5-11-25-12-15-27-16-13-25)10-9-20-21(26)17-23(29-24(18)20)19-7-3-2-4-8-19/h2-4,7-10,17H,5-6,11-16H2,1H3 RONHWZKWQSMGNP-UHFFFAOYSA-N 50435239 CHEMBL2393071 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435239 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435239&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71603130 175447556 CHEMBL2393071 ZINC96271250 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066303 CN(C)CCCCOc1ccc2c(oc(cc2=O)-c2ccccc2)c1C InChI=1S/C22H25NO3/c1-16-20(25-14-8-7-13-23(2)3)12-11-18-19(24)15-21(26-22(16)18)17-9-5-4-6-10-17/h4-6,9-12,15H,7-8,13-14H2,1-3H3 JKJRTNOOSNWMJV-UHFFFAOYSA-N 50435240 CHEMBL2393069 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435240 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435240&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71603075 175447557 CHEMBL2393069 ZINC96271251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066304 CCN(CC)CCCCCOc1ccc2c(oc(cc2=O)-c2ccccc2)c1C InChI=1S/C25H31NO3/c1-4-26(5-2)16-10-7-11-17-28-23-15-14-21-22(27)18-24(29-25(21)19(23)3)20-12-8-6-9-13-20/h6,8-9,12-15,18H,4-5,7,10-11,16-17H2,1-3H3 LYXYENKXUDZGBB-UHFFFAOYSA-N 50435241 CHEMBL2393068 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435241 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435241&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71603074 175447558 CHEMBL2393068 ZINC96271252 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066305 Cc1c(OCCCCN2CCCCC2)ccc2c1oc(cc2=O)-c1ccccc1 InChI=1S/C25H29NO3/c1-19-23(28-17-9-8-16-26-14-6-3-7-15-26)13-12-21-22(27)18-24(29-25(19)21)20-10-4-2-5-11-20/h2,4-5,10-13,18H,3,6-9,14-17H2,1H3 JTLGJFBDQUBICH-UHFFFAOYSA-N 50435242 CHEMBL2393063 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435242 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435242&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71603009 175447559 CHEMBL2393063 ZINC96271253 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066306 Cc1c(OCCCCN2CCC(O)CC2)ccc2c1oc(cc2=O)-c1ccccc1 InChI=1S/C25H29NO4/c1-18-23(29-16-6-5-13-26-14-11-20(27)12-15-26)10-9-21-22(28)17-24(30-25(18)21)19-7-3-2-4-8-19/h2-4,7-10,17,20,27H,5-6,11-16H2,1H3 UKTJXSFOAKCFCY-UHFFFAOYSA-N 50435243 CHEMBL2393060 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435243 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435243&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71603006 175447560 CHEMBL2393060 ZINC96271254 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066307 CC1CCCCN1CCCCOc1ccc2c(oc(cc2=O)-c2ccccc2)c1C InChI=1S/C26H31NO3/c1-19-10-6-7-15-27(19)16-8-9-17-29-24-14-13-22-23(28)18-25(30-26(22)20(24)2)21-11-4-3-5-12-21/h3-5,11-14,18-19H,6-10,15-17H2,1-2H3 YXQKMQFSGNZWHC-UHFFFAOYSA-N 50435244 CHEMBL2393055 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435244 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435244&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71602953 175447561 CHEMBL2393055 ZINC96271256 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066308 CC1CCCCN1CCOc1ccc2c(oc(cc2=O)-c2ccccc2)c1C InChI=1S/C24H27NO3/c1-17-8-6-7-13-25(17)14-15-27-22-12-11-20-21(26)16-23(28-24(20)18(22)2)19-9-4-3-5-10-19/h3-5,9-12,16-17H,6-8,13-15H2,1-2H3 TYFJTPBIWREAAP-UHFFFAOYSA-N 50435245 CHEMBL2392941 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435245 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435245&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71602951 175447562 CHEMBL2392941 ZINC96271258 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066309 Cc1c(O)ccc2c1oc(cc2=O)-c1ccccc1 InChI=1S/C16H12O3/c1-10-13(17)8-7-12-14(18)9-15(19-16(10)12)11-5-3-2-4-6-11/h2-9,17H,1H3 APZPBTFVVAFVHI-UHFFFAOYSA-N 50435246 CHEMBL2393075 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435246 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435246&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 13115575 175447563 CHEMBL2393075 ZINC96271259 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066313 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 12700 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066315 CC1CCCCN1CCCOc1ccc2c(oc(cc2=O)-c2ccccc2)c1C InChI=1S/C25H29NO3/c1-18-9-6-7-14-26(18)15-8-16-28-23-13-12-21-22(27)17-24(29-25(21)19(23)2)20-10-4-3-5-11-20/h3-5,10-13,17-18H,6-9,14-16H2,1-2H3 AXLCIPJFRQULIP-UHFFFAOYSA-N 50435249 CHEMBL2393054 Cholinesterase 5840 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435249 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435249&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71602952 175447566 CHEMBL2393054 ZINC96271263 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066316 CN1CCN(CCCCOc2ccc3c(oc(cc3=O)-c3ccccc3)c2C)CC1 InChI=1S/C25H30N2O3/c1-19-23(29-17-7-6-12-27-15-13-26(2)14-16-27)11-10-21-22(28)18-24(30-25(19)21)20-8-4-3-5-9-20/h3-5,8-11,18H,6-7,12-17H2,1-2H3 KZASLSLPFQAZRC-UHFFFAOYSA-N 50435250 CHEMBL2393065 Cholinesterase 5750 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435250 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435250&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71603071 175447567 CHEMBL2393065 ZINC96271264 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066317 Cc1c(OCCCCN2CCCC2)ccc2c1oc(cc2=O)-c1ccccc1 InChI=1S/C24H27NO3/c1-18-22(27-16-8-7-15-25-13-5-6-14-25)12-11-20-21(26)17-23(28-24(18)20)19-9-3-2-4-10-19/h2-4,9-12,17H,5-8,13-16H2,1H3 YDMIIIPMEYJFFO-UHFFFAOYSA-N 50435251 CHEMBL2392938 Cholinesterase 5700 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435251 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435251&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71602906 175447568 CHEMBL2392938 ZINC96271265 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066318 CN1CCN(CCCCCOc2ccc3c(oc(cc3=O)-c3ccccc3)c2C)CC1 InChI=1S/C26H32N2O3/c1-20-24(30-18-8-4-7-13-28-16-14-27(2)15-17-28)12-11-22-23(29)19-25(31-26(20)22)21-9-5-3-6-10-21/h3,5-6,9-12,19H,4,7-8,13-18H2,1-2H3 APTXIDCPFDQWLD-UHFFFAOYSA-N 50435252 CHEMBL2393066 Cholinesterase 4870 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435252 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435252&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71603072 175447569 CHEMBL2393066 ZINC96271266 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066319 Cc1c(OCCCCCN2CCC(O)CC2)ccc2c1oc(cc2=O)-c1ccccc1 InChI=1S/C26H31NO4/c1-19-24(30-17-7-3-6-14-27-15-12-21(28)13-16-27)11-10-22-23(29)18-25(31-26(19)22)20-8-4-2-5-9-20/h2,4-5,8-11,18,21,28H,3,6-7,12-17H2,1H3 WWCCBBVMJQCXNV-UHFFFAOYSA-N 50435253 CHEMBL2393061 Cholinesterase 4850 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435253 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435253&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71603007 175447570 CHEMBL2393061 ZINC96271267 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066320 CCN(CC)CCCCOc1ccc2c(oc(cc2=O)-c2ccccc2)c1C InChI=1S/C24H29NO3/c1-4-25(5-2)15-9-10-16-27-22-14-13-20-21(26)17-23(28-24(20)18(22)3)19-11-7-6-8-12-19/h6-8,11-14,17H,4-5,9-10,15-16H2,1-3H3 ZPMMPPBRCTWMHF-UHFFFAOYSA-N 50435254 CHEMBL2393067 Cholinesterase 4820 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435254 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435254&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71603073 175447571 CHEMBL2393067 ZINC96271268 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066321 Cc1c(OCCCN2CCC(O)CC2)ccc2c1oc(cc2=O)-c1ccccc1 InChI=1S/C24H27NO4/c1-17-22(28-15-5-12-25-13-10-19(26)11-14-25)9-8-20-21(27)16-23(29-24(17)20)18-6-3-2-4-7-18/h2-4,6-9,16,19,26H,5,10-15H2,1H3 YUMJJAGCNNWOJV-UHFFFAOYSA-N 50435255 CHEMBL2393059 Cholinesterase 4120 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435255 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435255&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71603005 175447572 CHEMBL2393059 ZINC96271269 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066322 COC(=O)[C@@H]1CCCN1CCCCCOc1ccc2c(oc(cc2=O)-c2ccccc2)c1C InChI=1S/C27H31NO5/c1-19-24(32-17-8-4-7-15-28-16-9-12-22(28)27(30)31-2)14-13-21-23(29)18-25(33-26(19)21)20-10-5-3-6-11-20/h3,5-6,10-11,13-14,18,22H,4,7-9,12,15-17H2,1-2H3/t22-/m0/s1 AGNFQCKJPUBONH-QFIPXVFZSA-N 50435248 CHEMBL2393074 Cholinesterase 3930 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435248 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435248&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71603133 175447565 CHEMBL2393074 ZINC96271261 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066323 Cc1c(OCCCCCCN2CCC(O)CC2)ccc2c1oc(cc2=O)-c1ccccc1 InChI=1S/C27H33NO4/c1-20-25(31-18-8-3-2-7-15-28-16-13-22(29)14-17-28)12-11-23-24(30)19-26(32-27(20)23)21-9-5-4-6-10-21/h4-6,9-12,19,22,29H,2-3,7-8,13-18H2,1H3 KNVRTFGEXWYNHE-UHFFFAOYSA-N 50435256 CHEMBL2393062 Cholinesterase 3930 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435256 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435256&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71603008 175447573 CHEMBL2393062 ZINC96271270 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066324 COC(=O)[C@@H]1CCCN1CCCCOc1ccc2c(oc(cc2=O)-c2ccccc2)c1C InChI=1S/C26H29NO5/c1-18-23(31-16-7-6-14-27-15-8-11-21(27)26(29)30-2)13-12-20-22(28)17-24(32-25(18)20)19-9-4-3-5-10-19/h3-5,9-10,12-13,17,21H,6-8,11,14-16H2,1-2H3/t21-/m0/s1 VDOKFMFBTXCKMK-NRFANRHFSA-N 50435247 CHEMBL2393073 Cholinesterase 3820 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435247 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435247&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71603132 175447564 CHEMBL2393073 ZINC96271260 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066325 CC1CCCCN1CCCCCCOc1ccc2c(oc(cc2=O)-c2ccccc2)c1C InChI=1S/C28H35NO3/c1-21-12-8-10-18-29(21)17-9-3-4-11-19-31-26-16-15-24-25(30)20-27(32-28(24)22(26)2)23-13-6-5-7-14-23/h5-7,13-16,20-21H,3-4,8-12,17-19H2,1-2H3 DWHIUIXHPDJNKC-UHFFFAOYSA-N 50435257 CHEMBL2393057 Cholinesterase 3740 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435257 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435257&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71602955 175447574 CHEMBL2393057 ZINC96271272 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066326 Cc1c(OCCCCCCN2CCCC2)ccc2c1oc(cc2=O)-c1ccccc1 InChI=1S/C26H31NO3/c1-20-24(29-18-10-3-2-7-15-27-16-8-9-17-27)14-13-22-23(28)19-25(30-26(20)22)21-11-5-4-6-12-21/h4-6,11-14,19H,2-3,7-10,15-18H2,1H3 CEZZKAHZNNVPOC-UHFFFAOYSA-N 50435258 CHEMBL2392940 Cholinesterase 3280 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435258 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435258&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71602950 175447575 CHEMBL2392940 ZINC96271273 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066327 Cc1c(OCCN2CCC(O)CC2)ccc2c1oc(cc2=O)-c1ccccc1 InChI=1S/C23H25NO4/c1-16-21(27-14-13-24-11-9-18(25)10-12-24)8-7-19-20(26)15-22(28-23(16)19)17-5-3-2-4-6-17/h2-8,15,18,25H,9-14H2,1H3 RHIDSCLGNKDOQE-UHFFFAOYSA-N 50435259 CHEMBL2393058 Cholinesterase 3210 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435259 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435259&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71603004 175447576 CHEMBL2393058 ZINC96271274 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066331 Cc1c(OCCCN2CCCC2)ccc2c1oc(cc2=O)-c1ccccc1 InChI=1S/C23H25NO3/c1-17-21(26-15-7-14-24-12-5-6-13-24)11-10-19-20(25)16-22(27-23(17)19)18-8-3-2-4-9-18/h2-4,8-11,16H,5-7,12-15H2,1H3 PHWLRVAQNSVPJY-UHFFFAOYSA-N 50435260 CHEMBL2392937 Cholinesterase 2780 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435260 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435260&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71602905 175447577 CHEMBL2392937 ZINC96271275 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066332 CC1CCCCN1CCCCCOc1ccc2c(oc(cc2=O)-c2ccccc2)c1C InChI=1S/C27H33NO3/c1-20-11-7-9-17-28(20)16-8-4-10-18-30-25-15-14-23-24(29)19-26(31-27(23)21(25)2)22-12-5-3-6-13-22/h3,5-6,12-15,19-20H,4,7-11,16-18H2,1-2H3 BDFXZHLXKUDFHC-UHFFFAOYSA-N 50435261 CHEMBL2393056 Cholinesterase 2770 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435261 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435261&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71602954 175447578 CHEMBL2393056 ZINC96271277 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066333 Cc1c(OCCN2CCCC2)ccc2c1oc(cc2=O)-c1ccccc1 InChI=1S/C22H23NO3/c1-16-20(25-14-13-23-11-5-6-12-23)10-9-18-19(24)15-21(26-22(16)18)17-7-3-2-4-8-17/h2-4,7-10,15H,5-6,11-14H2,1H3 GFPKLZJTGXCXCI-UHFFFAOYSA-N 50435262 CHEMBL2392936 Cholinesterase 2710 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435262 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435262&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71602904 175447579 CHEMBL2392936 ZINC96271278 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066335 CN(C)CCCCCOc1ccc2c(oc(cc2=O)-c2ccccc2)c1C InChI=1S/C23H27NO3/c1-17-21(26-15-9-5-8-14-24(2)3)13-12-19-20(25)16-22(27-23(17)19)18-10-6-4-7-11-18/h4,6-7,10-13,16H,5,8-9,14-15H2,1-3H3 REFAZYLZAXUBGI-UHFFFAOYSA-N 50435263 CHEMBL2393070 Cholinesterase 2540 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435263 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435263&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71603129 175447580 CHEMBL2393070 ZINC96271279 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066338 Cc1c(OCCCCCN2CCCC2)ccc2c1oc(cc2=O)-c1ccccc1 InChI=1S/C25H29NO3/c1-19-23(28-17-9-3-6-14-26-15-7-8-16-26)13-12-21-22(27)18-24(29-25(19)21)20-10-4-2-5-11-20/h2,4-5,10-13,18H,3,6-9,14-17H2,1H3 BRXJBYCPWWKBGD-UHFFFAOYSA-N 50435264 CHEMBL2392939 Cholinesterase 1910 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435264 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435264&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71602907 175447581 CHEMBL2392939 ZINC96271280 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066343 Cc1c(OCCCCCN2CCCCC2)ccc2c1oc(cc2=O)-c1ccccc1 InChI=1S/C26H31NO3/c1-20-24(29-18-10-4-9-17-27-15-7-3-8-16-27)14-13-22-23(28)19-25(30-26(20)22)21-11-5-2-6-12-21/h2,5-6,11-14,19H,3-4,7-10,15-18H2,1H3 FEBATDALCUAQCM-UHFFFAOYSA-N 50435265 CHEMBL2393064 Cholinesterase 1410 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435265 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435265&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71603070 175447582 CHEMBL2393064 ZINC96271281 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066360 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 54 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51066301 Cc1c(OCCCCCN2CCOCC2)ccc2c1oc(cc2=O)-c1ccccc1 InChI=1S/C25H29NO4/c1-19-23(29-15-7-3-6-12-26-13-16-28-17-14-26)11-10-21-22(27)18-24(30-25(19)21)20-8-4-2-5-9-20/h2,4-5,8-11,18H,3,6-7,12-17H2,1H3 AUTKMUGYKXZGTJ-UHFFFAOYSA-N 50435238 CHEMBL2393072 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2013.02.095 10.7270/Q2571DD9 23511019 Li, RS; Wang, XB; Hu, XJ; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435238 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435238&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71603131 175447555 CHEMBL2393072 ZINC96271249 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062138 CC(C(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccc(OCCO[N+]([O-])=O)cc1 InChI=1S/C36H41FN4O5/c1-25(27-16-19-29(32(37)24-27)26-14-17-28(18-15-26)45-22-23-46-41(43)44)36(42)39-21-9-3-2-8-20-38-35-30-10-4-6-12-33(30)40-34-13-7-5-11-31(34)35/h4,6,10,12,14-19,24-25H,2-3,5,7-9,11,13,20-23H2,1H3,(H,38,40)(H,39,42) KZCQJHOZUQOHSD-UHFFFAOYSA-N 50433313 CHEMBL2376474 Cholinesterase 1.7 ChEMBL 10.1016/j.bmc.2013.03.005 10.7270/Q2319X82 23541836 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433313 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433313&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71602519 175445630 CHEMBL2376474 ZINC96269471 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062140 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 11 ChEMBL 10.1016/j.bmc.2013.03.005 10.7270/Q2319X82 23541836 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062141 CC(C(=O)NCCCCCCCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccc(OCCCCCCO[N+]([O-])=O)cc1 InChI=1S/C42H53FN4O5/c1-31(33-22-25-35(38(43)30-33)32-20-23-34(24-21-32)51-28-14-6-7-15-29-52-47(49)50)42(48)45-27-13-5-3-2-4-12-26-44-41-36-16-8-10-18-39(36)46-40-19-11-9-17-37(40)41/h8,10,16,18,20-25,30-31H,2-7,9,11-15,17,19,26-29H2,1H3,(H,44,46)(H,45,48) IUSZGKKLIPPMOS-UHFFFAOYSA-N 50433315 CHEMBL2376481 Cholinesterase 1.5 ChEMBL 10.1016/j.bmc.2013.03.005 10.7270/Q2319X82 23541836 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433315 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433315&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71602636 175445632 CHEMBL2376481 ZINC96269473 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062142 CC(C(=O)NCCCCCCCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccc(OCCCCO[N+]([O-])=O)cc1 InChI=1S/C40H49FN4O5/c1-29(31-20-23-33(36(41)28-31)30-18-21-32(22-19-30)49-26-12-13-27-50-45(47)48)40(46)43-25-11-5-3-2-4-10-24-42-39-34-14-6-8-16-37(34)44-38-17-9-7-15-35(38)39/h6,8,14,16,18-23,28-29H,2-5,7,9-13,15,17,24-27H2,1H3,(H,42,44)(H,43,46) VGCARQWJPMTGRS-UHFFFAOYSA-N 50433316 CHEMBL2376480 Cholinesterase 1.3 ChEMBL 10.1016/j.bmc.2013.03.005 10.7270/Q2319X82 23541836 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433316 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433316&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71602635 175445633 CHEMBL2376480 ZINC96269475 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062143 CC(C(=O)NCCCCCCCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccc(OCCCO[N+]([O-])=O)cc1 InChI=1S/C39H47FN4O5/c1-28(30-19-22-32(35(40)27-30)29-17-20-31(21-18-29)48-25-12-26-49-44(46)47)39(45)42-24-11-5-3-2-4-10-23-41-38-33-13-6-8-15-36(33)43-37-16-9-7-14-34(37)38/h6,8,13,15,17-22,27-28H,2-5,7,9-12,14,16,23-26H2,1H3,(H,41,43)(H,42,45) JBDKIZMXCKQPEO-UHFFFAOYSA-N 50433317 CHEMBL2376479 Cholinesterase 1.6 ChEMBL 10.1016/j.bmc.2013.03.005 10.7270/Q2319X82 23541836 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433317 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433317&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71602580 175445634 CHEMBL2376479 ZINC96269477 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062144 CC(C(=O)NCCCCCCCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccc(OCCO[N+]([O-])=O)cc1 InChI=1S/C38H45FN4O5/c1-27(29-18-21-31(34(39)26-29)28-16-19-30(20-17-28)47-24-25-48-43(45)46)38(44)41-23-11-5-3-2-4-10-22-40-37-32-12-6-8-14-35(32)42-36-15-9-7-13-33(36)37/h6,8,12,14,16-21,26-27H,2-5,7,9-11,13,15,22-25H2,1H3,(H,40,42)(H,41,44) NEQBDGIZCFQZDX-UHFFFAOYSA-N 50433318 CHEMBL2376478 Cholinesterase 1.000000 ChEMBL 10.1016/j.bmc.2013.03.005 10.7270/Q2319X82 23541836 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433318 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433318&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71602579 175445635 CHEMBL2376478 ZINC96269479 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062145 CC(C(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccc(OCCCCCCO[N+]([O-])=O)cc1 InChI=1S/C40H49FN4O5/c1-29(31-20-23-33(36(41)28-31)30-18-21-32(22-19-30)49-26-12-4-5-13-27-50-45(47)48)40(46)43-25-11-3-2-10-24-42-39-34-14-6-8-16-37(34)44-38-17-9-7-15-35(38)39/h6,8,14,16,18-23,28-29H,2-5,7,9-13,15,17,24-27H2,1H3,(H,42,44)(H,43,46) HVGOKDSSQHDHOP-UHFFFAOYSA-N 50433319 CHEMBL2376477 Cholinesterase 0.600000 ChEMBL 10.1016/j.bmc.2013.03.005 10.7270/Q2319X82 23541836 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433319 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433319&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71602578 175445636 CHEMBL2376477 ZINC96269481 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062146 CC(C(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccc(OCCCCO[N+]([O-])=O)cc1 InChI=1S/C38H45FN4O5/c1-27(29-18-21-31(34(39)26-29)28-16-19-30(20-17-28)47-24-10-11-25-48-43(45)46)38(44)41-23-9-3-2-8-22-40-37-32-12-4-6-14-35(32)42-36-15-7-5-13-33(36)37/h4,6,12,14,16-21,26-27H,2-3,5,7-11,13,15,22-25H2,1H3,(H,40,42)(H,41,44) AGEBSSRVIKUYTM-UHFFFAOYSA-N 50433320 CHEMBL2376476 Cholinesterase 1.3 ChEMBL 10.1016/j.bmc.2013.03.005 10.7270/Q2319X82 23541836 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433320 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433320&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71602577 175445637 CHEMBL2376476 ZINC96269483 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062147 CC(C(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccc(OCCCO[N+]([O-])=O)cc1 InChI=1S/C37H43FN4O5/c1-26(28-17-20-30(33(38)25-28)27-15-18-29(19-16-27)46-23-10-24-47-42(44)45)37(43)40-22-9-3-2-8-21-39-36-31-11-4-6-13-34(31)41-35-14-7-5-12-32(35)36/h4,6,11,13,15-20,25-26H,2-3,5,7-10,12,14,21-24H2,1H3,(H,39,41)(H,40,43) QGSCRRBPBVMEHM-UHFFFAOYSA-N 50433321 CHEMBL2376475 Cholinesterase 2.4 ChEMBL 10.1016/j.bmc.2013.03.005 10.7270/Q2319X82 23541836 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433321 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433321&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71602520 175445638 CHEMBL2376475 ZINC96269485 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062148 CC(C(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccc(OCCO[N+]([O-])=O)cc1 InChI=1S/C36H41FN4O5/c1-25(27-16-19-29(32(37)24-27)26-14-17-28(18-15-26)45-22-23-46-41(43)44)36(42)39-21-9-3-2-8-20-38-35-30-10-4-6-12-33(30)40-34-13-7-5-11-31(34)35/h4,6,10,12,14-19,24-25H,2-3,5,7-9,11,13,20-23H2,1H3,(H,38,40)(H,39,42) KZCQJHOZUQOHSD-UHFFFAOYSA-N 50433313 CHEMBL2376474 Cholinesterase 2.5 ChEMBL 10.1016/j.bmc.2013.03.005 10.7270/Q2319X82 23541836 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433313 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433313&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71602519 175445630 CHEMBL2376474 ZINC96269471 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062149 CC(C(=O)NCCCCCCCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccccc1 InChI=1S/C36H42FN3O/c1-26(28-21-22-29(32(37)25-28)27-15-7-6-8-16-27)36(41)39-24-14-5-3-2-4-13-23-38-35-30-17-9-11-19-33(30)40-34-20-12-10-18-31(34)35/h6-9,11,15-17,19,21-22,25-26H,2-5,10,12-14,18,20,23-24H2,1H3,(H,38,40)(H,39,41) BHBIPNYAHFZVSM-UHFFFAOYSA-N 50433322 CHEMBL2376473 Cholinesterase 2.1 ChEMBL 10.1016/j.bmc.2013.03.005 10.7270/Q2319X82 23541836 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433322 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433322&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72725539 175445639 CHEMBL2376473 ZINC96269487 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51062150 CC(C(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccccc1 InChI=1S/C34H38FN3O/c1-24(26-19-20-27(30(35)23-26)25-13-5-4-6-14-25)34(39)37-22-12-3-2-11-21-36-33-28-15-7-9-17-31(28)38-32-18-10-8-16-29(32)33/h4-7,9,13-15,17,19-20,23-24H,2-3,8,10-12,16,18,21-22H2,1H3,(H,36,38)(H,37,39) LIUKBAIABYHLPL-UHFFFAOYSA-N 50433323 CHEMBL2376472 Cholinesterase 3.7 ChEMBL 10.1016/j.bmc.2013.03.005 10.7270/Q2319X82 23541836 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433323 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433323&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72725538 175445640 CHEMBL2376472 ZINC96269489 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067662 COc1cc(=O)oc2cc(O)ccc12 InChI=1S/C10H8O4/c1-13-8-5-10(12)14-9-4-6(11)2-3-7(8)9/h2-5,11H,1H3 RZNHAJPLNGBHCA-UHFFFAOYSA-N 50435940 CHEMBL2391651 Cholinesterase >500000 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435940 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435940&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5702835 175448257 CHEMBL2391651 ZINC12418078 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067663 Oc1ccc2c(cc(=O)oc2c1)-c1ccccc1 InChI=1S/C15H10O3/c16-11-6-7-12-13(10-4-2-1-3-5-10)9-15(17)18-14(12)8-11/h1-9,16H IVJMJRRORVMRJJ-UHFFFAOYSA-N 50104891 7-Hydroxy-4-phenyl-chromen-2-one::7-hydroxy-4-phenyl-2H-chromen-2-one::CHEMBL325841::Coumarin derivative, 3c::cid_5357479 Cholinesterase >500000 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50104891 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50104891&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5357479 104000713 CHEMBL325841 ZINC00162733 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067664 Cc1cc(=O)oc2cc(O)ccc12 InChI=1S/C10H8O3/c1-6-4-10(12)13-9-5-7(11)2-3-8(6)9/h2-5,11H,1H3 HSHNITRMYYLLCV-UHFFFAOYSA-N 50022178 4-Methyl-7-hydroxycoumarin::4-methylumbelliferone::7-Hydroxy-4-methyl-2-oxo-2H-1-benzopyran::7-Hydroxy-4-methyl-2-oxo-3-chromene::7-Hydroxy-4-methyl-2H-1-benzopyran-2-one::7-Hydroxy-4-methyl-2H-2-one (1)::7-Hydroxy-4-methylcoumarin::7-hydroxy-4-methyl-2H-chromen-2-one::CHEMBL12208::Coumarin derivative, 3b::Imecromone::beta-Methylumbelliferone::cid_5280567 Cholinesterase >500000 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50022178 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50022178&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 4MU 4AX7,4V28,3ETS,6Z69,5JR3,5IK8,5IK5 5280567 103932801 17224 CHEMBL12208 DB07118 C03081 ZINC00058121 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067665 Oc1ccc2ccc(=O)oc2c1 InChI=1S/C9H6O3/c10-7-3-1-6-2-4-9(11)12-8(6)5-7/h1-5,10H ORHBXUUXSCNDEV-UHFFFAOYSA-N 50174558 7-hydroxy-2H-1-benzopyran-2-one::7-hydroxy-2H-chromen-2-one::CHEMBL51628::Coumarin derivative, 3a::beta-umbelliferone::hydrangin::skimmetin::umbelliferone Cholinesterase >500000 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50174558 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50174558&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 07L 5LNI,5LNJ,8DQQ,3U0F,5RT5 5281426 104060374 27510 CHEMBL51628 C09315 ZINC00058111 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067671 O=C(CN1CCNCC1)Nc1c2CCCCc2nc2ccccc12 InChI=1S/C19H24N4O/c24-18(13-23-11-9-20-10-12-23)22-19-14-5-1-3-7-16(14)21-17-8-4-2-6-15(17)19/h1,3,5,7,20H,2,4,6,8-13H2,(H,21,22,24) MWKCDNFJTHGYJQ-UHFFFAOYSA-N 50435941 CHEMBL2391652 Cholinesterase 22000 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435941 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435941&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71699397 175448258 CHEMBL2391652 ZINC96271823 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067672 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 12700 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067673 COc1cc(=O)oc2cc(OCCN3CCN(CC(=O)Nc4c5CCCCc5nc5ccccc45)CC3)ccc12 InChI=1S/C31H34N4O5/c1-38-27-19-30(37)40-28-18-21(10-11-24(27)28)39-17-16-34-12-14-35(15-13-34)20-29(36)33-31-22-6-2-4-8-25(22)32-26-9-5-3-7-23(26)31/h2,4,6,8,10-11,18-19H,3,5,7,9,12-17,20H2,1H3,(H,32,33,36) QHOLDIQQONVHTG-UHFFFAOYSA-N 50435942 CHEMBL2391491 Cholinesterase 5140 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435942 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435942&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71699563 175448259 CHEMBL2391491 ZINC96271824 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067674 O=C(CN1CCN(CCCCCCOc2ccc3c(cc(=O)oc3c2)-c2ccccc2)CC1)Nc1c2CCCCc2nc2ccccc12 InChI=1S/C40H44N4O4/c45-38(42-40-32-14-6-8-16-35(32)41-36-17-9-7-15-33(36)40)28-44-23-21-43(22-24-44)20-10-1-2-11-25-47-30-18-19-31-34(29-12-4-3-5-13-29)27-39(46)48-37(31)26-30/h3-6,8,12-14,16,18-19,26-27H,1-2,7,9-11,15,17,20-25,28H2,(H,41,42,45) HUQDZMOHVVJHEF-UHFFFAOYSA-N 50435943 CHEMBL2391482 Cholinesterase 4510 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435943 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435943&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71698450 175448260 CHEMBL2391482 ZINC96271825 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067675 COc1cc(=O)oc2cc(OCCCCN3CCN(CC(=O)Nc4c5CCCCc5nc5ccccc45)CC3)ccc12 InChI=1S/C33H38N4O5/c1-40-29-21-32(39)42-30-20-23(12-13-26(29)30)41-19-7-6-14-36-15-17-37(18-16-36)22-31(38)35-33-24-8-2-4-10-27(24)34-28-11-5-3-9-25(28)33/h2,4,8,10,12-13,20-21H,3,5-7,9,11,14-19,22H2,1H3,(H,34,35,38) XYMNXQZLQMQWHO-UHFFFAOYSA-N 50435944 CHEMBL2391475 Cholinesterase 3630 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435944 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435944&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71699632 175448261 CHEMBL2391475 ZINC96271826 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067676 O=C(CN1CCN(CCCOc2ccc3c(cc(=O)oc3c2)-c2ccccc2)CC1)Nc1c2CCCCc2nc2ccccc12 InChI=1S/C37H38N4O4/c42-35(39-37-29-11-4-6-13-32(29)38-33-14-7-5-12-30(33)37)25-41-20-18-40(19-21-41)17-8-22-44-27-15-16-28-31(26-9-2-1-3-10-26)24-36(43)45-34(28)23-27/h1-4,6,9-11,13,15-16,23-24H,5,7-8,12,14,17-22,25H2,(H,38,39,42) LIGXGSONOCBWSR-UHFFFAOYSA-N 50435945 CHEMBL2391479 Cholinesterase 3160 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435945 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435945&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71698368 175448262 CHEMBL2391479 ZINC96271827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067679 COc1cc(=O)oc2cc(OCCCN3CCN(CC(=O)Nc4c5CCCCc5nc5ccccc45)CC3)ccc12 InChI=1S/C32H36N4O5/c1-39-28-20-31(38)41-29-19-22(11-12-25(28)29)40-18-6-13-35-14-16-36(17-15-35)21-30(37)34-32-23-7-2-4-9-26(23)33-27-10-5-3-8-24(27)32/h2,4,7,9,11-12,19-20H,3,5-6,8,10,13-18,21H2,1H3,(H,33,34,37) CSOBROVYJLLXAQ-UHFFFAOYSA-N 50435946 CHEMBL2391492 Cholinesterase 1830 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435946 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435946&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71699631 175448263 CHEMBL2391492 ZINC96271828 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067680 O=C(CN1CCN(CCCCOc2ccc3c(cc(=O)oc3c2)-c2ccccc2)CC1)Nc1c2CCCCc2nc2ccccc12 InChI=1S/C38H40N4O4/c43-36(40-38-30-12-4-6-14-33(30)39-34-15-7-5-13-31(34)38)26-42-21-19-41(20-22-42)18-8-9-23-45-28-16-17-29-32(27-10-2-1-3-11-27)25-37(44)46-35(29)24-28/h1-4,6,10-12,14,16-17,24-25H,5,7-9,13,15,18-23,26H2,(H,39,40,43) RFMLTHAJELVKLQ-UHFFFAOYSA-N 50435947 CHEMBL2391480 Cholinesterase 1820 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435947 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435947&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71698369 175448264 CHEMBL2391480 ZINC96271829 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067681 COc1cc(=O)oc2cc(OCCCCCCN3CCN(CC(=O)Nc4c5CCCCc5nc5ccccc45)CC3)ccc12 InChI=1S/C35H42N4O5/c1-42-31-23-34(41)44-32-22-25(14-15-28(31)32)43-21-9-3-2-8-16-38-17-19-39(20-18-38)24-33(40)37-35-26-10-4-6-12-29(26)36-30-13-7-5-11-27(30)35/h4,6,10,12,14-15,22-23H,2-3,5,7-9,11,13,16-21,24H2,1H3,(H,36,37,40) ZRZOBRDQJAZAHG-UHFFFAOYSA-N 50435948 CHEMBL2391477 Cholinesterase 1780 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435948 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435948&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71699634 175448265 CHEMBL2391477 ZINC96271830 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51064525 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 19340 ChEMBL 10.1016/j.bmc.2013.03.058 10.7270/Q2V40WK4 23602518 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51064526 S=C1NC(C2CNCC(=Cc3cccc4ccccc34)C2=N1)c1cccc2ccccc12 InChI=1S/C28H23N3S/c32-28-30-26-21(15-20-11-5-9-18-7-1-3-12-22(18)20)16-29-17-25(26)27(31-28)24-14-6-10-19-8-2-4-13-23(19)24/h1-15,25,27,29H,16-17H2,(H,31,32) ICWLSRBWUPEVOV-UHFFFAOYSA-N 50434506 CHEMBL2385785 Cholinesterase 5580 ChEMBL 10.1016/j.bmc.2013.03.058 10.7270/Q2V40WK4 23602518 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50434506 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50434506&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91899891 175446823 CHEMBL2385785 ZINC96270561 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51064527 Clc1ccc(C=C2CNCC3C(NC(=S)N=C23)c2ccc(Cl)cc2Cl)c(Cl)c1 InChI=1S/C20H15Cl4N3S/c21-12-2-1-10(16(23)6-12)5-11-8-25-9-15-18(11)26-20(28)27-19(15)14-4-3-13(22)7-17(14)24/h1-7,15,19,25H,8-9H2,(H,27,28) FYCQFEIFUYGGSU-UHFFFAOYSA-N 50434507 CHEMBL2385784 Cholinesterase 49800 ChEMBL 10.1016/j.bmc.2013.03.058 10.7270/Q2V40WK4 23602518 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50434507 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50434507&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91899892 175446824 CHEMBL2385784 ZINC96270563 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51064528 Fc1ccc(C=C2CNCC3C(NC(=S)N=C23)c2ccc(F)cc2)cc1 InChI=1S/C20H17F2N3S/c21-15-5-1-12(2-6-15)9-14-10-23-11-17-18(24-20(26)25-19(14)17)13-3-7-16(22)8-4-13/h1-9,17-18,23H,10-11H2,(H,24,26) XDEMWJWHQRINAV-UHFFFAOYSA-N 50434508 CHEMBL2385783 Cholinesterase 28820 ChEMBL 10.1016/j.bmc.2013.03.058 10.7270/Q2V40WK4 23602518 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50434508 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50434508&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91899893 175446825 CHEMBL2385783 ZINC96270565 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51064529 Clc1ccc(C=C2CNCC3C(NC(=S)N=C23)c2ccc(Cl)cc2)cc1 InChI=1S/C20H17Cl2N3S/c21-15-5-1-12(2-6-15)9-14-10-23-11-17-18(24-20(26)25-19(14)17)13-3-7-16(22)8-4-13/h1-9,17-18,23H,10-11H2,(H,24,26) WTDZWVHMLBZQEY-UHFFFAOYSA-N 50434509 CHEMBL2385782 Cholinesterase 6260 ChEMBL 10.1016/j.bmc.2013.03.058 10.7270/Q2V40WK4 23602518 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50434509 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50434509&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91899894 175446826 CHEMBL2385782 ZINC96270567 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51064530 Cc1ccc(C=C2CNCC3C(NC(=S)N=C23)c2ccc(C)cc2)cc1 InChI=1S/C22H23N3S/c1-14-3-7-16(8-4-14)11-18-12-23-13-19-20(24-22(26)25-21(18)19)17-9-5-15(2)6-10-17/h3-11,19-20,23H,12-13H2,1-2H3,(H,24,26) PBAUMKNLCRWIBL-UHFFFAOYSA-N 50434510 CHEMBL2385781 Cholinesterase 6270 ChEMBL 10.1016/j.bmc.2013.03.058 10.7270/Q2V40WK4 23602518 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50434510 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50434510&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91899895 175446827 CHEMBL2385781 ZINC96270569 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51064531 Brc1ccc(C=C2CNCC3C(NC(=S)N=C23)c2ccc(Br)cc2)cc1 InChI=1S/C20H17Br2N3S/c21-15-5-1-12(2-6-15)9-14-10-23-11-17-18(24-20(26)25-19(14)17)13-3-7-16(22)8-4-13/h1-9,17-18,23H,10-11H2,(H,24,26) LUIJCZNEVPXBMB-UHFFFAOYSA-N 50434511 CHEMBL2385780 Cholinesterase 1650 ChEMBL 10.1016/j.bmc.2013.03.058 10.7270/Q2V40WK4 23602518 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50434511 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50434511&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91899896 175446828 CHEMBL2385780 ZINC96270571 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51064532 [O-][N+](=O)c1cccc(C=C2CNCC3C(NC(=S)N=C23)c2cccc(c2)[N+]([O-])=O)c1 InChI=1S/C20H17N5O4S/c26-24(27)15-5-1-3-12(8-15)7-14-10-21-11-17-18(22-20(30)23-19(14)17)13-4-2-6-16(9-13)25(28)29/h1-9,17-18,21H,10-11H2,(H,22,30) XUWVLBDHXAMFMC-UHFFFAOYSA-N 50434512 CHEMBL2385779 Cholinesterase 8090 ChEMBL 10.1016/j.bmc.2013.03.058 10.7270/Q2V40WK4 23602518 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50434512 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50434512&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91899897 175446829 CHEMBL2385779 ZINC96270573 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51064533 COc1ccccc1C=C1CNCC2C(NC(=S)N=C12)c1ccccc1OC InChI=1S/C22H23N3O2S/c1-26-18-9-5-3-7-14(18)11-15-12-23-13-17-20(15)24-22(28)25-21(17)16-8-4-6-10-19(16)27-2/h3-11,17,21,23H,12-13H2,1-2H3,(H,25,28) YMGDXRMOOMCDAL-UHFFFAOYSA-N 50434513 CHEMBL2385778 Cholinesterase 1180 ChEMBL 10.1016/j.bmc.2013.03.058 10.7270/Q2V40WK4 23602518 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50434513 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50434513&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91899898 175446830 CHEMBL2385778 ZINC96270575 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51064534 Fc1ccccc1C=C1CNCC2C(NC(=S)N=C12)c1ccccc1F InChI=1S/C20H17F2N3S/c21-16-7-3-1-5-12(16)9-13-10-23-11-15-18(13)24-20(26)25-19(15)14-6-2-4-8-17(14)22/h1-9,15,19,23H,10-11H2,(H,25,26) LYVDCPLEHZTRDA-UHFFFAOYSA-N 50434514 CHEMBL2385777 Cholinesterase 6500 ChEMBL 10.1016/j.bmc.2013.03.058 10.7270/Q2V40WK4 23602518 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50434514 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50434514&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91899899 175446831 CHEMBL2385777 ZINC96270577 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51064535 Clc1ccccc1C=C1CNCC2C(NC(=S)N=C12)c1ccccc1Cl InChI=1S/C20H17Cl2N3S/c21-16-7-3-1-5-12(16)9-13-10-23-11-15-18(13)24-20(26)25-19(15)14-6-2-4-8-17(14)22/h1-9,15,19,23H,10-11H2,(H,25,26) SNBMRPUEGLCZEG-UHFFFAOYSA-N 50434515 CHEMBL2385776 Cholinesterase 2910 ChEMBL 10.1016/j.bmc.2013.03.058 10.7270/Q2V40WK4 23602518 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50434515 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50434515&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91899900 175446832 CHEMBL2385776 ZINC96270579 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51064536 Cc1ccccc1C=C1CNCC2C(NC(=S)N=C12)c1ccccc1C InChI=1S/C22H23N3S/c1-14-7-3-5-9-16(14)11-17-12-23-13-19-20(17)24-22(26)25-21(19)18-10-6-4-8-15(18)2/h3-11,19,21,23H,12-13H2,1-2H3,(H,25,26) GTZSGHNRRUJVMX-UHFFFAOYSA-N 50434516 CHEMBL2385775 Cholinesterase 3070 ChEMBL 10.1016/j.bmc.2013.03.058 10.7270/Q2V40WK4 23602518 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50434516 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50434516&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91899901 175446833 CHEMBL2385775 ZINC96270581 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51064537 S=C1NC(C2CNCC(=Cc3ccccc3)C2=N1)c1ccccc1 InChI=1S/C20H19N3S/c24-20-22-18(15-9-5-2-6-10-15)17-13-21-12-16(19(17)23-20)11-14-7-3-1-4-8-14/h1-11,17-18,21H,12-13H2,(H,22,24) FUZRSTXCJSEUCS-UHFFFAOYSA-N 50434517 CHEMBL2385774 Cholinesterase 3780 ChEMBL 10.1016/j.bmc.2013.03.058 10.7270/Q2V40WK4 23602518 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50434517 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50434517&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91899902 175446834 CHEMBL2385774 ZINC96270583 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51064538 O=C1NC(C2CNCC(=Cc3cccc4ccccc34)C2=N1)c1cccc2ccccc12 InChI=1S/C28H23N3O/c32-28-30-26-21(15-20-11-5-9-18-7-1-3-12-22(18)20)16-29-17-25(26)27(31-28)24-14-6-10-19-8-2-4-13-23(19)24/h1-15,25,27,29H,16-17H2,(H,31,32) PDBATHWNPGJGIP-UHFFFAOYSA-N 50434518 CHEMBL2385773 Cholinesterase 5390 ChEMBL 10.1016/j.bmc.2013.03.058 10.7270/Q2V40WK4 23602518 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50434518 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50434518&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91899903 175446835 CHEMBL2385773 ZINC96270585 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51064539 Clc1ccc(C=C2CNCC3C(NC(=O)N=C23)c2ccc(Cl)cc2Cl)c(Cl)c1 InChI=1S/C20H15Cl4N3O/c21-12-2-1-10(16(23)6-12)5-11-8-25-9-15-18(11)26-20(28)27-19(15)14-4-3-13(22)7-17(14)24/h1-7,15,19,25H,8-9H2,(H,27,28) ZKAGFOGUOXIEEX-UHFFFAOYSA-N 50434519 CHEMBL2385772 Cholinesterase 23510 ChEMBL 10.1016/j.bmc.2013.03.058 10.7270/Q2V40WK4 23602518 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50434519 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50434519&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91899904 175446836 CHEMBL2385772 ZINC96270587 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51064540 Fc1ccc(C=C2CNCC3C(NC(=O)N=C23)c2ccc(F)cc2)cc1 InChI=1S/C20H17F2N3O/c21-15-5-1-12(2-6-15)9-14-10-23-11-17-18(24-20(26)25-19(14)17)13-3-7-16(22)8-4-13/h1-9,17-18,23H,10-11H2,(H,24,26) HJBLYLSJADESHN-UHFFFAOYSA-N 50434520 CHEMBL2385771 Cholinesterase 18900 ChEMBL 10.1016/j.bmc.2013.03.058 10.7270/Q2V40WK4 23602518 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50434520 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50434520&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91899905 175446837 CHEMBL2385771 ZINC96270589 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51064541 Clc1ccc(C=C2CNCC3C(NC(=O)N=C23)c2ccc(Cl)cc2)cc1 InChI=1S/C20H17Cl2N3O/c21-15-5-1-12(2-6-15)9-14-10-23-11-17-18(24-20(26)25-19(14)17)13-3-7-16(22)8-4-13/h1-9,17-18,23H,10-11H2,(H,24,26) KYRHFJFGKUVOHZ-UHFFFAOYSA-N 50434521 CHEMBL2385770 Cholinesterase 16730 ChEMBL 10.1016/j.bmc.2013.03.058 10.7270/Q2V40WK4 23602518 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50434521 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50434521&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91899906 175446838 CHEMBL2385770 ZINC96270591 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51064542 Cc1ccc(C=C2CNCC3C(NC(=O)N=C23)c2ccc(C)cc2)cc1 InChI=1S/C22H23N3O/c1-14-3-7-16(8-4-14)11-18-12-23-13-19-20(24-22(26)25-21(18)19)17-9-5-15(2)6-10-17/h3-11,19-20,23H,12-13H2,1-2H3,(H,24,26) LMFKZPIECIZZIM-UHFFFAOYSA-N 50434522 CHEMBL2385769 Cholinesterase 7090 ChEMBL 10.1016/j.bmc.2013.03.058 10.7270/Q2V40WK4 23602518 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50434522 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50434522&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91899907 175446839 CHEMBL2385769 ZINC96270593 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51064543 Brc1ccc(C=C2CNCC3C(NC(=O)N=C23)c2ccc(Br)cc2)cc1 InChI=1S/C20H17Br2N3O/c21-15-5-1-12(2-6-15)9-14-10-23-11-17-18(24-20(26)25-19(14)17)13-3-7-16(22)8-4-13/h1-9,17-18,23H,10-11H2,(H,24,26) IYKOKWZYMIIDDC-UHFFFAOYSA-N 50434523 CHEMBL2385768 Cholinesterase 6220 ChEMBL 10.1016/j.bmc.2013.03.058 10.7270/Q2V40WK4 23602518 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50434523 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50434523&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91899908 175446840 CHEMBL2385768 ZINC96270595 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51064544 [O-][N+](=O)c1cccc(C=C2CNCC3C(NC(=O)N=C23)c2cccc(c2)[N+]([O-])=O)c1 InChI=1S/C20H17N5O5/c26-20-22-18(13-4-2-6-16(9-13)25(29)30)17-11-21-10-14(19(17)23-20)7-12-3-1-5-15(8-12)24(27)28/h1-9,17-18,21H,10-11H2,(H,22,26) ZKLUDMIJZMEMSE-UHFFFAOYSA-N 50434524 CHEMBL2385767 Cholinesterase 10340 ChEMBL 10.1016/j.bmc.2013.03.058 10.7270/Q2V40WK4 23602518 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50434524 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50434524&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91899909 175446841 CHEMBL2385767 ZINC96270597 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51064545 COc1ccccc1C=C1CNCC2C(NC(=O)N=C12)c1ccccc1OC InChI=1S/C22H23N3O3/c1-27-18-9-5-3-7-14(18)11-15-12-23-13-17-20(15)24-22(26)25-21(17)16-8-4-6-10-19(16)28-2/h3-11,17,21,23H,12-13H2,1-2H3,(H,25,26) KVPXGHJEZWPAPE-UHFFFAOYSA-N 50434525 CHEMBL2385766 Cholinesterase 10700 ChEMBL 10.1016/j.bmc.2013.03.058 10.7270/Q2V40WK4 23602518 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50434525 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50434525&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91899910 175446842 CHEMBL2385766 ZINC96270599 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51064546 Fc1ccccc1C=C1CNCC2C(NC(=O)N=C12)c1ccccc1F InChI=1S/C20H17F2N3O/c21-16-7-3-1-5-12(16)9-13-10-23-11-15-18(13)24-20(26)25-19(15)14-6-2-4-8-17(14)22/h1-9,15,19,23H,10-11H2,(H,25,26) BFTGTSCUZOSWSA-UHFFFAOYSA-N 50434526 CHEMBL2385765 Cholinesterase 3310 ChEMBL 10.1016/j.bmc.2013.03.058 10.7270/Q2V40WK4 23602518 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50434526 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50434526&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91899911 175446843 CHEMBL2385765 ZINC96270601 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51064547 Clc1ccccc1C=C1CNCC2C(NC(=O)N=C12)c1ccccc1Cl InChI=1S/C20H17Cl2N3O/c21-16-7-3-1-5-12(16)9-13-10-23-11-15-18(13)24-20(26)25-19(15)14-6-2-4-8-17(14)22/h1-9,15,19,23H,10-11H2,(H,25,26) XUSKHAZDWKPONX-UHFFFAOYSA-N 50434527 CHEMBL2385764 Cholinesterase 2510 ChEMBL 10.1016/j.bmc.2013.03.058 10.7270/Q2V40WK4 23602518 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50434527 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50434527&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91899912 175446844 CHEMBL2385764 ZINC96270603 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51064548 Cc1ccccc1C=C1CNCC2C(NC(=O)N=C12)c1ccccc1C InChI=1S/C22H23N3O/c1-14-7-3-5-9-16(14)11-17-12-23-13-19-20(17)24-22(26)25-21(19)18-10-6-4-8-15(18)2/h3-11,19,21,23H,12-13H2,1-2H3,(H,25,26) YKPZXTZEYIUSDB-UHFFFAOYSA-N 50434528 CHEMBL2385763 Cholinesterase 5220 ChEMBL 10.1016/j.bmc.2013.03.058 10.7270/Q2V40WK4 23602518 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50434528 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50434528&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91899913 175446845 CHEMBL2385763 ZINC96270605 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51064549 O=C1NC(C2CNCC(=Cc3ccccc3)C2=N1)c1ccccc1 InChI=1S/C20H19N3O/c24-20-22-18(15-9-5-2-6-10-15)17-13-21-12-16(19(17)23-20)11-14-7-3-1-4-8-14/h1-11,17-18,21H,12-13H2,(H,22,24) KEYNSINUMXAPCC-UHFFFAOYSA-N 50434529 CHEMBL2385762 Cholinesterase 2860 ChEMBL 10.1016/j.bmc.2013.03.058 10.7270/Q2V40WK4 23602518 Basiri, A; Murugaiyah, V; Osman, H; Kumar, RS; Kia, Y; Ali, MA Universiti Sains Malaysia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50434529 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50434529&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91899914 175446846 CHEMBL2385762 ZINC96270607 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067683 O=C(CN1CCN(CCOc2ccc3c(cc(=O)oc3c2)-c2ccccc2)CC1)Nc1c2CCCCc2nc2ccccc12 InChI=1S/C36H36N4O4/c41-34(38-36-28-10-4-6-12-31(28)37-32-13-7-5-11-29(32)36)24-40-18-16-39(17-19-40)20-21-43-26-14-15-27-30(25-8-2-1-3-9-25)23-35(42)44-33(27)22-26/h1-4,6,8-10,12,14-15,22-23H,5,7,11,13,16-21,24H2,(H,37,38,41) WFJSAZFTQDCBDU-UHFFFAOYSA-N 50435950 CHEMBL2391478 Cholinesterase 1510 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435950 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435950&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71698367 175448267 CHEMBL2391478 ZINC96271832 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067684 O=C(CN1CCN(CCCCCOc2ccc3c(cc(=O)oc3c2)-c2ccccc2)CC1)Nc1c2CCCCc2nc2ccccc12 InChI=1S/C39H42N4O4/c44-37(41-39-31-13-5-7-15-34(31)40-35-16-8-6-14-32(35)39)27-43-22-20-42(21-23-43)19-9-2-10-24-46-29-17-18-30-33(28-11-3-1-4-12-28)26-38(45)47-36(30)25-29/h1,3-5,7,11-13,15,17-18,25-26H,2,6,8-10,14,16,19-24,27H2,(H,40,41,44) CTGCJJGSKOQITO-UHFFFAOYSA-N 50435949 CHEMBL2391481 Cholinesterase 1270 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435949 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435949&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71698370 175448266 CHEMBL2391481 ZINC96271831 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067688 COc1cc(=O)oc2cc(OCCCCCN3CCN(CC(=O)Nc4c5CCCCc5nc5ccccc45)CC3)ccc12 InChI=1S/C34H40N4O5/c1-41-30-22-33(40)43-31-21-24(13-14-27(30)31)42-20-8-2-7-15-37-16-18-38(19-17-37)23-32(39)36-34-25-9-3-5-11-28(25)35-29-12-6-4-10-26(29)34/h3,5,9,11,13-14,21-22H,2,4,6-8,10,12,15-20,23H2,1H3,(H,35,36,39) IUOBAYQUFIRIFW-UHFFFAOYSA-N 50435951 CHEMBL2391476 Cholinesterase 730 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435951 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435951&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71699633 175448268 CHEMBL2391476 ZINC96271833 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067690 Cc1cc(=O)oc2cc(OCCCN3CCN(CC(=O)Nc4c5CCCCc5nc5ccccc45)CC3)ccc12 InChI=1S/C32H36N4O4/c1-22-19-31(38)40-29-20-23(11-12-24(22)29)39-18-6-13-35-14-16-36(17-15-35)21-30(37)34-32-25-7-2-4-9-27(25)33-28-10-5-3-8-26(28)32/h2,4,7,9,11-12,19-20H,3,5-6,8,10,13-18,21H2,1H3,(H,33,34,37) ZICKHCKGQJNYPU-UHFFFAOYSA-N 50435953 CHEMBL2391487 Cholinesterase 628 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435953 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435953&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71699559 175448270 CHEMBL2391487 ZINC96271835 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067691 O=C(CN1CCN(CCOc2ccc3ccc(=O)oc3c2)CC1)Nc1c2CCCCc2nc2ccccc12 InChI=1S/C30H32N4O4/c35-28(32-30-23-5-1-3-7-25(23)31-26-8-4-2-6-24(26)30)20-34-15-13-33(14-16-34)17-18-37-22-11-9-21-10-12-29(36)38-27(21)19-22/h1,3,5,7,9-12,19H,2,4,6,8,13-18,20H2,(H,31,32,35) IFYBWVINZZLKPU-UHFFFAOYSA-N 50435954 CHEMBL2391653 Cholinesterase 493 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435954 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435954&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71699403 175448271 CHEMBL2391653 ZINC96271836 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067692 O=C(CN1CCN(CCCOc2ccc3ccc(=O)oc3c2)CC1)Nc1c2CCCCc2nc2ccccc12 InChI=1S/C31H34N4O4/c36-29(33-31-24-6-1-3-8-26(24)32-27-9-4-2-7-25(27)31)21-35-17-15-34(16-18-35)14-5-19-38-23-12-10-22-11-13-30(37)39-28(22)20-23/h1,3,6,8,10-13,20H,2,4-5,7,9,14-19,21H2,(H,32,33,36) BQPITAWTQRMCJX-UHFFFAOYSA-N 50435955 CHEMBL2391654 Cholinesterase 440 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435955 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435955&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71699478 175448272 CHEMBL2391654 ZINC96271837 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067698 O=C(CN1CCN(CCCCOc2ccc3ccc(=O)oc3c2)CC1)Nc1c2CCCCc2nc2ccccc12 InChI=1S/C32H36N4O4/c37-30(34-32-25-7-1-3-9-27(25)33-28-10-4-2-8-26(28)32)22-36-18-16-35(17-19-36)15-5-6-20-39-24-13-11-23-12-14-31(38)40-29(23)21-24/h1,3,7,9,11-14,21H,2,4-6,8,10,15-20,22H2,(H,33,34,37) HRESYZKNQSWLGX-UHFFFAOYSA-N 50435959 CHEMBL2391483 Cholinesterase 309 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435959 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435959&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71699479 175448276 CHEMBL2391483 ZINC96271841 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067701 Cc1cc(=O)oc2cc(OCCN3CCN(CC(=O)Nc4c5CCCCc5nc5ccccc45)CC3)ccc12 InChI=1S/C31H34N4O4/c1-21-18-30(37)39-28-19-22(10-11-23(21)28)38-17-16-34-12-14-35(15-13-34)20-29(36)33-31-24-6-2-4-8-26(24)32-27-9-5-3-7-25(27)31/h2,4,6,8,10-11,18-19H,3,5,7,9,12-17,20H2,1H3,(H,32,33,36) RFIJTJVQDQTLEV-UHFFFAOYSA-N 50435960 CHEMBL2391486 Cholinesterase 234 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71699482 175448277 CHEMBL2391486 ZINC96271842 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067702 O=C(CN1CCN(CCCCCOc2ccc3ccc(=O)oc3c2)CC1)Nc1c2CCCCc2nc2ccccc12 InChI=1S/C33H38N4O4/c38-31(35-33-26-8-2-4-10-28(26)34-29-11-5-3-9-27(29)33)23-37-19-17-36(18-20-37)16-6-1-7-21-40-25-14-12-24-13-15-32(39)41-30(24)22-25/h2,4,8,10,12-15,22H,1,3,5-7,9,11,16-21,23H2,(H,34,35,38) GRAHOHOHWNFDDR-UHFFFAOYSA-N 50435958 CHEMBL2391484 Cholinesterase 215 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435958 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435958&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71699480 175448275 CHEMBL2391484 ZINC96271840 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067703 O=C(CN1CCN(CCCCCCOc2ccc3ccc(=O)oc3c2)CC1)Nc1c2CCCCc2nc2ccccc12 InChI=1S/C34H40N4O4/c39-32(36-34-27-9-3-5-11-29(27)35-30-12-6-4-10-28(30)34)24-38-20-18-37(19-21-38)17-7-1-2-8-22-41-26-15-13-25-14-16-33(40)42-31(25)23-26/h3,5,9,11,13-16,23H,1-2,4,6-8,10,12,17-22,24H2,(H,35,36,39) XAPQIBLRQAOZQR-UHFFFAOYSA-N 50435952 CHEMBL2391485 Cholinesterase 210 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435952 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435952&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71699481 175448269 CHEMBL2391485 ZINC96271834 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067707 Cc1cc(=O)oc2cc(OCCCCCN3CCN(CC(=O)Nc4c5CCCCc5nc5ccccc45)CC3)ccc12 InChI=1S/C34H40N4O4/c1-24-21-33(40)42-31-22-25(13-14-26(24)31)41-20-8-2-7-15-37-16-18-38(19-17-37)23-32(39)36-34-27-9-3-5-11-29(27)35-30-12-6-4-10-28(30)34/h3,5,9,11,13-14,21-22H,2,4,6-8,10,12,15-20,23H2,1H3,(H,35,36,39) BGOVDTOQIRZTJP-UHFFFAOYSA-N 50435957 CHEMBL2391489 Cholinesterase 164 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435957 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435957&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71699561 175448274 CHEMBL2391489 ZINC96271839 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067710 Cc1cc(=O)oc2cc(OCCCCN3CCN(CC(=O)Nc4c5CCCCc5nc5ccccc45)CC3)ccc12 InChI=1S/C33H38N4O4/c1-23-20-32(39)41-30-21-24(12-13-25(23)30)40-19-7-6-14-36-15-17-37(18-16-36)22-31(38)35-33-26-8-2-4-10-28(26)34-29-11-5-3-9-27(29)33/h2,4,8,10,12-13,20-21H,3,5-7,9,11,14-19,22H2,1H3,(H,34,35,38) JIZMVVINYFLRDM-UHFFFAOYSA-N 50435961 CHEMBL2391488 Cholinesterase 147 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71699560 175448278 CHEMBL2391488 ZINC96271843 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067713 Cc1cc(=O)oc2cc(OCCCCCCN3CCN(CC(=O)Nc4c5CCCCc5nc5ccccc45)CC3)ccc12 InChI=1S/C35H42N4O4/c1-25-22-34(41)43-32-23-26(14-15-27(25)32)42-21-9-3-2-8-16-38-17-19-39(20-18-38)24-33(40)37-35-28-10-4-6-12-30(28)36-31-13-7-5-11-29(31)35/h4,6,10,12,14-15,22-23H,2-3,5,7-9,11,13,16-21,24H2,1H3,(H,36,37,40) VRTZOHZVMJKYNS-UHFFFAOYSA-N 50435956 CHEMBL2391490 Cholinesterase 99 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50435956 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50435956&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71699562 175448273 CHEMBL2391490 ZINC96271838 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51067716 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 42 ChEMBL 10.1016/j.ejmech.2013.03.051 10.7270/Q2H996KW 23685572 Xie, SS; Wang, XB; Li, JY; Yang, L; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061412 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 33 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061413 O=C(CCCc1ccccc1)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1 InChI=1S/C28H22N4O2/c33-25(12-6-9-18-7-2-1-3-8-18)29-19-13-14-24-22(17-19)28(34)32-16-15-21-20-10-4-5-11-23(20)30-26(21)27(32)31-24/h1-5,7-8,10-11,13-17,30H,6,9,12H2,(H,29,33) GAJPPJXZSOIUSJ-UHFFFAOYSA-N 50433002 CHEMBL2375939 Cholinesterase 24600 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433002 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433002&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72197653 175445319 CHEMBL2375939 ZINC96258302 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061414 O=C(CCCN1CCCC1)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1 InChI=1S/C26H25N5O2/c32-23(8-5-14-30-12-3-4-13-30)27-17-9-10-22-20(16-17)26(33)31-15-11-19-18-6-1-2-7-21(18)28-24(19)25(31)29-22/h1-2,6-7,9-11,15-16,28H,3-5,8,12-14H2,(H,27,32) ALKHOFYVGYELHW-UHFFFAOYSA-N 50433003 CHEMBL2375938 Cholinesterase 18500 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433003 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433003&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72197652 175445320 CHEMBL2375938 ZINC96258304 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061415 Cn1cc[n+](CCCC(=O)Nc2ccc3nc4c5[nH]c6ccccc6c5ccn4c(=O)c3c2)c1 InChI=1S/C26H22N6O2/c1-30-13-14-31(16-30)11-4-7-23(33)27-17-8-9-22-20(15-17)26(34)32-12-10-19-18-5-2-3-6-21(18)28-24(19)25(32)29-22/h2-3,5-6,8-10,12-16H,4,7,11H2,1H3,(H-,27,28,29,33,34)/p+1 RWHVSLOYZKLKTK-UHFFFAOYSA-O 50433004 CHEMBL2375937 Cholinesterase 8200 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433004 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433004&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72197651 175445321 CHEMBL2375937 ZINC96258305 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061416 O=C(CCC[n+]1ccccc1)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1 InChI=1S/C27H21N5O2/c33-24(9-6-15-31-13-4-1-5-14-31)28-18-10-11-23-21(17-18)27(34)32-16-12-20-19-7-2-3-8-22(19)29-25(20)26(32)30-23/h1-5,7-8,10-14,16-17H,6,9,15H2,(H-,28,29,30,33,34)/p+1 IZZCMVUZYQICIU-UHFFFAOYSA-O 50433005 CHEMBL2375936 Cholinesterase 4160 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433005 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433005&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72197649 175445322 CHEMBL2375936 ZINC96258307 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061417 C[N+]1(CCC(=O)Nc2ccc3nc4c5[nH]c6ccccc6c5ccn4c(=O)c3c2)CCCC1 InChI=1S/C26H25N5O2/c1-31(13-4-5-14-31)15-11-23(32)27-17-8-9-22-20(16-17)26(33)30-12-10-19-18-6-2-3-7-21(18)28-24(19)25(30)29-22/h2-3,6-10,12,16H,4-5,11,13-15H2,1H3,(H-,27,28,29,32,33)/p+1 BDUDWPYTOJWNKS-UHFFFAOYSA-O 50433006 CHEMBL2375935 Cholinesterase 17100 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433006 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433006&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72197647 175445323 CHEMBL2375935 ZINC96258309 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061418 C[N+](C)(C)CCC(=O)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1 InChI=1S/C24H23N5O2/c1-29(2,3)13-11-21(30)25-15-8-9-20-18(14-15)24(31)28-12-10-17-16-6-4-5-7-19(16)26-22(17)23(28)27-20/h4-10,12,14H,11,13H2,1-3H3,(H-,25,26,27,30,31)/p+1 CNYYVKHGPZFTEI-UHFFFAOYSA-O 50433007 CHEMBL2375934 Cholinesterase 37200 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433007 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433007&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72197465 175445324 CHEMBL2375934 ZINC96258311 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061419 O=C(CCc1ccccc1)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1 InChI=1S/C27H20N4O2/c32-24(13-10-17-6-2-1-3-7-17)28-18-11-12-23-21(16-18)27(33)31-15-14-20-19-8-4-5-9-22(19)29-25(20)26(31)30-23/h1-9,11-12,14-16,29H,10,13H2,(H,28,32) NSGFXAJMYZBCCL-UHFFFAOYSA-N 50433008 CHEMBL2375933 Cholinesterase 26100 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433008 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433008&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72197463 175445325 CHEMBL2375933 ZINC96258312 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061420 O=C(CCNc1ccccc1)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1 InChI=1S/C27H21N5O2/c33-24(12-14-28-17-6-2-1-3-7-17)29-18-10-11-23-21(16-18)27(34)32-15-13-20-19-8-4-5-9-22(19)30-25(20)26(32)31-23/h1-11,13,15-16,28,30H,12,14H2,(H,29,33) QYKFEGRKLOWGEL-UHFFFAOYSA-N 50433009 CHEMBL2375932 Cholinesterase 27800 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433009 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433009&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72197462 175445326 CHEMBL2375932 ZINC96258313 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061421 O=C(CCOc1cccnc1)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1 InChI=1S/C26H19N5O3/c32-23(10-13-34-17-4-3-11-27-15-17)28-16-7-8-22-20(14-16)26(33)31-12-9-19-18-5-1-2-6-21(18)29-24(19)25(31)30-22/h1-9,11-12,14-15,29H,10,13H2,(H,28,32) BFWQUXMAEQESNE-UHFFFAOYSA-N 50433010 CHEMBL2375931 Cholinesterase 6430 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433010 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433010&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72197461 175445327 CHEMBL2375931 ZINC96258314 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061422 CN1CCN(CCC(=O)Nc2ccc3nc4c5[nH]c6ccccc6c5ccn4c(=O)c3c2)CC1 InChI=1S/C26H26N6O2/c1-30-12-14-31(15-13-30)10-9-23(33)27-17-6-7-22-20(16-17)26(34)32-11-8-19-18-4-2-3-5-21(18)28-24(19)25(32)29-22/h2-8,11,16,28H,9-10,12-15H2,1H3,(H,27,33) KMGINLONUJGCOO-UHFFFAOYSA-N 50433011 CHEMBL2375930 Cholinesterase 28900 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433011 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433011&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72197460 175445328 CHEMBL2375930 ZINC96258315 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061423 O=C(CCN1CCOCC1)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1 InChI=1S/C25H23N5O3/c31-22(8-9-29-11-13-33-14-12-29)26-16-5-6-21-19(15-16)25(32)30-10-7-18-17-3-1-2-4-20(17)27-23(18)24(30)28-21/h1-7,10,15,27H,8-9,11-14H2,(H,26,31) HAYSFYXYOUEPDQ-UHFFFAOYSA-N 50433012 CHEMBL2375929 Cholinesterase 27600 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433012 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433012&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72197289 175445329 CHEMBL2375929 ZINC96258317 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061424 O=C(CCN1CCCCC1)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1 InChI=1S/C26H25N5O2/c32-23(11-14-30-12-4-1-5-13-30)27-17-8-9-22-20(16-17)26(33)31-15-10-19-18-6-2-3-7-21(18)28-24(19)25(31)29-22/h2-3,6-10,15-16,28H,1,4-5,11-14H2,(H,27,32) VMPADCIHBAIVJF-UHFFFAOYSA-N 50433013 CHEMBL2375928 Cholinesterase 24000 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433013 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433013&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72197288 175445330 CHEMBL2375928 ZINC96258319 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061425 O=C(CCN1CCCC1)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1 InChI=1S/C25H23N5O2/c31-22(10-13-29-11-3-4-12-29)26-16-7-8-21-19(15-16)25(32)30-14-9-18-17-5-1-2-6-20(17)27-23(18)24(30)28-21/h1-2,5-9,14-15,27H,3-4,10-13H2,(H,26,31) YYWCCCDEKZFMBZ-UHFFFAOYSA-N 50433014 CHEMBL2375927 Cholinesterase 14900 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433014 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433014&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72197287 175445331 CHEMBL2375927 ZINC96258320 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061426 CCN(CC)CCC(=O)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1 InChI=1S/C25H25N5O2/c1-3-29(4-2)13-12-22(31)26-16-9-10-21-19(15-16)25(32)30-14-11-18-17-7-5-6-8-20(17)27-23(18)24(30)28-21/h5-11,14-15,27H,3-4,12-13H2,1-2H3,(H,26,31) LTWZXZXZDDZMED-UHFFFAOYSA-N 50433015 CHEMBL2375926 Cholinesterase 28300 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433015 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433015&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72197286 175445332 CHEMBL2375926 ZINC96258322 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061427 CN(C)CCC(=O)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1 InChI=1S/C23H21N5O2/c1-27(2)11-10-20(29)24-14-7-8-19-17(13-14)23(30)28-12-9-16-15-5-3-4-6-18(15)25-21(16)22(28)26-19/h3-9,12-13,25H,10-11H2,1-2H3,(H,24,29) GVYIYCHGDWJDLF-UHFFFAOYSA-N 50433016 CHEMBL2375925 Cholinesterase 21400 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433016 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433016&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72197285 175445333 CHEMBL2375925 ZINC96258324 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061428 Cn1cc[n+](CCC(=O)Nc2ccc3nc4c5[nH]c6ccccc6c5ccn4c(=O)c3c2)c1 InChI=1S/C25H20N6O2/c1-29-12-13-30(15-29)10-9-22(32)26-16-6-7-21-19(14-16)25(33)31-11-8-18-17-4-2-3-5-20(17)27-23(18)24(31)28-21/h2-8,11-15H,9-10H2,1H3,(H-,26,27,28,32,33)/p+1 AXRVSGWAVJFIAY-UHFFFAOYSA-O 50433017 CHEMBL2375924 Cholinesterase 7019 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433017 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433017&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72197284 175445334 CHEMBL2375924 ZINC96258326 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061429 Fc1ccc[n+](CCC(=O)Nc2ccc3nc4c5[nH]c6ccccc6c5ccn4c(=O)c3c2)c1 InChI=1S/C26H18FN5O2/c27-16-4-3-11-31(15-16)12-10-23(33)28-17-7-8-22-20(14-17)26(34)32-13-9-19-18-5-1-2-6-21(18)29-24(19)25(32)30-22/h1-9,11,13-15H,10,12H2,(H-,28,29,30,33,34)/p+1 CCUIOGOXSLVRRV-UHFFFAOYSA-O 50433018 CHEMBL2375923 Cholinesterase 3488 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433018 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433018&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72197112 175445335 CHEMBL2375923 ZINC96258327 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061430 O=C(CC[n+]1ccccc1)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1 InChI=1S/C26H19N5O2/c32-23(11-14-30-12-4-1-5-13-30)27-17-8-9-22-20(16-17)26(33)31-15-10-19-18-6-2-3-7-21(18)28-24(19)25(31)29-22/h1-10,12-13,15-16H,11,14H2,(H-,27,28,29,32,33)/p+1 ABHCTTFWVASZNF-UHFFFAOYSA-O 50433019 CHEMBL2375922 Cholinesterase 4291 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433019 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433019&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72197110 175445336 CHEMBL2375922 ZINC96258328 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061431 O=C(Cc1ccccc1)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1 InChI=1S/C26H18N4O2/c31-23(14-16-6-2-1-3-7-16)27-17-10-11-22-20(15-17)26(32)30-13-12-19-18-8-4-5-9-21(18)28-24(19)25(30)29-22/h1-13,15,28H,14H2,(H,27,31) GWSPFDOKJUYTOJ-UHFFFAOYSA-N 50433020 CHEMBL2375921 Cholinesterase 24900 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433020 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433020&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72197108 175445337 CHEMBL2375921 ZINC96258330 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061432 O=C(CNc1ccccc1)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1 InChI=1S/C26H19N5O2/c32-23(15-27-16-6-2-1-3-7-16)28-17-10-11-22-20(14-17)26(33)31-13-12-19-18-8-4-5-9-21(18)29-24(19)25(31)30-22/h1-14,27,29H,15H2,(H,28,32) SCCSPGNMUMILKS-UHFFFAOYSA-N 50433021 CHEMBL2375920 Cholinesterase 25300 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433021 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433021&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72197107 175445338 CHEMBL2375920 ZINC96258331 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061433 O=C(COc1cccnc1)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1 InChI=1S/C25H17N5O3/c31-22(14-33-16-4-3-10-26-13-16)27-15-7-8-21-19(12-15)25(32)30-11-9-18-17-5-1-2-6-20(17)28-23(18)24(30)29-21/h1-13,28H,14H2,(H,27,31) SNYMHCSGZZKMAB-UHFFFAOYSA-N 50433022 CHEMBL2375919 Cholinesterase 7300 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433022 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433022&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72197106 175445339 CHEMBL2375919 ZINC96258332 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061434 CN1CCN(CC(=O)Nc2ccc3nc4c5[nH]c6ccccc6c5ccn4c(=O)c3c2)CC1 InChI=1S/C25H24N6O2/c1-29-10-12-30(13-11-29)15-22(32)26-16-6-7-21-19(14-16)25(33)31-9-8-18-17-4-2-3-5-20(17)27-23(18)24(31)28-21/h2-9,14,27H,10-13,15H2,1H3,(H,26,32) HJDPCBUZHOJABL-UHFFFAOYSA-N 50433023 CHEMBL2375945 Cholinesterase 29100 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433023 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433023&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72196925 175445340 CHEMBL2375945 ZINC96258334 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061435 O=C(CN1CCOCC1)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1 InChI=1S/C24H21N5O3/c30-21(14-28-9-11-32-12-10-28)25-15-5-6-20-18(13-15)24(31)29-8-7-17-16-3-1-2-4-19(16)26-22(17)23(29)27-20/h1-8,13,26H,9-12,14H2,(H,25,30) TWCJQHKRTSUKPE-UHFFFAOYSA-N 50433024 CHEMBL2375944 Cholinesterase 28500 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433024 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433024&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72196924 175445341 CHEMBL2375944 ZINC96258335 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51063493 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 11 ChEMBL 10.1016/j.bmcl.2013.04.008 10.7270/Q2NP25SJ 23639542 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51063494 CC(C(=O)NCCCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccc(OCCCCCCO[N+]([O-])=O)cc1 InChI=1S/C38H45FN4O5/c1-27(38(44)41-23-9-8-22-40-37-32-12-4-6-14-35(32)42-36-15-7-5-13-33(36)37)29-18-21-31(34(39)26-29)28-16-19-30(20-17-28)47-24-10-2-3-11-25-48-43(45)46/h4,6,12,14,16-21,26-27H,2-3,5,7-11,13,15,22-25H2,1H3,(H,40,42)(H,41,44) VPSJQWYDLMDCOQ-UHFFFAOYSA-N 50433917 CHEMBL2380611 Cholinesterase 3.9 ChEMBL 10.1016/j.bmcl.2013.04.008 10.7270/Q2NP25SJ 23639542 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433917 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433917&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71625789 175446234 CHEMBL2380611 ZINC96270053 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51063495 CC(C(=O)NCCCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccc(OCCCCO[N+]([O-])=O)cc1 InChI=1S/C36H41FN4O5/c1-25(27-16-19-29(32(37)24-27)26-14-17-28(18-15-26)45-22-8-9-23-46-41(43)44)36(42)39-21-7-6-20-38-35-30-10-2-4-12-33(30)40-34-13-5-3-11-31(34)35/h2,4,10,12,14-19,24-25H,3,5-9,11,13,20-23H2,1H3,(H,38,40)(H,39,42) IDYOZSGAARAUPI-UHFFFAOYSA-N 50433918 CHEMBL2380610 Cholinesterase 7.7 ChEMBL 10.1016/j.bmcl.2013.04.008 10.7270/Q2NP25SJ 23639542 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433918 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433918&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71625788 175446235 CHEMBL2380610 ZINC96270055 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51063496 CC(C(=O)NCCCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccc(OCCCO[N+]([O-])=O)cc1 InChI=1S/C35H39FN4O5/c1-24(26-15-18-28(31(36)23-26)25-13-16-27(17-14-25)44-21-8-22-45-40(42)43)35(41)38-20-7-6-19-37-34-29-9-2-4-11-32(29)39-33-12-5-3-10-30(33)34/h2,4,9,11,13-18,23-24H,3,5-8,10,12,19-22H2,1H3,(H,37,39)(H,38,41) HGRAQIZTJBXKFK-UHFFFAOYSA-N 50433919 CHEMBL2380609 Cholinesterase 11 ChEMBL 10.1016/j.bmcl.2013.04.008 10.7270/Q2NP25SJ 23639542 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433919 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433919&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71625787 175446236 CHEMBL2380609 ZINC96270057 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51063497 CC(C(=O)NCCCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccc(OCCO[N+]([O-])=O)cc1 InChI=1S/C34H37FN4O5/c1-23(25-14-17-27(30(35)22-25)24-12-15-26(16-13-24)43-20-21-44-39(41)42)34(40)37-19-7-6-18-36-33-28-8-2-4-10-31(28)38-32-11-5-3-9-29(32)33/h2,4,8,10,12-17,22-23H,3,5-7,9,11,18-21H2,1H3,(H,36,38)(H,37,40) PDRXQFWLPWJYCL-UHFFFAOYSA-N 50433920 CHEMBL2380608 Cholinesterase 14 ChEMBL 10.1016/j.bmcl.2013.04.008 10.7270/Q2NP25SJ 23639542 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433920 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433920&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71625676 175446237 CHEMBL2380608 ZINC96270059 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51063498 CC(C(=O)NCCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccc(OCCCCCCO[N+]([O-])=O)cc1 InChI=1S/C37H43FN4O5/c1-26(37(43)40-22-10-21-39-36-31-11-4-6-13-34(31)41-35-14-7-5-12-32(35)36)28-17-20-30(33(38)25-28)27-15-18-29(19-16-27)46-23-8-2-3-9-24-47-42(44)45/h4,6,11,13,15-20,25-26H,2-3,5,7-10,12,14,21-24H2,1H3,(H,39,41)(H,40,43) WHKJEXOECXIDBC-UHFFFAOYSA-N 50433921 CHEMBL2380607 Cholinesterase 8.1 ChEMBL 10.1016/j.bmcl.2013.04.008 10.7270/Q2NP25SJ 23639542 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433921 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433921&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71625675 175446238 CHEMBL2380607 ZINC96270061 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51063499 CC(C(=O)NCCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccc(OCCCCO[N+]([O-])=O)cc1 InChI=1S/C35H39FN4O5/c1-24(26-15-18-28(31(36)23-26)25-13-16-27(17-14-25)44-21-6-7-22-45-40(42)43)35(41)38-20-8-19-37-34-29-9-2-4-11-32(29)39-33-12-5-3-10-30(33)34/h2,4,9,11,13-18,23-24H,3,5-8,10,12,19-22H2,1H3,(H,37,39)(H,38,41) MKEUKPOLBUSZTI-UHFFFAOYSA-N 50433922 CHEMBL2380606 Cholinesterase 7.9 ChEMBL 10.1016/j.bmcl.2013.04.008 10.7270/Q2NP25SJ 23639542 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433922 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433922&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71625674 175446239 CHEMBL2380606 ZINC96270063 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51063500 CC(C(=O)NCCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccc(OCCCO[N+]([O-])=O)cc1 InChI=1S/C34H37FN4O5/c1-23(25-14-17-27(30(35)22-25)24-12-15-26(16-13-24)43-20-7-21-44-39(41)42)34(40)37-19-6-18-36-33-28-8-2-4-10-31(28)38-32-11-5-3-9-29(32)33/h2,4,8,10,12-17,22-23H,3,5-7,9,11,18-21H2,1H3,(H,36,38)(H,37,40) RKVRONUETMYAFM-UHFFFAOYSA-N 50433923 CHEMBL2380605 Cholinesterase 8.6 ChEMBL 10.1016/j.bmcl.2013.04.008 10.7270/Q2NP25SJ 23639542 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433923 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433923&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71625673 175446240 CHEMBL2380605 ZINC96270065 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51063501 CC(C(=O)NCCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccc(OCCO[N+]([O-])=O)cc1 InChI=1S/C33H35FN4O5/c1-22(24-13-16-26(29(34)21-24)23-11-14-25(15-12-23)42-19-20-43-38(40)41)33(39)36-18-6-17-35-32-27-7-2-4-9-30(27)37-31-10-5-3-8-28(31)32/h2,4,7,9,11-16,21-22H,3,5-6,8,10,17-20H2,1H3,(H,35,37)(H,36,39) JFDHFBUOFZFAPW-UHFFFAOYSA-N 50433924 CHEMBL2380604 Cholinesterase 8.1 ChEMBL 10.1016/j.bmcl.2013.04.008 10.7270/Q2NP25SJ 23639542 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433924 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433924&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71625558 175446241 CHEMBL2380604 ZINC96270067 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51063502 CC(C(=O)NCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccc(OCCCCCCO[N+]([O-])=O)cc1 InChI=1S/C36H41FN4O5/c1-25(36(42)39-21-20-38-35-30-10-4-6-12-33(30)40-34-13-7-5-11-31(34)35)27-16-19-29(32(37)24-27)26-14-17-28(18-15-26)45-22-8-2-3-9-23-46-41(43)44/h4,6,10,12,14-19,24-25H,2-3,5,7-9,11,13,20-23H2,1H3,(H,38,40)(H,39,42) FBWXOUBMHZMKRS-UHFFFAOYSA-N 50433925 CHEMBL2380603 Cholinesterase 7.6 ChEMBL 10.1016/j.bmcl.2013.04.008 10.7270/Q2NP25SJ 23639542 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433925 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433925&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71625557 175446242 CHEMBL2380603 ZINC96270069 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51063503 CC(C(=O)NCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccc(OCCCCO[N+]([O-])=O)cc1 InChI=1S/C34H37FN4O5/c1-23(34(40)37-19-18-36-33-28-8-2-4-10-31(28)38-32-11-5-3-9-29(32)33)25-14-17-27(30(35)22-25)24-12-15-26(16-13-24)43-20-6-7-21-44-39(41)42/h2,4,8,10,12-17,22-23H,3,5-7,9,11,18-21H2,1H3,(H,36,38)(H,37,40) IEFWFBOBLBKOIT-UHFFFAOYSA-N 50433926 CHEMBL2380602 Cholinesterase 10 ChEMBL 10.1016/j.bmcl.2013.04.008 10.7270/Q2NP25SJ 23639542 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433926 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433926&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71625556 175446243 CHEMBL2380602 ZINC96270071 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51063504 CC(C(=O)NCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccc(OCCCO[N+]([O-])=O)cc1 InChI=1S/C33H35FN4O5/c1-22(24-13-16-26(29(34)21-24)23-11-14-25(15-12-23)42-19-6-20-43-38(40)41)33(39)36-18-17-35-32-27-7-2-4-9-30(27)37-31-10-5-3-8-28(31)32/h2,4,7,9,11-16,21-22H,3,5-6,8,10,17-20H2,1H3,(H,35,37)(H,36,39) PDRCRSNEMYGWMI-UHFFFAOYSA-N 50433927 CHEMBL2380601 Cholinesterase 10.0 ChEMBL 10.1016/j.bmcl.2013.04.008 10.7270/Q2NP25SJ 23639542 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433927 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433927&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71625555 175446244 CHEMBL2380601 ZINC96270073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51063505 CC(C(=O)NCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccc(OCCO[N+]([O-])=O)cc1 InChI=1S/C32H33FN4O5/c1-21(23-12-15-25(28(33)20-23)22-10-13-24(14-11-22)41-18-19-42-37(39)40)32(38)35-17-16-34-31-26-6-2-4-8-29(26)36-30-9-5-3-7-27(30)31/h2,4,6,8,10-15,20-21H,3,5,7,9,16-19H2,1H3,(H,34,36)(H,35,38) YAJBEERVPURFIL-UHFFFAOYSA-N 50433928 CHEMBL2380615 Cholinesterase 9.9 ChEMBL 10.1016/j.bmcl.2013.04.008 10.7270/Q2NP25SJ 23639542 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433928 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433928&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71625438 175446245 CHEMBL2380615 ZINC96270075 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51063506 CC(C(=O)NCCCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccccc1 InChI=1S/C32H34FN3O/c1-22(24-17-18-25(28(33)21-24)23-11-3-2-4-12-23)32(37)35-20-10-9-19-34-31-26-13-5-7-15-29(26)36-30-16-8-6-14-27(30)31/h2-5,7,11-13,15,17-18,21-22H,6,8-10,14,16,19-20H2,1H3,(H,34,36)(H,35,37) DMDNXXVGDPOBEA-UHFFFAOYSA-N 50433929 CHEMBL2380614 Cholinesterase 11 ChEMBL 10.1016/j.bmcl.2013.04.008 10.7270/Q2NP25SJ 23639542 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433929 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433929&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72725487 175446246 CHEMBL2380614 ZINC96270077 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51063507 CC(C(=O)NCCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccccc1 InChI=1S/C31H32FN3O/c1-21(23-16-17-24(27(32)20-23)22-10-3-2-4-11-22)31(36)34-19-9-18-33-30-25-12-5-7-14-28(25)35-29-15-8-6-13-26(29)30/h2-5,7,10-12,14,16-17,20-21H,6,8-9,13,15,18-19H2,1H3,(H,33,35)(H,34,36) PQPUUCJLTFZTCY-UHFFFAOYSA-N 50433930 CHEMBL2380613 Cholinesterase 14 ChEMBL 10.1016/j.bmcl.2013.04.008 10.7270/Q2NP25SJ 23639542 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433930 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433930&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72725486 175446247 CHEMBL2380613 ZINC96270079 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51063508 CC(C(=O)NCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccccc1 InChI=1S/C30H30FN3O/c1-20(22-15-16-23(26(31)19-22)21-9-3-2-4-10-21)30(35)33-18-17-32-29-24-11-5-7-13-27(24)34-28-14-8-6-12-25(28)29/h2-5,7,9-11,13,15-16,19-20H,6,8,12,14,17-18H2,1H3,(H,32,34)(H,33,35) PEMHNFONPRXBLD-UHFFFAOYSA-N 50433931 CHEMBL2380612 Cholinesterase 59 ChEMBL 10.1016/j.bmcl.2013.04.008 10.7270/Q2NP25SJ 23639542 Chen, Y; Sun, J; Huang, Z; Liao, H; Peng, S; Lehmann, J; Zhang, Y China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433931 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433931&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72725485 175446248 CHEMBL2380612 ZINC96270081 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073280 CC(C)N(CCOc1ccc(cc1)-c1nc2ccc(Cl)cc2[nH]1)C(C)C InChI=1S/C21H26ClN3O/c1-14(2)25(15(3)4)11-12-26-18-8-5-16(6-9-18)21-23-19-10-7-17(22)13-20(19)24-21/h5-10,13-15H,11-12H2,1-4H3,(H,23,24) QEGIKSFQWDYIPY-UHFFFAOYSA-N 50438825 CHEMBL2413741 Cholinesterase 7440 ChEMBL 10.1016/j.bmc.2013.06.065 10.7270/Q21837XT 23891231 Alpan, AS; Parlar, S; Carlino, L; Tarikogullari, AH; Alptuzun, V; Gunes, HS Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50438825 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50438825&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71769495 175451142 CHEMBL2413741 ZINC96282666 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073281 CCN(CC)CCOc1ccc(cc1)-c1nc2ccc(Cl)cc2[nH]1 InChI=1S/C19H22ClN3O/c1-3-23(4-2)11-12-24-16-8-5-14(6-9-16)19-21-17-10-7-15(20)13-18(17)22-19/h5-10,13H,3-4,11-12H2,1-2H3,(H,21,22) MRCUDDHDPPYVCN-UHFFFAOYSA-N 50438826 CHEMBL2413740 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2013.06.065 10.7270/Q21837XT 23891231 Alpan, AS; Parlar, S; Carlino, L; Tarikogullari, AH; Alptuzun, V; Gunes, HS Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50438826 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50438826&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 559371 175451143 CHEMBL2413740 ZINC32230907 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073282 CN(C)CCOc1ccc(cc1)-c1nc2ccc(Cl)cc2[nH]1 InChI=1S/C17H18ClN3O/c1-21(2)9-10-22-14-6-3-12(4-7-14)17-19-15-8-5-13(18)11-16(15)20-17/h3-8,11H,9-10H2,1-2H3,(H,19,20) UFPXLIINJWSSMV-UHFFFAOYSA-N 50438827 CHEMBL2413739 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2013.06.065 10.7270/Q21837XT 23891231 Alpan, AS; Parlar, S; Carlino, L; Tarikogullari, AH; Alptuzun, V; Gunes, HS Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50438827 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50438827&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71769388 175451144 CHEMBL2413739 ZINC96282667 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073283 Oc1ccc(cc1)-c1nc2ccc(Cl)cc2[nH]1 InChI=1S/C13H9ClN2O/c14-9-3-6-11-12(7-9)16-13(15-11)8-1-4-10(17)5-2-8/h1-7,17H,(H,15,16) GGUHTGJGVJGBEI-UHFFFAOYSA-N 50438828 CHEMBL2413738 Cholinesterase 8520 ChEMBL 10.1016/j.bmc.2013.06.065 10.7270/Q21837XT 23891231 Alpan, AS; Parlar, S; Carlino, L; Tarikogullari, AH; Alptuzun, V; Gunes, HS Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50438828 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50438828&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5453440 175451145 CHEMBL2413738 ZINC05491223 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073284 Cc1ccc2nc([nH]c2c1)-c1ccc(OCCN2CCOCC2)cc1 InChI=1S/C20H23N3O2/c1-15-2-7-18-19(14-15)22-20(21-18)16-3-5-17(6-4-16)25-13-10-23-8-11-24-12-9-23/h2-7,14H,8-13H2,1H3,(H,21,22) JNNLSQKEHIMVGD-UHFFFAOYSA-N 50438829 CHEMBL2413737 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2013.06.065 10.7270/Q21837XT 23891231 Alpan, AS; Parlar, S; Carlino, L; Tarikogullari, AH; Alptuzun, V; Gunes, HS Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50438829 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50438829&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71769387 175451146 CHEMBL2413737 ZINC96282668 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061436 O=C(CN1CCCCC1)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1 InChI=1S/C25H23N5O2/c31-22(15-29-11-4-1-5-12-29)26-16-8-9-21-19(14-16)25(32)30-13-10-18-17-6-2-3-7-20(17)27-23(18)24(30)28-21/h2-3,6-10,13-14,27H,1,4-5,11-12,15H2,(H,26,31) WLAAJJZNAFKAMK-UHFFFAOYSA-N 50316369 3-(2-N-Piperidyl-acetamino)-7,8-dehydrorutaecarpine::CHEMBL1098308 Cholinesterase 23200 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50316369 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50316369&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46192443 104150730 CHEMBL1098308 ZINC49784060 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061437 O=C(CN1CCCC1)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1 InChI=1S/C24H21N5O2/c30-21(14-28-10-3-4-11-28)25-15-7-8-20-18(13-15)24(31)29-12-9-17-16-5-1-2-6-19(16)26-22(17)23(29)27-20/h1-2,5-9,12-13,26H,3-4,10-11,14H2,(H,25,30) YHMBQJOVILGZDZ-UHFFFAOYSA-N 50316368 3-(2-N-Pyrrolyl-acetamino)-7,8-dehydrorutaecarpine::CHEMBL1096953 Cholinesterase 14400 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50316368 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50316368&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46192442 104150729 CHEMBL1096953 ZINC49783963 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061438 CCN(CC)CC(=O)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1 InChI=1S/C24H23N5O2/c1-3-28(4-2)14-21(30)25-15-9-10-20-18(13-15)24(31)29-12-11-17-16-7-5-6-8-19(16)26-22(17)23(29)27-20/h5-13,26H,3-4,14H2,1-2H3,(H,25,30) OXBFBPQXYBLXFZ-UHFFFAOYSA-N 50316367 3-(2-Diethylamino-acetamino)-7,8-dehydrorutaecarpine::CHEMBL1096952 Cholinesterase 24100 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50316367 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50316367&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46192315 104150728 CHEMBL1096952 ZINC49114091 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061439 CN(C)CC(=O)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1 InChI=1S/C22H19N5O2/c1-26(2)12-19(28)23-13-7-8-18-16(11-13)22(29)27-10-9-15-14-5-3-4-6-17(14)24-20(15)21(27)25-18/h3-11,24H,12H2,1-2H3,(H,23,28) VIPFSPAWJVQHSE-UHFFFAOYSA-N 50433025 CHEMBL2375943 Cholinesterase 26500 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433025 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433025&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72196923 175445342 CHEMBL2375943 ZINC96258336 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061440 Cn1cc[n+](CC(=O)Nc2ccc3nc4c5[nH]c6ccccc6c5ccn4c(=O)c3c2)c1 InChI=1S/C24H18N6O2/c1-28-10-11-29(14-28)13-21(31)25-15-6-7-20-18(12-15)24(32)30-9-8-17-16-4-2-3-5-19(16)26-22(17)23(30)27-20/h2-12,14H,13H2,1H3,(H-,25,26,27,31,32)/p+1 JHJWLSZXEIVXCC-UHFFFAOYSA-O 50433026 CHEMBL2375942 Cholinesterase 7340 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433026 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433026&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72196922 175445343 CHEMBL2375942 ZINC96258338 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061441 Fc1ccc[n+](CC(=O)Nc2ccc3nc4c5[nH]c6ccccc6c5ccn4c(=O)c3c2)c1 InChI=1S/C25H16FN5O2/c26-15-4-3-10-30(13-15)14-22(32)27-16-7-8-21-19(12-16)25(33)31-11-9-18-17-5-1-2-6-20(17)28-23(18)24(31)29-21/h1-13H,14H2,(H-,27,28,29,32,33)/p+1 VLZOWPGVQBRRTN-UHFFFAOYSA-O 50433027 CHEMBL2375941 Cholinesterase 1855 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433027 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433027&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72196920 175445344 CHEMBL2375941 ZINC96258339 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51061442 O=C(C[n+]1ccccc1)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1 InChI=1S/C25H17N5O2/c31-22(15-29-11-4-1-5-12-29)26-16-8-9-21-19(14-16)25(32)30-13-10-18-17-6-2-3-7-20(17)27-23(18)24(30)28-21/h1-14H,15H2,(H-,26,27,28,31,32)/p+1 HIFOZIUNPJTFQP-UHFFFAOYSA-O 50433028 CHEMBL2375940 Cholinesterase 2451 ChEMBL 10.1016/j.ejmech.2013.02.014 10.7270/Q2SQ91RP 23501115 He, Y; Yao, PF; Chen, SB; Huang, ZH; Huang, SL; Tan, JH; Li, D; Gu, LQ; Huang, ZS Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433028 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433028&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72196918 175445345 CHEMBL2375940 ZINC96258341 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073285 Cc1ccc2nc([nH]c2c1)-c1ccc(OCCN2CCCCC2)cc1 InChI=1S/C21H25N3O/c1-16-5-10-19-20(15-16)23-21(22-19)17-6-8-18(9-7-17)25-14-13-24-11-3-2-4-12-24/h5-10,15H,2-4,11-14H2,1H3,(H,22,23) XVWGGOXBAAKLJP-UHFFFAOYSA-N 50438830 CHEMBL2413736 Cholinesterase 1370 ChEMBL 10.1016/j.bmc.2013.06.065 10.7270/Q21837XT 23891231 Alpan, AS; Parlar, S; Carlino, L; Tarikogullari, AH; Alptuzun, V; Gunes, HS Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50438830 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50438830&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71769386 175451147 CHEMBL2413736 ZINC96282669 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073286 Cc1ccc2nc([nH]c2c1)-c1ccc(OCCN2CCCC2)cc1 InChI=1S/C20H23N3O/c1-15-4-9-18-19(14-15)22-20(21-18)16-5-7-17(8-6-16)24-13-12-23-10-2-3-11-23/h4-9,14H,2-3,10-13H2,1H3,(H,21,22) ULFZHPSKEWCTNR-UHFFFAOYSA-N 50438831 CHEMBL2413735 Cholinesterase 3240 ChEMBL 10.1016/j.bmc.2013.06.065 10.7270/Q21837XT 23891231 Alpan, AS; Parlar, S; Carlino, L; Tarikogullari, AH; Alptuzun, V; Gunes, HS Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50438831 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50438831&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71769385 175451148 CHEMBL2413735 ZINC96282670 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073287 CCN(CC)CCOc1ccc(cc1)-c1nc2ccc(C)cc2[nH]1 InChI=1S/C20H25N3O/c1-4-23(5-2)12-13-24-17-9-7-16(8-10-17)20-21-18-11-6-15(3)14-19(18)22-20/h6-11,14H,4-5,12-13H2,1-3H3,(H,21,22) FRSWFNMTSFMEFA-UHFFFAOYSA-N 50438832 CHEMBL2413734 Cholinesterase 6480 ChEMBL 10.1016/j.bmc.2013.06.065 10.7270/Q21837XT 23891231 Alpan, AS; Parlar, S; Carlino, L; Tarikogullari, AH; Alptuzun, V; Gunes, HS Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50438832 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50438832&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71769384 175451149 CHEMBL2413734 ZINC96282671 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073288 CN(C)CCOc1ccc(cc1)-c1nc2ccc(C)cc2[nH]1 InChI=1S/C18H21N3O/c1-13-4-9-16-17(12-13)20-18(19-16)14-5-7-15(8-6-14)22-11-10-21(2)3/h4-9,12H,10-11H2,1-3H3,(H,19,20) LXOFWGQRZZFMFP-UHFFFAOYSA-N 50438833 CHEMBL2413733 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2013.06.065 10.7270/Q21837XT 23891231 Alpan, AS; Parlar, S; Carlino, L; Tarikogullari, AH; Alptuzun, V; Gunes, HS Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50438833 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50438833&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71769383 175451150 CHEMBL2413733 ZINC96282672 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073289 Cc1ccc2nc([nH]c2c1)-c1ccc(O)cc1 InChI=1S/C14H12N2O/c1-9-2-7-12-13(8-9)16-14(15-12)10-3-5-11(17)6-4-10/h2-8,17H,1H3,(H,15,16) CPQLMFZCFVDANN-UHFFFAOYSA-N 50438834 CHEMBL2413732 Cholinesterase 4670 ChEMBL 10.1016/j.bmc.2013.06.065 10.7270/Q21837XT 23891231 Alpan, AS; Parlar, S; Carlino, L; Tarikogullari, AH; Alptuzun, V; Gunes, HS Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50438834 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50438834&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5420503 175451151 CHEMBL2413732 ZINC05818449 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073290 C(CN1CCOCC1)Oc1ccc(cc1)-c1nc2ccccc2[nH]1 InChI=1S/C19H21N3O2/c1-2-4-18-17(3-1)20-19(21-18)15-5-7-16(8-6-15)24-14-11-22-9-12-23-13-10-22/h1-8H,9-14H2,(H,20,21) FVWQPWJWXDUYOX-UHFFFAOYSA-N 50438835 CHEMBL2413561 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2013.06.065 10.7270/Q21837XT 23891231 Alpan, AS; Parlar, S; Carlino, L; Tarikogullari, AH; Alptuzun, V; Gunes, HS Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50438835 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50438835&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71769382 175451152 CHEMBL2413561 ZINC96282673 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073291 C(CN1CCCCC1)Oc1ccc(cc1)-c1nc2ccccc2[nH]1 InChI=1S/C20H23N3O/c1-4-12-23(13-5-1)14-15-24-17-10-8-16(9-11-17)20-21-18-6-2-3-7-19(18)22-20/h2-3,6-11H,1,4-5,12-15H2,(H,21,22) DQHHGJIDSIEIRK-UHFFFAOYSA-N 50438836 CHEMBL2413560 Cholinesterase 2450 ChEMBL 10.1016/j.bmc.2013.06.065 10.7270/Q21837XT 23891231 Alpan, AS; Parlar, S; Carlino, L; Tarikogullari, AH; Alptuzun, V; Gunes, HS Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50438836 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50438836&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 69515123 175451153 CHEMBL2413560 ZINC96282674 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073292 C(CN1CCCC1)Oc1ccc(cc1)-c1nc2ccccc2[nH]1 InChI=1S/C19H21N3O/c1-2-6-18-17(5-1)20-19(21-18)15-7-9-16(10-8-15)23-14-13-22-11-3-4-12-22/h1-2,5-10H,3-4,11-14H2,(H,20,21) GPCCQUBMGXQCPH-UHFFFAOYSA-N 50438837 CHEMBL2413559 Cholinesterase 23050 ChEMBL 10.1016/j.bmc.2013.06.065 10.7270/Q21837XT 23891231 Alpan, AS; Parlar, S; Carlino, L; Tarikogullari, AH; Alptuzun, V; Gunes, HS Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50438837 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50438837&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71769273 175451154 CHEMBL2413559 ZINC96282675 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073293 CC(C)N(CCOc1ccc(cc1)-c1nc2ccccc2[nH]1)C(C)C InChI=1S/C21H27N3O/c1-15(2)24(16(3)4)13-14-25-18-11-9-17(10-12-18)21-22-19-7-5-6-8-20(19)23-21/h5-12,15-16H,13-14H2,1-4H3,(H,22,23) PYQMEKHFZSJYQR-UHFFFAOYSA-N 50438838 CHEMBL2413558 Cholinesterase 4110 ChEMBL 10.1016/j.bmc.2013.06.065 10.7270/Q21837XT 23891231 Alpan, AS; Parlar, S; Carlino, L; Tarikogullari, AH; Alptuzun, V; Gunes, HS Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50438838 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50438838&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71769272 175451155 CHEMBL2413558 ZINC96282676 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073294 CCN(CC)CCOc1ccc(cc1)-c1nc2ccccc2[nH]1 InChI=1S/C19H23N3O/c1-3-22(4-2)13-14-23-16-11-9-15(10-12-16)19-20-17-7-5-6-8-18(17)21-19/h5-12H,3-4,13-14H2,1-2H3,(H,20,21) YOVHNJSQWZOPJV-UHFFFAOYSA-N 50438839 CHEMBL2413745 Cholinesterase 5060 ChEMBL 10.1016/j.bmc.2013.06.065 10.7270/Q21837XT 23891231 Alpan, AS; Parlar, S; Carlino, L; Tarikogullari, AH; Alptuzun, V; Gunes, HS Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50438839 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50438839&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71769271 175451156 CHEMBL2413745 ZINC96282677 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073295 CN(C)CCOc1ccc(cc1)-c1nc2ccccc2[nH]1 InChI=1S/C17H19N3O/c1-20(2)11-12-21-14-9-7-13(8-10-14)17-18-15-5-3-4-6-16(15)19-17/h3-10H,11-12H2,1-2H3,(H,18,19) LUBUSRLQUIHRJC-UHFFFAOYSA-N 50438840 CHEMBL2413746 Cholinesterase 5870 ChEMBL 10.1016/j.bmc.2013.06.065 10.7270/Q21837XT 23891231 Alpan, AS; Parlar, S; Carlino, L; Tarikogullari, AH; Alptuzun, V; Gunes, HS Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50438840 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50438840&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71769270 175451157 CHEMBL2413746 ZINC96282678 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073296 Oc1ccc(cc1)-c1nc2ccccc2[nH]1 InChI=1S/C13H10N2O/c16-10-7-5-9(6-8-10)13-14-11-3-1-2-4-12(11)15-13/h1-8,16H,(H,14,15) REOGMBVECOGANJ-UHFFFAOYSA-N 50438841 CHEMBL377740 Cholinesterase 4590 ChEMBL 10.1016/j.bmc.2013.06.065 10.7270/Q21837XT 23891231 Alpan, AS; Parlar, S; Carlino, L; Tarikogullari, AH; Alptuzun, V; Gunes, HS Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50438841 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50438841&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5391130 175451158 CHEMBL377740 ZINC00038453 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073318 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 9.8 ChEMBL 10.1016/j.bmc.2013.06.065 10.7270/Q21837XT 23891231 Alpan, AS; Parlar, S; Carlino, L; Tarikogullari, AH; Alptuzun, V; Gunes, HS Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073319 Clc1ccc2nc([nH]c2c1)-c1ccc(OCCN2CCOCC2)cc1 InChI=1S/C19H20ClN3O2/c20-15-3-6-17-18(13-15)22-19(21-17)14-1-4-16(5-2-14)25-12-9-23-7-10-24-11-8-23/h1-6,13H,7-12H2,(H,21,22) MKCZJPWVOINYIU-UHFFFAOYSA-N 50438842 CHEMBL2413744 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2013.06.065 10.7270/Q21837XT 23891231 Alpan, AS; Parlar, S; Carlino, L; Tarikogullari, AH; Alptuzun, V; Gunes, HS Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50438842 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50438842&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71769498 175451159 CHEMBL2413744 ZINC96282679 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073320 Clc1ccc2nc([nH]c2c1)-c1ccc(OCCN2CCCCC2)cc1 InChI=1S/C20H22ClN3O/c21-16-6-9-18-19(14-16)23-20(22-18)15-4-7-17(8-5-15)25-13-12-24-10-2-1-3-11-24/h4-9,14H,1-3,10-13H2,(H,22,23) JWMNDJKJQTZJKT-UHFFFAOYSA-N 50438843 CHEMBL2413743 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2013.06.065 10.7270/Q21837XT 23891231 Alpan, AS; Parlar, S; Carlino, L; Tarikogullari, AH; Alptuzun, V; Gunes, HS Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50438843 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50438843&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71769497 175451160 CHEMBL2413743 ZINC96282680 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51073321 Clc1ccc2nc([nH]c2c1)-c1ccc(OCCN2CCCC2)cc1 InChI=1S/C19H20ClN3O/c20-15-5-8-17-18(13-15)22-19(21-17)14-3-6-16(7-4-14)24-12-11-23-9-1-2-10-23/h3-8,13H,1-2,9-12H2,(H,21,22) BBTOCHYFQHOWFS-UHFFFAOYSA-N 50438844 CHEMBL2413742 Cholinesterase 3420 ChEMBL 10.1016/j.bmc.2013.06.065 10.7270/Q21837XT 23891231 Alpan, AS; Parlar, S; Carlino, L; Tarikogullari, AH; Alptuzun, V; Gunes, HS Ege University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50438844 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50438844&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71769496 175451161 CHEMBL2413742 ZINC96282681 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51032012 CCC1Oc2c(Br)cc(Cl)cc2C2CC(C)=NN2C1=O InChI=1S/C14H14BrClN2O2/c1-3-12-14(19)18-11(4-7(2)17-18)9-5-8(16)6-10(15)13(9)20-12/h5-6,11-12H,3-4H2,1-2H3 GMUBTUZIZDTPNF-UHFFFAOYSA-N 50307814 CHEMBL4176194 Cholinesterase 1500 ChEMBL 10.1016/j.ejmech.2018.02.002 10.7270/Q2XG9TP4 29438888 Chen, SC; Qiu, GL; Li, B; Shi, JB; Liu, XH; Tang, WJ Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50307814 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50307814&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 17572266 104162175 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525939 CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCC(=O)NCCN3CCCC3)cc2o1 InChI=1S/C25H29N3O4/c1-27(2)19-7-5-18(6-8-19)23-16-22(29)21-10-9-20(15-24(21)32-23)31-17-25(30)26-11-14-28-12-3-4-13-28/h5-10,15-16H,3-4,11-14,17H2,1-2H3,(H,26,30) GTNBUNOOQYEHMZ-UHFFFAOYSA-N 50200123 CHEMBL3913567 Cholinesterase 27200 ChEMBL 10.1016/j.ejmech.2016.06.022 10.7270/Q2QZ2CX6 27343850 Luo, W; Wang, T; Hong, C; Yang, YC; Chen, Y; Cen, J; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50200123 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50200123&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134142336 375978797 CHEMBL3913567 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525945 CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCC(=O)NCCCNc3c4CCCCc4nc4ccccc34)cc2o1 InChI=1S/C35H36N4O4/c1-39(2)24-14-12-23(13-15-24)32-21-31(40)28-17-16-25(20-33(28)43-32)42-22-34(41)36-18-7-19-37-35-26-8-3-5-10-29(26)38-30-11-6-4-9-27(30)35/h3,5,8,10,12-17,20-21H,4,6-7,9,11,18-19,22H2,1-2H3,(H,36,41)(H,37,38) IFPHNBDCOFNVTL-UHFFFAOYSA-N 50200128 CHEMBL3931477 Cholinesterase 266 ChEMBL 10.1016/j.ejmech.2016.06.022 10.7270/Q2QZ2CX6 27343850 Luo, W; Wang, T; Hong, C; Yang, YC; Chen, Y; Cen, J; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50200128 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50200128&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134138479 375978802 CHEMBL3931477 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525947 CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCC(=O)NCCNc3c4CCCCc4nc4ccccc34)cc2o1 InChI=1S/C34H34N4O4/c1-38(2)23-13-11-22(12-14-23)31-20-30(39)27-16-15-24(19-32(27)42-31)41-21-33(40)35-17-18-36-34-25-7-3-5-9-28(25)37-29-10-6-4-8-26(29)34/h3,5,7,9,11-16,19-20H,4,6,8,10,17-18,21H2,1-2H3,(H,35,40)(H,36,37) DWAPEXDLMBBEEE-UHFFFAOYSA-N 50200126 CHEMBL3892539 Cholinesterase 814 ChEMBL 10.1016/j.ejmech.2016.06.022 10.7270/Q2QZ2CX6 27343850 Luo, W; Wang, T; Hong, C; Yang, YC; Chen, Y; Cen, J; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50200126 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50200126&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134137194 375978800 CHEMBL3892539 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525948 CN(C)CCNC(=O)COc1ccc2c(c1)oc(cc2=O)-c1ccc(cc1)N(C)C InChI=1S/C23H27N3O4/c1-25(2)12-11-24-23(28)15-29-18-9-10-19-20(27)14-21(30-22(19)13-18)16-5-7-17(8-6-16)26(3)4/h5-10,13-14H,11-12,15H2,1-4H3,(H,24,28) LQKVYSSDIPOIFL-UHFFFAOYSA-N 50200121 CHEMBL3897800 Cholinesterase 10660 ChEMBL 10.1016/j.ejmech.2016.06.022 10.7270/Q2QZ2CX6 27343850 Luo, W; Wang, T; Hong, C; Yang, YC; Chen, Y; Cen, J; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50200121 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50200121&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134133151 375978795 CHEMBL3897800 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525949 CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCC(=O)NCCCCCCN3CCCC3)cc2o1 InChI=1S/C29H37N3O4/c1-31(2)23-11-9-22(10-12-23)27-20-26(33)25-14-13-24(19-28(25)36-27)35-21-29(34)30-15-5-3-4-6-16-32-17-7-8-18-32/h9-14,19-20H,3-8,15-18,21H2,1-2H3,(H,30,34) FBSQNPVGAVGJQX-UHFFFAOYSA-N 50200127 CHEMBL3932576 Cholinesterase 1354 ChEMBL 10.1016/j.ejmech.2016.06.022 10.7270/Q2QZ2CX6 27343850 Luo, W; Wang, T; Hong, C; Yang, YC; Chen, Y; Cen, J; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50200127 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50200127&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134138095 375978801 CHEMBL3932576 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525950 CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCC(=O)NCCCCNc3c4CCCCc4nc4ccccc34)cc2o1 InChI=1S/C36H38N4O4/c1-40(2)25-15-13-24(14-16-25)33-22-32(41)29-18-17-26(21-34(29)44-33)43-23-35(42)37-19-7-8-20-38-36-27-9-3-5-11-30(27)39-31-12-6-4-10-28(31)36/h3,5,9,11,13-18,21-22H,4,6-8,10,12,19-20,23H2,1-2H3,(H,37,42)(H,38,39) UBGRCNKSJOAVOU-UHFFFAOYSA-N 50200122 CHEMBL3958981 Cholinesterase 335 ChEMBL 10.1016/j.ejmech.2016.06.022 10.7270/Q2QZ2CX6 27343850 Luo, W; Wang, T; Hong, C; Yang, YC; Chen, Y; Cen, J; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50200122 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50200122&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134155949 375978796 CHEMBL3958981 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525951 CN(C)CCCNC(=O)COc1ccc2c(c1)oc(cc2=O)-c1ccc(cc1)N(C)C InChI=1S/C24H29N3O4/c1-26(2)13-5-12-25-24(29)16-30-19-10-11-20-21(28)15-22(31-23(20)14-19)17-6-8-18(9-7-17)27(3)4/h6-11,14-15H,5,12-13,16H2,1-4H3,(H,25,29) KXINLIQEPWKJFC-UHFFFAOYSA-N 50200125 CHEMBL3975419 Cholinesterase 13577 ChEMBL 10.1016/j.ejmech.2016.06.022 10.7270/Q2QZ2CX6 27343850 Luo, W; Wang, T; Hong, C; Yang, YC; Chen, Y; Cen, J; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50200125 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50200125&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134152137 375978799 CHEMBL3975419 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525953 CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCC(=O)NCCCN3CCCC3)cc2o1 InChI=1S/C26H31N3O4/c1-28(2)20-8-6-19(7-9-20)24-17-23(30)22-11-10-21(16-25(22)33-24)32-18-26(31)27-12-5-15-29-13-3-4-14-29/h6-11,16-17H,3-5,12-15,18H2,1-2H3,(H,27,31) XYKHEUQCDSBEKC-UHFFFAOYSA-N 50200124 CHEMBL3941548 Cholinesterase 21609 ChEMBL 10.1016/j.ejmech.2016.06.022 10.7270/Q2QZ2CX6 27343850 Luo, W; Wang, T; Hong, C; Yang, YC; Chen, Y; Cen, J; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50200124 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50200124&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134146191 375978798 CHEMBL3941548 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525954 CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCC(=O)NCCCCN3CCCC3)cc2o1 InChI=1S/C27H33N3O4/c1-29(2)21-9-7-20(8-10-21)25-18-24(31)23-12-11-22(17-26(23)34-25)33-19-27(32)28-13-3-4-14-30-15-5-6-16-30/h7-12,17-18H,3-6,13-16,19H2,1-2H3,(H,28,32) KEWYFQIMVAGBDU-UHFFFAOYSA-N 50200129 CHEMBL3904577 Cholinesterase 11588 ChEMBL 10.1016/j.ejmech.2016.06.022 10.7270/Q2QZ2CX6 27343850 Luo, W; Wang, T; Hong, C; Yang, YC; Chen, Y; Cen, J; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50200129 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50200129&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134135034 375978803 CHEMBL3904577 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525957 CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCC(=O)NCCCCCCCCN3CCCC3)cc2o1 InChI=1S/C31H41N3O4/c1-33(2)25-13-11-24(12-14-25)29-22-28(35)27-16-15-26(21-30(27)38-29)37-23-31(36)32-17-7-5-3-4-6-8-18-34-19-9-10-20-34/h11-16,21-22H,3-10,17-20,23H2,1-2H3,(H,32,36) UFVAJPUHGJFXKV-UHFFFAOYSA-N 50200131 CHEMBL3968969 Cholinesterase 238 ChEMBL 10.1016/j.ejmech.2016.06.022 10.7270/Q2QZ2CX6 27343850 Luo, W; Wang, T; Hong, C; Yang, YC; Chen, Y; Cen, J; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50200131 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50200131&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134150251 375978805 CHEMBL3968969 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525958 CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCC(=O)NCCCCCCCCNc3c4CCCCc4nc4ccccc34)cc2o1 InChI=1S/C40H46N4O4/c1-44(2)29-19-17-28(18-20-29)37-26-36(45)33-22-21-30(25-38(33)48-37)47-27-39(46)41-23-11-5-3-4-6-12-24-42-40-31-13-7-9-15-34(31)43-35-16-10-8-14-32(35)40/h7,9,13,15,17-22,25-26H,3-6,8,10-12,14,16,23-24,27H2,1-2H3,(H,41,46)(H,42,43) ATNVTNYCAKJQKO-UHFFFAOYSA-N 50200130 CHEMBL3950279 Cholinesterase 25 ChEMBL 10.1016/j.ejmech.2016.06.022 10.7270/Q2QZ2CX6 27343850 Luo, W; Wang, T; Hong, C; Yang, YC; Chen, Y; Cen, J; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50200130 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50200130&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134147322 375978804 CHEMBL3950279 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525959 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 37 ChEMBL 10.1016/j.ejmech.2016.06.022 10.7270/Q2QZ2CX6 27343850 Luo, W; Wang, T; Hong, C; Yang, YC; Chen, Y; Cen, J; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525961 CCn1nc(-c2ccccc2)c(C(C)=O)c(Nc2ccc(cc2)C(O)=O)c1=O InChI=1S/C21H19N3O4/c1-3-24-20(26)19(22-16-11-9-15(10-12-16)21(27)28)17(13(2)25)18(23-24)14-7-5-4-6-8-14/h4-12,22H,3H2,1-2H3,(H,27,28) HAISKEJFQSPYKC-UHFFFAOYSA-N 50199714 CHEMBL3922564 Cholinesterase 46 ChEMBL 10.1016/j.ejmech.2016.06.022 10.7270/Q2QZ2CX6 27343850 Luo, W; Wang, T; Hong, C; Yang, YC; Chen, Y; Cen, J; Xie, SQ; Wang, CJ Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199714 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199714&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 6PT 5K1I 10452194 375978675 CHEMBL3922564 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51032011 CCC1Oc2c(Br)cc(Br)cc2C2CC(C)=NN2C1=O InChI=1S/C14H14Br2N2O2/c1-3-12-14(19)18-11(4-7(2)17-18)9-5-8(15)6-10(16)13(9)20-12/h5-6,11-12H,3-4H2,1-2H3 NYLGYTWZKHXNMW-UHFFFAOYSA-N 50307397 CHEMBL4177151 Cholinesterase 7600 ChEMBL 10.1016/j.ejmech.2018.02.002 10.7270/Q2XG9TP4 29438888 Chen, SC; Qiu, GL; Li, B; Shi, JB; Liu, XH; Tang, WJ Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50307397 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50307397&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46233427 104161758 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51032013 CC[C@@H]1Oc2c(Br)cc(Cl)cc2C2CC(C)=NN2C1=O InChI=1S/C14H14BrClN2O2/c1-3-12-14(19)18-11(4-7(2)17-18)9-5-8(16)6-10(15)13(9)20-12/h5-6,11-12H,3-4H2,1-2H3/t11?,12-/m0/s1 GMUBTUZIZDTPNF-KIYNQFGBSA-N 50307937 CHEMBL4167927 Cholinesterase 20420 ChEMBL 10.1016/j.ejmech.2018.02.002 10.7270/Q2XG9TP4 29438888 Chen, SC; Qiu, GL; Li, B; Shi, JB; Liu, XH; Tang, WJ Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50307937 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50307937&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 45140940 104162298 ZINC45387004 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51032014 CC[C@H]1Oc2c(Br)cc(Cl)cc2C2CC(C)=NN2C1=O InChI=1S/C14H14BrClN2O2/c1-3-12-14(19)18-11(4-7(2)17-18)9-5-8(16)6-10(15)13(9)20-12/h5-6,11-12H,3-4H2,1-2H3/t11?,12-/m1/s1 GMUBTUZIZDTPNF-PIJUOVFKSA-N 50307938 CHEMBL4165579 Cholinesterase 1140 ChEMBL 10.1016/j.ejmech.2018.02.002 10.7270/Q2XG9TP4 29438888 Chen, SC; Qiu, GL; Li, B; Shi, JB; Liu, XH; Tang, WJ Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50307938 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50307938&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 45141137 104162299 ZINC45367601 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51032020 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 11810 ChEMBL 10.1016/j.ejmech.2018.02.002 10.7270/Q2XG9TP4 29438888 Chen, SC; Qiu, GL; Li, B; Shi, JB; Liu, XH; Tang, WJ Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51032017 CCC1Oc2c(Br)cc(Br)cc2C2CC(C)=NN2C1=O InChI=1S/C14H14Br2N2O2/c1-3-12-14(19)18-11(4-7(2)17-18)9-5-8(15)6-10(16)13(9)20-12/h5-6,11-12H,3-4H2,1-2H3 NYLGYTWZKHXNMW-UHFFFAOYSA-N 50307397 CHEMBL4177151 Cholinesterase 2920 ChEMBL 10.1016/j.ejmech.2018.02.002 10.7270/Q2XG9TP4 29438888 Chen, SC; Qiu, GL; Li, B; Shi, JB; Liu, XH; Tang, WJ Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50307397 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50307397&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46233427 104161758 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51032018 CC1Oc2c(Cl)cc(Cl)cc2C2CC(C)=NN2C1=O InChI=1S/C13H12Cl2N2O2/c1-6-3-11-9-4-8(14)5-10(15)12(9)19-7(2)13(18)17(11)16-6/h4-5,7,11H,3H2,1-2H3 YQDXODJOXXNSFT-UHFFFAOYSA-N 50308029 CHEMBL4159231 Cholinesterase 5950 ChEMBL 10.1016/j.ejmech.2018.02.002 10.7270/Q2XG9TP4 29438888 Chen, SC; Qiu, GL; Li, B; Shi, JB; Liu, XH; Tang, WJ Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50308029 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50308029&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46228604 104162390 ZINC45394567 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51032022 CCC1Oc2c(Cl)cc(Cl)cc2C2CC(C)=NN2C1=O InChI=1S/C14H14Cl2N2O2/c1-3-12-14(19)18-11(4-7(2)17-18)9-5-8(15)6-10(16)13(9)20-12/h5-6,11-12H,3-4H2,1-2H3 ATGXKSCIHUETFM-UHFFFAOYSA-N 50308061 CHEMBL4163091 Cholinesterase 4670 ChEMBL 10.1016/j.ejmech.2018.02.002 10.7270/Q2XG9TP4 29438888 Chen, SC; Qiu, GL; Li, B; Shi, JB; Liu, XH; Tang, WJ Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50308061 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50308061&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46228880 104162422 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51032021 CCC1Oc2c(Br)cc(Cl)cc2C2CC(C)=NN2C1=O InChI=1S/C14H14BrClN2O2/c1-3-12-14(19)18-11(4-7(2)17-18)9-5-8(16)6-10(15)13(9)20-12/h5-6,11-12H,3-4H2,1-2H3 GMUBTUZIZDTPNF-UHFFFAOYSA-N 50307814 CHEMBL4176194 Cholinesterase 2040 ChEMBL 10.1016/j.ejmech.2018.02.002 10.7270/Q2XG9TP4 29438888 Chen, SC; Qiu, GL; Li, B; Shi, JB; Liu, XH; Tang, WJ Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50307814 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50307814&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 17572266 104162175 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51032015 CC1Oc2c(Br)cc(Cl)cc2C2CC(C)=NN2C1=O InChI=1S/C13H12BrClN2O2/c1-6-3-11-9-4-8(15)5-10(14)12(9)19-7(2)13(18)17(11)16-6/h4-5,7,11H,3H2,1-2H3 QJKLJVOOGFRFBC-UHFFFAOYSA-N 50307988 CHEMBL4169003 Cholinesterase 11100 ChEMBL 10.1016/j.ejmech.2018.02.002 10.7270/Q2XG9TP4 29438888 Chen, SC; Qiu, GL; Li, B; Shi, JB; Liu, XH; Tang, WJ Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50307988 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50307988&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46228648 104162349 ZINC45375215 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51032016 CCC1Oc2ccc(Cl)cc2C2CC(C)=NN2C1=O InChI=1S/C14H15ClN2O2/c1-3-12-14(18)17-11(6-8(2)16-17)10-7-9(15)4-5-13(10)19-12/h4-5,7,11-12H,3,6H2,1-2H3 DEJNSWVCEXLTOE-UHFFFAOYSA-N 50308001 CHEMBL4173395 Cholinesterase 12830 ChEMBL 10.1016/j.ejmech.2018.02.002 10.7270/Q2XG9TP4 29438888 Chen, SC; Qiu, GL; Li, B; Shi, JB; Liu, XH; Tang, WJ Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50308001 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50308001&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46228468 104162362 ZINC45356574 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525123 CN(C)Cc1ccc(CSCCNc2ncccn2)o1 InChI=1S/C14H20N4OS/c1-18(2)10-12-4-5-13(19-12)11-20-9-8-17-14-15-6-3-7-16-14/h3-7H,8-11H2,1-2H3,(H,15,16,17) HOYUJCRHOOCRBJ-UHFFFAOYSA-N 50199144 CHEMBL3963436 Cholinesterase 7650 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199144 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199144&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134151044 375978518 CHEMBL3963436 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525124 CN(C)Cc1ccc(CSCCN\C(N\N=C\c2ccccc2)=C\[N+]([O-])=O)o1 InChI=1S/C19H25N5O3S/c1-23(2)13-17-8-9-18(27-17)15-28-11-10-20-19(14-24(25)26)22-21-12-16-6-4-3-5-7-16/h3-9,12,14,20,22H,10-11,13,15H2,1-2H3/b19-14-,21-12+ FSOZTTJYBBCOAV-RRKJHFEZSA-N 50199145 CHEMBL3923597 Cholinesterase 2960 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199145 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199145&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134140031 375978519 CHEMBL3923597 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525125 CC1CC(=O)N(CCSCc2ccc(CN(C)C)o2)C1=O InChI=1S/C15H22N2O3S/c1-11-8-14(18)17(15(11)19)6-7-21-10-13-5-4-12(20-13)9-16(2)3/h4-5,11H,6-10H2,1-3H3 QVWUPYIHRXPINQ-UHFFFAOYSA-N 50199146 CHEMBL3936203 Cholinesterase >50000 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199146 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199146&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134149165 375978520 CHEMBL3936203 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525126 CN(C)Cc1ccc(CSCCN2C(=O)c3cccc4cc(cc(C2=O)c34)[N+]([O-])=O)o1 InChI=1S/C22H21N3O5S/c1-23(2)12-16-6-7-17(30-16)13-31-9-8-24-21(26)18-5-3-4-14-10-15(25(28)29)11-19(20(14)18)22(24)27/h3-7,10-11H,8-9,12-13H2,1-2H3 CCHWVUBITQTPDB-UHFFFAOYSA-N 50199147 CHEMBL3963904 Cholinesterase 8010 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199147 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199147&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134149871 375978521 CHEMBL3963904 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525129 CN(C)Cc1ccc(CSCCNc2ncccc2C#N)o1 InChI=1S/C16H20N4OS/c1-20(2)11-14-5-6-15(21-14)12-22-9-8-19-16-13(10-17)4-3-7-18-16/h3-7H,8-9,11-12H2,1-2H3,(H,18,19) XPQARXHJKZMDKV-UHFFFAOYSA-N 50199150 CHEMBL3916017 Cholinesterase 8360 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199150 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199150&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134142586 375978524 CHEMBL3916017 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525130 CN(C)Cc1ccc(CSCCNc2nc(N)n[nH]2)o1 InChI=1S/C12H20N6OS/c1-18(2)7-9-3-4-10(19-9)8-20-6-5-14-12-15-11(13)16-17-12/h3-4H,5-8H2,1-2H3,(H4,13,14,15,16,17) MPCHFTDBRPKJLW-UHFFFAOYSA-N 50199151 CHEMBL3926121 Cholinesterase >50000 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199151 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199151&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 70570522 375978525 CHEMBL3926121 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525134 CN(C)Cc1ccc(CSCCNc2nnc(cc2[N+]([O-])=O)-c2ccccc2)o1 InChI=1S/C20H23N5O3S/c1-24(2)13-16-8-9-17(28-16)14-29-11-10-21-20-19(25(26)27)12-18(22-23-20)15-6-4-3-5-7-15/h3-9,12H,10-11,13-14H2,1-2H3,(H,21,23) PPRJNDSOOQGJSQ-UHFFFAOYSA-N 50199148 CHEMBL3917462 Cholinesterase 4460 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199148 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199148&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134142407 375978522 CHEMBL3917462 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525135 CN(C)Cc1ccc(CSCCN2C(=O)c3ccccc3C2=O)o1 InChI=1S/C18H20N2O3S/c1-19(2)11-13-7-8-14(23-13)12-24-10-9-20-17(21)15-5-3-4-6-16(15)18(20)22/h3-8H,9-12H2,1-2H3 VCCTWUFHIQYYHA-UHFFFAOYSA-N 50199155 CHEMBL3966045 Cholinesterase 14460 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199155 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199155&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14989504 375978529 CHEMBL3966045 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525137 CN(C)Cc1ccc(CSCCNC(=O)c2ccccc2Nc2cccc(C)c2C)o1 InChI=1S/C25H31N3O2S/c1-18-8-7-11-23(19(18)2)27-24-10-6-5-9-22(24)25(29)26-14-15-31-17-21-13-12-20(30-21)16-28(3)4/h5-13,27H,14-17H2,1-4H3,(H,26,29) LLIQKOOZFWEQHA-UHFFFAOYSA-N 50199156 CHEMBL3937756 Cholinesterase >50000 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199156 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199156&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134149087 375978530 CHEMBL3937756 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525155 CN(C)Cc1ccc(CSCCNc2nnccc2[N+]([O-])=O)o1 InChI=1S/C14H19N5O3S/c1-18(2)9-11-3-4-12(22-11)10-23-8-7-15-14-13(19(20)21)5-6-16-17-14/h3-6H,7-10H2,1-2H3,(H,15,17) YSANROTYHBNTDV-UHFFFAOYSA-N 50004659 CHEMBL321808::[2-(5-Dimethylaminomethyl-furan-2-ylmethylsulfanyl)-ethyl]-(4-nitro-pyridazin-3-yl)-amine Cholinesterase 10000 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50004659 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50004659&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 6410685 103918246 CHEMBL321808 ZINC52986907 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525156 CN(C)Cc1ccc(CSCCNc2nnc(c(C)c2[N+]([O-])=O)-c2ccccc2)o1 InChI=1S/C21H25N5O3S/c1-15-19(16-7-5-4-6-8-16)23-24-21(20(15)26(27)28)22-11-12-30-14-18-10-9-17(29-18)13-25(2)3/h4-10H,11-14H2,1-3H3,(H,22,24) MSJNFKAPNQYNLY-UHFFFAOYSA-N 50199161 CHEMBL3961411 Cholinesterase 3710 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199161 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199161&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134155892 375978535 CHEMBL3961411 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525157 CN(C)Cc1ccc(CSCCNc2nnc(-c3ccccc3)c(-c3ccccc3)c2[N+]([O-])=O)o1 InChI=1S/C26H27N5O3S/c1-30(2)17-21-13-14-22(34-21)18-35-16-15-27-26-25(31(32)33)23(19-9-5-3-6-10-19)24(28-29-26)20-11-7-4-8-12-20/h3-14H,15-18H2,1-2H3,(H,27,29) WUSIWPKVWUINMQ-UHFFFAOYSA-N 50199163 CHEMBL3952735 Cholinesterase 7050 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199163 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199163&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134145002 375978537 CHEMBL3952735 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525158 CN(C)Cc1ccc(CSCCNc2ccc(Cl)nn2)o1 InChI=1S/C14H19ClN4OS/c1-19(2)9-11-3-4-12(20-11)10-21-8-7-16-14-6-5-13(15)17-18-14/h3-6H,7-10H2,1-2H3,(H,16,18) RRKVWPOGWSUACU-UHFFFAOYSA-N 50199152 CHEMBL3935020 Cholinesterase >50000 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199152 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199152&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134149640 375978526 CHEMBL3935020 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525159 CN(C)Cc1ccc(CSCCNc2nc(N)no2)o1 InChI=1S/C12H19N5O2S/c1-17(2)7-9-3-4-10(18-9)8-20-6-5-14-12-15-11(13)16-19-12/h3-4H,5-8H2,1-2H3,(H3,13,14,15,16) UJTCZUNUEVQHAB-UHFFFAOYSA-N 50199168 CHEMBL3897419 Cholinesterase >50000 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199168 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199168&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 13486642 375978542 CHEMBL3897419 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525160 CN(C)Cc1ccc(CSCCN\C(=C\[N+]([O-])=O)N2CCCCC2)o1 InChI=1S/C17H28N4O3S/c1-19(2)12-15-6-7-16(24-15)14-25-11-8-18-17(13-21(22)23)20-9-4-3-5-10-20/h6-7,13,18H,3-5,8-12,14H2,1-2H3/b17-13- NMBJWVPNYHGHCZ-LGMDPLHJSA-N 50199164 CHEMBL3941167 Cholinesterase 21180 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199164 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199164&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134145897 375978538 CHEMBL3941167 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525161 CN(C)Cc1ccc(CSCCN2\C(NN=C(C)C2=C)=C\[N+]([O-])=O)o1 InChI=1S/C16H23N5O3S/c1-12-13(2)20(16(18-17-12)10-21(22)23)7-8-25-11-15-6-5-14(24-15)9-19(3)4/h5-6,10,18H,2,7-9,11H2,1,3-4H3/b16-10+ NSEPRNDDKDBSKO-MHWRWJLKSA-N 50199169 CHEMBL3928312 Cholinesterase 7100 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199169 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199169&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134141323 375978543 CHEMBL3928312 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525162 CN(C)Cc1ccc(CSCCNC(=O)c2ccccc2-c2ccccc2C(O)=O)o1 InChI=1S/C24H26N2O4S/c1-26(2)15-17-11-12-18(30-17)16-31-14-13-25-23(27)21-9-5-3-7-19(21)20-8-4-6-10-22(20)24(28)29/h3-12H,13-16H2,1-2H3,(H,25,27)(H,28,29) JMPSCUAHFPGFPC-UHFFFAOYSA-N 50199166 CHEMBL3918300 Cholinesterase >50000 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199166 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199166&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134139116 375978540 CHEMBL3918300 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525163 CN(C)Cc1ccc(CSCCN2C(=O)c3cccc(c3C2=O)[N+]([O-])=O)o1 InChI=1S/C18H19N3O5S/c1-19(2)10-12-6-7-13(26-12)11-27-9-8-20-17(22)14-4-3-5-15(21(24)25)16(14)18(20)23/h3-7H,8-11H2,1-2H3 WRBRONXILRDHPO-UHFFFAOYSA-N 50199158 CHEMBL3971565 Cholinesterase >50000 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199158 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199158&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134153325 375978532 CHEMBL3971565 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525164 CN(C)Cc1ccc(CSCCN2C(=O)c3cccc4cccc(C2=O)c34)o1 InChI=1S/C22H22N2O3S/c1-23(2)13-16-9-10-17(27-16)14-28-12-11-24-21(25)18-7-3-5-15-6-4-8-19(20(15)18)22(24)26/h3-10H,11-14H2,1-2H3 FTVPEZRHKZRFIN-UHFFFAOYSA-N 50199170 CHEMBL3979679 Cholinesterase 7210 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199170 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199170&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134152749 375978544 CHEMBL3979679 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525166 CN(C)Cc1ccc(CSCCNc2nnc(C)cc2[N+]([O-])=O)o1 InChI=1S/C15H21N5O3S/c1-11-8-14(20(21)22)15(18-17-11)16-6-7-24-10-13-5-4-12(23-13)9-19(2)3/h4-5,8H,6-7,9-10H2,1-3H3,(H,16,18) FUXOILYHKCWHNQ-UHFFFAOYSA-N 50199157 CHEMBL3921095 Cholinesterase 28400 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199157 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199157&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134139180 375978531 CHEMBL3921095 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525167 CN(C)Cc1ccc(CSCCNC(=O)Cc2ccccc2Nc2c(Cl)cccc2Cl)o1 InChI=1S/C24H27Cl2N3O2S/c1-29(2)15-18-10-11-19(31-18)16-32-13-12-27-23(30)14-17-6-3-4-9-22(17)28-24-20(25)7-5-8-21(24)26/h3-11,28H,12-16H2,1-2H3,(H,27,30) JEGJNMBJZAPUIM-UHFFFAOYSA-N 50199159 CHEMBL3927243 Cholinesterase 7650 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199159 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199159&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134140720 375978533 CHEMBL3927243 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525171 CCc1nnc(NCCSCc2ccc(CN(C)C)o2)c(c1CC)[N+]([O-])=O InChI=1S/C18H27N5O3S/c1-5-15-16(6-2)20-21-18(17(15)23(24)25)19-9-10-27-12-14-8-7-13(26-14)11-22(3)4/h7-8H,5-6,9-12H2,1-4H3,(H,19,21) ORVJJVVWQZKXFQ-UHFFFAOYSA-N 50199153 CHEMBL3893982 Cholinesterase 18800 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199153 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199153&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134137052 375978527 CHEMBL3893982 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525172 CN(C)Cc1ccc(CSCCNc2nncc(-c3ccccc3)c2[N+]([O-])=O)o1 InChI=1S/C20H23N5O3S/c1-24(2)13-16-8-9-17(28-16)14-29-11-10-21-20-19(25(26)27)18(12-22-23-20)15-6-4-3-5-7-15/h3-9,12H,10-11,13-14H2,1-2H3,(H,21,23) YRTBGGCOWNKYBD-UHFFFAOYSA-N 50199171 CHEMBL3944527 Cholinesterase 22700 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199171 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199171&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134145678 375978545 CHEMBL3944527 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525173 CN(C)Cc1ccc(CSCCNc2nnc(-c3cccs3)c(-c3cccs3)c2[N+]([O-])=O)o1 InChI=1S/C22H23N5O3S3/c1-26(2)13-15-7-8-16(30-15)14-31-12-9-23-22-21(27(28)29)19(17-5-3-10-32-17)20(24-25-22)18-6-4-11-33-18/h3-8,10-11H,9,12-14H2,1-2H3,(H,23,25) FMDKBRZGISLHJQ-UHFFFAOYSA-N 50199194 CHEMBL3925028 Cholinesterase 2280 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199194 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199194&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134141372 375978546 CHEMBL3925028 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525174 CS\C(NCCSCc1ccc(CN(C)C)o1)=N/S(=O)(=O)c1ccc(C)cc1 InChI=1S/C19H27N3O3S3/c1-15-5-9-18(10-6-15)28(23,24)21-19(26-4)20-11-12-27-14-17-8-7-16(25-17)13-22(2)3/h5-10H,11-14H2,1-4H3,(H,20,21) VAFHYMWCORIRPP-UHFFFAOYSA-N 50199154 CHEMBL3911088 Cholinesterase >50000 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199154 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199154&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134132168 375978528 CHEMBL3911088 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525175 CN(C)Cc1ccc(CSCCN2C(=O)CCC2=O)o1 InChI=1S/C14H20N2O3S/c1-15(2)9-11-3-4-12(19-11)10-20-8-7-16-13(17)5-6-14(16)18/h3-4H,5-10H2,1-2H3 BPGXGVFTAMAZHI-UHFFFAOYSA-N 50199149 CHEMBL3954887 Cholinesterase >50000 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199149 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199149&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134144943 375978523 CHEMBL3954887 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525176 CN(C)Cc1ccc(CSCCN2C(=O)c3ccc(cc3C2=O)[N+]([O-])=O)o1 InChI=1S/C18H19N3O5S/c1-19(2)10-13-4-5-14(26-13)11-27-8-7-20-17(22)15-6-3-12(21(24)25)9-16(15)18(20)23/h3-6,9H,7-8,10-11H2,1-2H3 AJFBCSHQVYMJOM-UHFFFAOYSA-N 50199167 CHEMBL3912004 Cholinesterase >50000 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199167 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199167&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134132928 375978541 CHEMBL3912004 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50525177 CN(C)Cc1ccc(CSCCNS(=O)(=O)c2ccc(C)cc2)o1 InChI=1S/C17H24N2O3S2/c1-14-4-8-17(9-5-14)24(20,21)18-10-11-23-13-16-7-6-15(22-16)12-19(2)3/h4-9,18H,10-13H2,1-3H3 WHNXBZQVRSNALD-UHFFFAOYSA-N 50199165 CHEMBL3937312 Cholinesterase 47210 ChEMBL 10.1016/j.bmcl.2016.09.072 10.7270/Q22F7QDF 27769620 Gao, J; Midde, N; Zhu, J; Terry, AV; McInnes, C; Chapman, JM University of South Carolina http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50199165 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50199165&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134148908 375978539 CHEMBL3937312 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553743 COc1cc2C\C(=C/c3ccc(cc3)N3CCN(CC3)C(c3ccccc3)c3ccccc3)C(=O)c2cc1OC InChI=1S/C35H34N2O3/c1-39-32-23-28-22-29(35(38)31(28)24-33(32)40-2)21-25-13-15-30(16-14-25)36-17-19-37(20-18-36)34(26-9-5-3-6-10-26)27-11-7-4-8-12-27/h3-16,21,23-24,34H,17-20,22H2,1-2H3/b29-21+ NXGWLNGXJVZMNN-XHLNEMQHSA-N 50210873 CHEMBL3944195 Cholinesterase 4894 ChEMBL 10.1016/j.ejmech.2016.09.057 10.7270/Q2Z89FJ1 27721157 Mishra, CB; Kumari, S; Manral, A; Prakash, A; Saini, V; Lynn, AM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210873 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210873&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134145849 375982836 CHEMBL3944195 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553745 COc1cc2C\C(=C/c3ccc(cc3)N3CCN(Cc4ccc5OCOc5c4)CC3)C(=O)c2cc1OC InChI=1S/C30H30N2O5/c1-34-27-16-22-15-23(30(33)25(22)17-28(27)35-2)13-20-3-6-24(7-4-20)32-11-9-31(10-12-32)18-21-5-8-26-29(14-21)37-19-36-26/h3-8,13-14,16-17H,9-12,15,18-19H2,1-2H3/b23-13+ SRRFJOCTTBPYJP-YDZHTSKRSA-N 50210874 CHEMBL3961645 Cholinesterase 12220 ChEMBL 10.1016/j.ejmech.2016.09.057 10.7270/Q2Z89FJ1 27721157 Mishra, CB; Kumari, S; Manral, A; Prakash, A; Saini, V; Lynn, AM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210874 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210874&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134155402 375982837 CHEMBL3961645 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553747 COc1ccc(cc1)N1CCN(CC1)c1ccc(\C=C2/Cc3cc(OC)c(OC)cc3C2=O)cc1 InChI=1S/C29H30N2O4/c1-33-25-10-8-24(9-11-25)31-14-12-30(13-15-31)23-6-4-20(5-7-23)16-22-17-21-18-27(34-2)28(35-3)19-26(21)29(22)32/h4-11,16,18-19H,12-15,17H2,1-3H3/b22-16+ PFBGRAGAHSGCNL-CJLVFECKSA-N 50210870 CHEMBL3902217 Cholinesterase 603 ChEMBL 10.1016/j.ejmech.2016.09.057 10.7270/Q2Z89FJ1 27721157 Mishra, CB; Kumari, S; Manral, A; Prakash, A; Saini, V; Lynn, AM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210870 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210870&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134134995 375982833 CHEMBL3902217 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553748 COc1cc2C\C(=C/c3ccc(cc3)N3CCN(CC3)C(=O)c3ccoc3)C(=O)c2cc1OC InChI=1S/C27H26N2O5/c1-32-24-15-20-14-21(26(30)23(20)16-25(24)33-2)13-18-3-5-22(6-4-18)28-8-10-29(11-9-28)27(31)19-7-12-34-17-19/h3-7,12-13,15-17H,8-11,14H2,1-2H3/b21-13+ CLLAPNVNWRFKIB-FYJGNVAPSA-N 50210869 CHEMBL3913721 Cholinesterase 1969 ChEMBL 10.1016/j.ejmech.2016.09.057 10.7270/Q2Z89FJ1 27721157 Mishra, CB; Kumari, S; Manral, A; Prakash, A; Saini, V; Lynn, AM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210869 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210869&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134142133 375982832 CHEMBL3913721 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553750 COc1cc2C\C(=C/c3ccc(cc3)N3CCN(CC3)c3ncccn3)C(=O)c2cc1OC InChI=1S/C26H26N4O3/c1-32-23-16-19-15-20(25(31)22(19)17-24(23)33-2)14-18-4-6-21(7-5-18)29-10-12-30(13-11-29)26-27-8-3-9-28-26/h3-9,14,16-17H,10-13,15H2,1-2H3/b20-14+ XMWPTWSKZWNVFU-XSFVSMFZSA-N 50210876 CHEMBL3951861 Cholinesterase 2434 ChEMBL 10.1016/j.ejmech.2016.09.057 10.7270/Q2Z89FJ1 27721157 Mishra, CB; Kumari, S; Manral, A; Prakash, A; Saini, V; Lynn, AM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210876 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210876&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134143791 375982839 CHEMBL3951861 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553752 COc1cc2C\C(=C/c3ccc(cc3)N3CCN(CC3)c3ccccc3)C(=O)c2cc1OC InChI=1S/C28H28N2O3/c1-32-26-18-21-17-22(28(31)25(21)19-27(26)33-2)16-20-8-10-24(11-9-20)30-14-12-29(13-15-30)23-6-4-3-5-7-23/h3-11,16,18-19H,12-15,17H2,1-2H3/b22-16+ IFPARRBNOVWNHQ-CJLVFECKSA-N 50210839 CHEMBL3965447 Cholinesterase 5980 ChEMBL 10.1016/j.ejmech.2016.09.057 10.7270/Q2Z89FJ1 27721157 Mishra, CB; Kumari, S; Manral, A; Prakash, A; Saini, V; Lynn, AM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210839 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210839&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134150769 375982802 CHEMBL3965447 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553753 COc1cc2C\C(=C/c3ccc(cc3)N3CCN(CC3)c3ccc(C)cc3)C(=O)c2cc1OC InChI=1S/C29H30N2O3/c1-20-4-8-24(9-5-20)30-12-14-31(15-13-30)25-10-6-21(7-11-25)16-23-17-22-18-27(33-2)28(34-3)19-26(22)29(23)32/h4-11,16,18-19H,12-15,17H2,1-3H3/b23-16+ GYJIYEYMALSDQT-XQNSMLJCSA-N 50210836 CHEMBL3930181 Cholinesterase 1849 ChEMBL 10.1016/j.ejmech.2016.09.057 10.7270/Q2Z89FJ1 27721157 Mishra, CB; Kumari, S; Manral, A; Prakash, A; Saini, V; Lynn, AM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210836 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210836&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134138056 375982799 CHEMBL3930181 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553754 COc1cc2C\C(=C/c3ccc(cc3)N3CCN(CC3)c3ccccn3)C(=O)c2cc1OC InChI=1S/C27H27N3O3/c1-32-24-17-20-16-21(27(31)23(20)18-25(24)33-2)15-19-6-8-22(9-7-19)29-11-13-30(14-12-29)26-5-3-4-10-28-26/h3-10,15,17-18H,11-14,16H2,1-2H3/b21-15+ QOFPZQJTZFMACG-RCCKNPSSSA-N 50210877 CHEMBL3972686 Cholinesterase 1735 ChEMBL 10.1016/j.ejmech.2016.09.057 10.7270/Q2Z89FJ1 27721157 Mishra, CB; Kumari, S; Manral, A; Prakash, A; Saini, V; Lynn, AM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210877 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210877&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134153021 375982840 CHEMBL3972686 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553757 COc1cc2C\C(=C/c3ccc(cc3)N3CCN(CC3)c3ccc(F)cc3)C(=O)c2cc1OC InChI=1S/C28H27FN2O3/c1-33-26-17-20-16-21(28(32)25(20)18-27(26)34-2)15-19-3-7-23(8-4-19)30-11-13-31(14-12-30)24-9-5-22(29)6-10-24/h3-10,15,17-18H,11-14,16H2,1-2H3/b21-15+ GCCJENNIBYDMMU-RCCKNPSSSA-N 50210840 CHEMBL3971579 Cholinesterase 3245 ChEMBL 10.1016/j.ejmech.2016.09.057 10.7270/Q2Z89FJ1 27721157 Mishra, CB; Kumari, S; Manral, A; Prakash, A; Saini, V; Lynn, AM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210840 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210840&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134153631 375982803 CHEMBL3971579 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553759 COc1cc2C\C(=C/c3ccc(cc3)N3CCN(CC3)C(=O)c3ccccc3)C(=O)c2cc1OC InChI=1S/C29H28N2O4/c1-34-26-18-22-17-23(28(32)25(22)19-27(26)35-2)16-20-8-10-24(11-9-20)30-12-14-31(15-13-30)29(33)21-6-4-3-5-7-21/h3-11,16,18-19H,12-15,17H2,1-2H3/b23-16+ GJSRQFLUIYWOGE-XQNSMLJCSA-N 50210871 CHEMBL3964617 Cholinesterase 365 ChEMBL 10.1016/j.ejmech.2016.09.057 10.7270/Q2Z89FJ1 27721157 Mishra, CB; Kumari, S; Manral, A; Prakash, A; Saini, V; Lynn, AM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210871 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210871&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134151060 375982834 CHEMBL3964617 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553761 COc1cc2C\C(=C/c3ccc(cc3)N3CCN(CC3)C(c3ccc(F)cc3)c3ccc(F)cc3)C(=O)c2cc1OC InChI=1S/C35H32F2N2O3/c1-41-32-21-26-20-27(35(40)31(26)22-33(32)42-2)19-23-3-13-30(14-4-23)38-15-17-39(18-16-38)34(24-5-9-28(36)10-6-24)25-7-11-29(37)12-8-25/h3-14,19,21-22,34H,15-18,20H2,1-2H3/b27-19+ KQEGLCPCHZZSTI-ZXVVBBHZSA-N 50210841 CHEMBL3925265 Cholinesterase 3015 ChEMBL 10.1016/j.ejmech.2016.09.057 10.7270/Q2Z89FJ1 27721157 Mishra, CB; Kumari, S; Manral, A; Prakash, A; Saini, V; Lynn, AM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210841 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210841&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134140987 375982804 CHEMBL3925265 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553762 COc1cc2C\C(=C/c3ccc(cc3)N3CCN(CC3)c3ccc(cc3)C(F)(F)F)C(=O)c2cc1OC InChI=1S/C29H27F3N2O3/c1-36-26-17-20-16-21(28(35)25(20)18-27(26)37-2)15-19-3-7-23(8-4-19)33-11-13-34(14-12-33)24-9-5-22(6-10-24)29(30,31)32/h3-10,15,17-18H,11-14,16H2,1-2H3/b21-15+ FZPXTPYRSIVANH-RCCKNPSSSA-N 50210872 CHEMBL3893238 Cholinesterase 214 ChEMBL 10.1016/j.ejmech.2016.09.057 10.7270/Q2Z89FJ1 27721157 Mishra, CB; Kumari, S; Manral, A; Prakash, A; Saini, V; Lynn, AM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210872 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210872&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134137483 375982835 CHEMBL3893238 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553763 COc1cc2C\C(=C/c3ccc(cc3)N3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C29H30N2O3/c1-33-27-18-23-17-24(29(32)26(23)19-28(27)34-2)16-21-8-10-25(11-9-21)31-14-12-30(13-15-31)20-22-6-4-3-5-7-22/h3-11,16,18-19H,12-15,17,20H2,1-2H3/b24-16+ NYBIPXIIXVHVMZ-LFVJCYFKSA-N 50210875 CHEMBL3934144 Cholinesterase 88 ChEMBL 10.1016/j.ejmech.2016.09.057 10.7270/Q2Z89FJ1 27721157 Mishra, CB; Kumari, S; Manral, A; Prakash, A; Saini, V; Lynn, AM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210875 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210875&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134138719 375982838 CHEMBL3934144 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553764 COc1cc2C\C(=C/c3ccc(cc3)N3CCN(CC3)c3ccc(Cl)cc3)C(=O)c2cc1OC InChI=1S/C28H27ClN2O3/c1-33-26-17-20-16-21(28(32)25(20)18-27(26)34-2)15-19-3-7-23(8-4-19)30-11-13-31(14-12-30)24-9-5-22(29)6-10-24/h3-10,15,17-18H,11-14,16H2,1-2H3/b21-15+ WECLIDKVWNHQFP-RCCKNPSSSA-N 50210838 CHEMBL3955339 Cholinesterase 2219 ChEMBL 10.1016/j.ejmech.2016.09.057 10.7270/Q2Z89FJ1 27721157 Mishra, CB; Kumari, S; Manral, A; Prakash, A; Saini, V; Lynn, AM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210838 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210838&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134144746 375982801 CHEMBL3955339 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553765 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 3360 ChEMBL 10.1016/j.ejmech.2016.09.057 10.7270/Q2Z89FJ1 27721157 Mishra, CB; Kumari, S; Manral, A; Prakash, A; Saini, V; Lynn, AM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50531610 C[C@H]1CC[C@@]2(C)[C@@H](CCC=C2C)[C@]1(C)Cc1cc(O)cc(Sc2ccccc2C(O)=O)c1O InChI=1S/C28H34O4S/c1-17-8-7-11-24-27(17,3)13-12-18(2)28(24,4)16-19-14-20(29)15-23(25(19)30)33-22-10-6-5-9-21(22)26(31)32/h5-6,8-10,14-15,18,24,29-30H,7,11-13,16H2,1-4H3,(H,31,32)/t18-,24+,27+,28+/m0/s1 PXYOTUPOITWOPU-JWNPUDRZSA-N 50204086 Avarol-3''-Thiosalicylate::CHEMBL238756 Cholinesterase 15140 ChEMBL 10.1016/j.ejmech.2016.06.036 10.7270/Q2QJ7K8X 27376495 Tommonaro, G; García-Font, N; Vitale, RM; Pejin, B; Iodice, C; Cañadas, S; Marco-Contelles, J; Oset-Gasque, MJ Istituto di Chimica Biomolecolare (ICB) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50204086 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50204086&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11442705 375980337 CHEMBL238756 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50531616 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 1.2 ChEMBL 10.1016/j.ejmech.2016.06.036 10.7270/Q2QJ7K8X 27376495 Tommonaro, G; García-Font, N; Vitale, RM; Pejin, B; Iodice, C; Cañadas, S; Marco-Contelles, J; Oset-Gasque, MJ Istituto di Chimica Biomolecolare (ICB) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50531617 CC(C)=CCC\C(C)=C\CC\C(C)=C\CC\C(C)=C\Cc1cc(O)cc(Sc2ccccc2C(O)=O)c1O InChI=1S/C33H42O4S/c1-23(2)11-8-12-24(3)13-9-14-25(4)15-10-16-26(5)19-20-27-21-28(34)22-31(32(27)35)38-30-18-7-6-17-29(30)33(36)37/h6-7,11,13,15,17-19,21-22,34-35H,8-10,12,14,16,20H2,1-5H3,(H,36,37)/b24-13+,25-15+,26-19+ UQMZRNVNHHEEKU-HEKOIHICSA-N 50204090 CHEMBL3958859 Cholinesterase 19700 ChEMBL 10.1016/j.ejmech.2016.06.036 10.7270/Q2QJ7K8X 27376495 Tommonaro, G; García-Font, N; Vitale, RM; Pejin, B; Iodice, C; Cañadas, S; Marco-Contelles, J; Oset-Gasque, MJ Istituto di Chimica Biomolecolare (ICB) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50204090 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50204090&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134155734 375980341 CHEMBL3958859 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50531618 CC(C)CCCC(C)CCCC(C)CCC\C(C)=C\Cc1cc(O)cc(Sc2ccccc2C(O)=O)c1O InChI=1S/C33H48O4S/c1-23(2)11-8-12-24(3)13-9-14-25(4)15-10-16-26(5)19-20-27-21-28(34)22-31(32(27)35)38-30-18-7-6-17-29(30)33(36)37/h6-7,17-19,21-25,34-35H,8-16,20H2,1-5H3,(H,36,37)/b26-19+ QIXJMCNCXLOJKZ-LGUFXXKBSA-N 50204091 CHEMBL3922437 Cholinesterase 12850 ChEMBL 10.1016/j.ejmech.2016.06.036 10.7270/Q2QJ7K8X 27376495 Tommonaro, G; García-Font, N; Vitale, RM; Pejin, B; Iodice, C; Cañadas, S; Marco-Contelles, J; Oset-Gasque, MJ Istituto di Chimica Biomolecolare (ICB) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50204091 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50204091&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134140191 375980342 CHEMBL3922437 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543702 CN(CCN1CCN(CC1)c1cccc2n(ccc12)S(=O)(=O)c1ccccc1)Cc1ccccc1 InChI=1S/C28H32N4O2S/c1-29(23-24-9-4-2-5-10-24)17-18-30-19-21-31(22-20-30)27-13-8-14-28-26(27)15-16-32(28)35(33,34)25-11-6-3-7-12-25/h2-16H,17-23H2,1H3 JSDWYKAIOMNQMQ-UHFFFAOYSA-N 50208212 CHEMBL3883443 Cholinesterase 1951 ChEMBL 10.1016/j.ejmech.2016.08.016 10.7270/Q2PZ5BT8 27560283 Wieckowska, A; Kolaczkowski, M; Bucki, A; Godyn, J; Marcinkowska, M; Wieckowski, K; Zareba, P; Siwek, A; Kazek, G; Gluch-Lutwin, M; Mierzejewski, P; Bienkowski, P; Sienkiewicz-Jarosz, H; Knez, D; Wichur, T; Gobec, S; Malawska, B Jagiellonian University Collegium Medicum http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208212 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208212&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134130529 375981938 CHEMBL3883443 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543703 Cl.O=S(=O)(c1ccccc1)n1ccc2c(cccc12)N1CCN(CCCCNC2CCN(Cc3ccccc3)CC2)CC1 InChI=1S/C34H43N5O2S/c40-42(41,31-12-5-2-6-13-31)39-23-18-32-33(14-9-15-34(32)39)38-26-24-36(25-27-38)20-8-7-19-35-30-16-21-37(22-17-30)28-29-10-3-1-4-11-29/h1-6,9-15,18,23,30,35H,7-8,16-17,19-22,24-28H2 LBIUELMDDBHRGI-UHFFFAOYSA-N 50208213 CHEMBL3884254 Cholinesterase 2163 ChEMBL 10.1016/j.ejmech.2016.08.016 10.7270/Q2PZ5BT8 27560283 Wieckowska, A; Kolaczkowski, M; Bucki, A; Godyn, J; Marcinkowska, M; Wieckowski, K; Zareba, P; Siwek, A; Kazek, G; Gluch-Lutwin, M; Mierzejewski, P; Bienkowski, P; Sienkiewicz-Jarosz, H; Knez, D; Wichur, T; Gobec, S; Malawska, B Jagiellonian University Collegium Medicum http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208213 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208213&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134130034 375981939 CHEMBL3884254 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543709 O=S(=O)(c1ccccc1)n1ccc2c(cccc12)N1CCN(CCCNC2CCN(Cc3ccccc3)CC2)CC1 InChI=1S/C33H41N5O2S/c39-41(40,30-11-5-2-6-12-30)38-22-17-31-32(13-7-14-33(31)38)37-25-23-35(24-26-37)19-8-18-34-29-15-20-36(21-16-29)27-28-9-3-1-4-10-28/h1-7,9-14,17,22,29,34H,8,15-16,18-21,23-27H2 OJFCLAACSLBCMO-UHFFFAOYSA-N 50208217 CHEMBL3884195 Cholinesterase 3217 ChEMBL 10.1016/j.ejmech.2016.08.016 10.7270/Q2PZ5BT8 27560283 Wieckowska, A; Kolaczkowski, M; Bucki, A; Godyn, J; Marcinkowska, M; Wieckowski, K; Zareba, P; Siwek, A; Kazek, G; Gluch-Lutwin, M; Mierzejewski, P; Bienkowski, P; Sienkiewicz-Jarosz, H; Knez, D; Wichur, T; Gobec, S; Malawska, B Jagiellonian University Collegium Medicum http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208217 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208217&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134130920 375981943 CHEMBL3884195 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543755 CN(CCCCCN1CCN(CC1)c1cccc2n(ccc12)S(=O)(=O)c1ccccc1)Cc1ccccc1 InChI=1S/C31H38N4O2S/c1-32(26-27-12-5-2-6-13-27)19-9-4-10-20-33-22-24-34(25-23-33)30-16-11-17-31-29(30)18-21-35(31)38(36,37)28-14-7-3-8-15-28/h2-3,5-8,11-18,21H,4,9-10,19-20,22-26H2,1H3 LRYIOSWYNHIQPO-UHFFFAOYSA-N 50208257 CHEMBL3884709 Cholinesterase 3071 ChEMBL 10.1016/j.ejmech.2016.08.016 10.7270/Q2PZ5BT8 27560283 Wieckowska, A; Kolaczkowski, M; Bucki, A; Godyn, J; Marcinkowska, M; Wieckowski, K; Zareba, P; Siwek, A; Kazek, G; Gluch-Lutwin, M; Mierzejewski, P; Bienkowski, P; Sienkiewicz-Jarosz, H; Knez, D; Wichur, T; Gobec, S; Malawska, B Jagiellonian University Collegium Medicum http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208257 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208257&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134130058 375981950 CHEMBL3884709 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543761 O=S(=O)(c1ccccc1)n1ccc2c(cccc12)N1CCN(CCNc2c3CCCCc3nc3ccccc23)CC1 InChI=1S/C33H35N5O2S/c39-41(40,25-9-2-1-3-10-25)38-19-17-28-31(15-8-16-32(28)38)37-23-21-36(22-24-37)20-18-34-33-26-11-4-6-13-29(26)35-30-14-7-5-12-27(30)33/h1-4,6,8-11,13,15-17,19H,5,7,12,14,18,20-24H2,(H,34,35) HFXNFOSTKCPMIS-UHFFFAOYSA-N 50208260 CHEMBL3884988 Cholinesterase 17 ChEMBL 10.1016/j.ejmech.2016.08.016 10.7270/Q2PZ5BT8 27560283 Wieckowska, A; Kolaczkowski, M; Bucki, A; Godyn, J; Marcinkowska, M; Wieckowski, K; Zareba, P; Siwek, A; Kazek, G; Gluch-Lutwin, M; Mierzejewski, P; Bienkowski, P; Sienkiewicz-Jarosz, H; Knez, D; Wichur, T; Gobec, S; Malawska, B Jagiellonian University Collegium Medicum http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208260 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208260&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134130116 375981953 CHEMBL3884988 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543762 O=S(=O)(c1ccccc1)n1ccc2c(cccc12)N1CCN(CCCCCNc2c3CCCCc3nc3ccccc23)CC1 InChI=1S/C36H41N5O2S/c42-44(43,28-12-3-1-4-13-28)41-23-20-31-34(18-11-19-35(31)41)40-26-24-39(25-27-40)22-10-2-9-21-37-36-29-14-5-7-16-32(29)38-33-17-8-6-15-30(33)36/h1,3-5,7,11-14,16,18-20,23H,2,6,8-10,15,17,21-22,24-27H2,(H,37,38) QVMOLXHRHHMTTI-UHFFFAOYSA-N 50208214 CHEMBL3884858 Cholinesterase 21 ChEMBL 10.1016/j.ejmech.2016.08.016 10.7270/Q2PZ5BT8 27560283 Wieckowska, A; Kolaczkowski, M; Bucki, A; Godyn, J; Marcinkowska, M; Wieckowski, K; Zareba, P; Siwek, A; Kazek, G; Gluch-Lutwin, M; Mierzejewski, P; Bienkowski, P; Sienkiewicz-Jarosz, H; Knez, D; Wichur, T; Gobec, S; Malawska, B Jagiellonian University Collegium Medicum http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208214 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208214&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134130069 375981940 CHEMBL3884858 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543763 O=S(=O)(c1ccccc1)n1ccc2c(cccc12)N1CCN(CCCCCCCNc2c3CCCCc3nc3ccccc23)CC1 InChI=1S/C38H45N5O2S/c44-46(45,30-14-5-4-6-15-30)43-25-22-33-36(20-13-21-37(33)43)42-28-26-41(27-29-42)24-12-3-1-2-11-23-39-38-31-16-7-9-18-34(31)40-35-19-10-8-17-32(35)38/h4-7,9,13-16,18,20-22,25H,1-3,8,10-12,17,19,23-24,26-29H2,(H,39,40) QVCWJIWRPGTNSS-UHFFFAOYSA-N 50208216 CHEMBL3884690 Cholinesterase 10.0 ChEMBL 10.1016/j.ejmech.2016.08.016 10.7270/Q2PZ5BT8 27560283 Wieckowska, A; Kolaczkowski, M; Bucki, A; Godyn, J; Marcinkowska, M; Wieckowski, K; Zareba, P; Siwek, A; Kazek, G; Gluch-Lutwin, M; Mierzejewski, P; Bienkowski, P; Sienkiewicz-Jarosz, H; Knez, D; Wichur, T; Gobec, S; Malawska, B Jagiellonian University Collegium Medicum http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208216 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208216&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134131347 375981942 CHEMBL3884690 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543764 O=S(=O)(c1ccccc1)n1ccc2c(cccc12)N1CCN(CCNCc2ccccc2)CC1 InChI=1S/C27H30N4O2S/c32-34(33,24-10-5-2-6-11-24)31-16-14-25-26(12-7-13-27(25)31)30-20-18-29(19-21-30)17-15-28-22-23-8-3-1-4-9-23/h1-14,16,28H,15,17-22H2 RMGARRVNUBPKJI-UHFFFAOYSA-N 50208261 CHEMBL3885452 Cholinesterase 1307 ChEMBL 10.1016/j.ejmech.2016.08.016 10.7270/Q2PZ5BT8 27560283 Wieckowska, A; Kolaczkowski, M; Bucki, A; Godyn, J; Marcinkowska, M; Wieckowski, K; Zareba, P; Siwek, A; Kazek, G; Gluch-Lutwin, M; Mierzejewski, P; Bienkowski, P; Sienkiewicz-Jarosz, H; Knez, D; Wichur, T; Gobec, S; Malawska, B Jagiellonian University Collegium Medicum http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208261 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208261&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134130472 375981954 CHEMBL3885452 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543766 O=S(=O)(c1ccccc1)n1ccc2c(cccc12)N1CCN(CCCCNCc2ccccc2)CC1 InChI=1S/C29H34N4O2S/c34-36(35,26-12-5-2-6-13-26)33-19-16-27-28(14-9-15-29(27)33)32-22-20-31(21-23-32)18-8-7-17-30-24-25-10-3-1-4-11-25/h1-6,9-16,19,30H,7-8,17-18,20-24H2 NBBRVXGVAVZCJM-UHFFFAOYSA-N 50208262 CHEMBL3884312 Cholinesterase 2211 ChEMBL 10.1016/j.ejmech.2016.08.016 10.7270/Q2PZ5BT8 27560283 Wieckowska, A; Kolaczkowski, M; Bucki, A; Godyn, J; Marcinkowska, M; Wieckowski, K; Zareba, P; Siwek, A; Kazek, G; Gluch-Lutwin, M; Mierzejewski, P; Bienkowski, P; Sienkiewicz-Jarosz, H; Knez, D; Wichur, T; Gobec, S; Malawska, B Jagiellonian University Collegium Medicum http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208262 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208262&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134130197 375981955 CHEMBL3884312 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543767 O=S(=O)(c1ccccc1)n1ccc2c(cccc12)N1CCN(CCNC2CCN(Cc3ccccc3)C2)CC1 InChI=1S/C31H37N5O2S/c37-39(38,28-10-5-2-6-11-28)36-18-15-29-30(12-7-13-31(29)36)35-22-20-33(21-23-35)19-16-32-27-14-17-34(25-27)24-26-8-3-1-4-9-26/h1-13,15,18,27,32H,14,16-17,19-25H2 INJXDTSZGYICFA-UHFFFAOYSA-N 50208255 CHEMBL3885238 Cholinesterase 3394 ChEMBL 10.1016/j.ejmech.2016.08.016 10.7270/Q2PZ5BT8 27560283 Wieckowska, A; Kolaczkowski, M; Bucki, A; Godyn, J; Marcinkowska, M; Wieckowski, K; Zareba, P; Siwek, A; Kazek, G; Gluch-Lutwin, M; Mierzejewski, P; Bienkowski, P; Sienkiewicz-Jarosz, H; Knez, D; Wichur, T; Gobec, S; Malawska, B Jagiellonian University Collegium Medicum http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208255 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208255&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134130269 375981948 CHEMBL3885238 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543768 O=S(=O)(c1ccccc1)n1ccc2c(cccc12)N1CCN(CCNC2CCN(Cc3ccccc3)CC2)CC1 InChI=1S/C32H39N5O2S/c38-40(39,29-10-5-2-6-11-29)37-20-16-30-31(12-7-13-32(30)37)36-24-22-34(23-25-36)21-17-33-28-14-18-35(19-15-28)26-27-8-3-1-4-9-27/h1-13,16,20,28,33H,14-15,17-19,21-26H2 YDYOZLWYBAEKHN-UHFFFAOYSA-N 50208215 CHEMBL3883620 Cholinesterase 10550 ChEMBL 10.1016/j.ejmech.2016.08.016 10.7270/Q2PZ5BT8 27560283 Wieckowska, A; Kolaczkowski, M; Bucki, A; Godyn, J; Marcinkowska, M; Wieckowski, K; Zareba, P; Siwek, A; Kazek, G; Gluch-Lutwin, M; Mierzejewski, P; Bienkowski, P; Sienkiewicz-Jarosz, H; Knez, D; Wichur, T; Gobec, S; Malawska, B Jagiellonian University Collegium Medicum http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208215 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208215&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134131296 375981941 CHEMBL3883620 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543769 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 1830 ChEMBL 10.1016/j.ejmech.2016.08.016 10.7270/Q2PZ5BT8 27560283 Wieckowska, A; Kolaczkowski, M; Bucki, A; Godyn, J; Marcinkowska, M; Wieckowski, K; Zareba, P; Siwek, A; Kazek, G; Gluch-Lutwin, M; Mierzejewski, P; Bienkowski, P; Sienkiewicz-Jarosz, H; Knez, D; Wichur, T; Gobec, S; Malawska, B Jagiellonian University Collegium Medicum http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543770 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 2.0 ChEMBL 10.1016/j.ejmech.2016.08.016 10.7270/Q2PZ5BT8 27560283 Wieckowska, A; Kolaczkowski, M; Bucki, A; Godyn, J; Marcinkowska, M; Wieckowski, K; Zareba, P; Siwek, A; Kazek, G; Gluch-Lutwin, M; Mierzejewski, P; Bienkowski, P; Sienkiewicz-Jarosz, H; Knez, D; Wichur, T; Gobec, S; Malawska, B Jagiellonian University Collegium Medicum http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543774 O=S(=O)(c1ccccc1)n1ccc2c(cccc12)N1CCN(CCCCCCNCc2ccccc2)CC1 InChI=1S/C31H38N4O2S/c36-38(37,28-14-7-4-8-15-28)35-21-18-29-30(16-11-17-31(29)35)34-24-22-33(23-25-34)20-10-2-1-9-19-32-26-27-12-5-3-6-13-27/h3-8,11-18,21,32H,1-2,9-10,19-20,22-26H2 QFAZJZRPJSUMMX-UHFFFAOYSA-N 50208263 CHEMBL3884227 Cholinesterase 2384 ChEMBL 10.1016/j.ejmech.2016.08.016 10.7270/Q2PZ5BT8 27560283 Wieckowska, A; Kolaczkowski, M; Bucki, A; Godyn, J; Marcinkowska, M; Wieckowski, K; Zareba, P; Siwek, A; Kazek, G; Gluch-Lutwin, M; Mierzejewski, P; Bienkowski, P; Sienkiewicz-Jarosz, H; Knez, D; Wichur, T; Gobec, S; Malawska, B Jagiellonian University Collegium Medicum http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208263 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208263&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134130564 375981956 CHEMBL3884227 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543778 O=S(=O)(c1ccccc1)n1ccc2c(cccc12)N1CCN(CCCCCNCc2ccccc2)CC1 InChI=1S/C30H36N4O2S/c35-37(36,27-13-6-2-7-14-27)34-20-17-28-29(15-10-16-30(28)34)33-23-21-32(22-24-33)19-9-3-8-18-31-25-26-11-4-1-5-12-26/h1-2,4-7,10-17,20,31H,3,8-9,18-19,21-25H2 CWITYEQBZKMPKP-UHFFFAOYSA-N 50208259 CHEMBL3884704 Cholinesterase 1673 ChEMBL 10.1016/j.ejmech.2016.08.016 10.7270/Q2PZ5BT8 27560283 Wieckowska, A; Kolaczkowski, M; Bucki, A; Godyn, J; Marcinkowska, M; Wieckowski, K; Zareba, P; Siwek, A; Kazek, G; Gluch-Lutwin, M; Mierzejewski, P; Bienkowski, P; Sienkiewicz-Jarosz, H; Knez, D; Wichur, T; Gobec, S; Malawska, B Jagiellonian University Collegium Medicum http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208259 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208259&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134129897 375981952 CHEMBL3884704 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543785 O=S(=O)(c1ccccc1)n1ccc2c(cccc12)N1CCN(CCCCCCNc2c3CCCCc3nc3ccccc23)CC1 InChI=1S/C37H43N5O2S/c43-45(44,29-13-4-3-5-14-29)42-24-21-32-35(19-12-20-36(32)42)41-27-25-40(26-28-41)23-11-2-1-10-22-38-37-30-15-6-8-17-33(30)39-34-18-9-7-16-31(34)37/h3-6,8,12-15,17,19-21,24H,1-2,7,9-11,16,18,22-23,25-28H2,(H,38,39) INTOYXAUMDZZCK-UHFFFAOYSA-N 50208258 CHEMBL3885186 Cholinesterase 8.2 ChEMBL 10.1016/j.ejmech.2016.08.016 10.7270/Q2PZ5BT8 27560283 Wieckowska, A; Kolaczkowski, M; Bucki, A; Godyn, J; Marcinkowska, M; Wieckowski, K; Zareba, P; Siwek, A; Kazek, G; Gluch-Lutwin, M; Mierzejewski, P; Bienkowski, P; Sienkiewicz-Jarosz, H; Knez, D; Wichur, T; Gobec, S; Malawska, B Jagiellonian University Collegium Medicum http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208258 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208258&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134131252 375981951 CHEMBL3885186 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554836 CC(C)c1ccc(C)cc1OC(=O)Nc1ccc(Cl)c(Cl)c1 InChI=1S/C17H17Cl2NO2/c1-10(2)13-6-4-11(3)8-16(13)22-17(21)20-12-5-7-14(18)15(19)9-12/h4-10H,1-3H3,(H,20,21) IFXWFVDOUIEPCB-UHFFFAOYSA-N 50211401 CHEMBL3905613 Cholinesterase 2540 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211401 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211401&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134134687 375982967 CHEMBL3905613 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554837 CC(C)c1ccc(C)cc1OC(=O)Nc1ccc(cc1)[N+]([O-])=O InChI=1S/C17H18N2O4/c1-11(2)15-9-4-12(3)10-16(15)23-17(20)18-13-5-7-14(8-6-13)19(21)22/h4-11H,1-3H3,(H,18,20) XSAOEMAEMWUWPW-UHFFFAOYSA-N 50211293 CHEMBL3896675 Cholinesterase 37710 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211293 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211293&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134134440 375982964 CHEMBL3896675 C02125 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554838 CC(C)c1ccc(C)c(OC(=O)NCc2ccccc2)c1 InChI=1S/C18H21NO2/c1-13(2)16-10-9-14(3)17(11-16)21-18(20)19-12-15-7-5-4-6-8-15/h4-11,13H,12H2,1-3H3,(H,19,20) CPMMNSMBFUQAAW-UHFFFAOYSA-N 50211402 CHEMBL3897305 Cholinesterase 70 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211402 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211402&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134133683 375982968 CHEMBL3897305 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554839 CC(C)c1ccc(C)c(OC(=O)Nc2ccc(cc2)C(F)(F)F)c1 InChI=1S/C18H18F3NO2/c1-11(2)13-5-4-12(3)16(10-13)24-17(23)22-15-8-6-14(7-9-15)18(19,20)21/h4-11H,1-3H3,(H,22,23) MITNTXQVBYKQIQ-UHFFFAOYSA-N 50211403 CHEMBL3967721 Cholinesterase 1230 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211403 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211403&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134150498 104087598 CHEMBL3967721 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554842 CC(C)c1ccc(C)c(OC(=O)Nc2ccccc2)c1 InChI=1S/C17H19NO2/c1-12(2)14-10-9-13(3)16(11-14)20-17(19)18-15-7-5-4-6-8-15/h4-12H,1-3H3,(H,18,19) PXNIAKKTSIVKRD-UHFFFAOYSA-N 50211406 CHEMBL3898730 Cholinesterase 550 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211406 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211406&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 585086 104087601 CHEMBL3898730 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554844 CC(C)c1ccc(C)cc1OC(=O)Nc1cccc2ccccc12 InChI=1S/C21H21NO2/c1-14(2)17-12-11-15(3)13-20(17)24-21(23)22-19-10-6-8-16-7-4-5-9-18(16)19/h4-14H,1-3H3,(H,22,23) JXDUPHZQYZPGDN-UHFFFAOYSA-N 50211408 CHEMBL3984923 Cholinesterase 96100 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211408 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211408&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 234127 104087603 CHEMBL3984923 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554848 CC(C)c1ccc(C)c(OC(=O)Nc2cccc3ccccc23)c1 InChI=1S/C21H21NO2/c1-14(2)17-12-11-15(3)20(13-17)24-21(23)22-19-10-6-8-16-7-4-5-9-18(16)19/h4-14H,1-3H3,(H,22,23) GAXLTFHYMJNLPL-UHFFFAOYSA-N 50211407 CHEMBL3936502 Cholinesterase 510 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211407 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211407&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134148496 104087602 CHEMBL3936502 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554850 CC(C)c1ccc(C)cc1OC(=O)NC1CCCC1 InChI=1S/C16H23NO2/c1-11(2)14-9-8-12(3)10-15(14)19-16(18)17-13-6-4-5-7-13/h8-11,13H,4-7H2,1-3H3,(H,17,18) WLAJIGRYVODJCD-UHFFFAOYSA-N 50211410 CHEMBL3931200 Cholinesterase 167420 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211410 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211410&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134138151 375982970 CHEMBL3931200 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554865 CC(C)c1ccc(C)cc1OC(=O)NCC1CCCCC1 InChI=1S/C18H27NO2/c1-13(2)16-10-9-14(3)11-17(16)21-18(20)19-12-15-7-5-4-6-8-15/h9-11,13,15H,4-8,12H2,1-3H3,(H,19,20) DMBUGRDCMNPOIM-UHFFFAOYSA-N 50211421 CHEMBL3975861 Cholinesterase 36790 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211421 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211421&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134152047 375982981 CHEMBL3975861 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554866 COc1cccc(NC(=O)Oc2cc(C)ccc2C(C)C)c1 InChI=1S/C18H21NO3/c1-12(2)16-9-8-13(3)10-17(16)22-18(20)19-14-6-5-7-15(11-14)21-4/h5-12H,1-4H3,(H,19,20) WORNOQJGBHZZPZ-UHFFFAOYSA-N 50211422 CHEMBL3956263 Cholinesterase 1650 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211422 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211422&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134144762 375982982 CHEMBL3956263 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554867 CC(C)c1ccc(C)cc1OC(=O)Nc1cccc(F)c1 InChI=1S/C17H18FNO2/c1-11(2)15-8-7-12(3)9-16(15)21-17(20)19-14-6-4-5-13(18)10-14/h4-11H,1-3H3,(H,19,20) NMLLLUWGVMNOCV-UHFFFAOYSA-N 50211295 CHEMBL3968319 Cholinesterase 3850 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211295 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211295&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 4208569 375982965 CHEMBL3968319 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554868 CC(C)c1ccc(C)cc1OC(=O)Nc1ccc(Br)cc1 InChI=1S/C17H18BrNO2/c1-11(2)15-9-4-12(3)10-16(15)21-17(20)19-14-7-5-13(18)6-8-14/h4-11H,1-3H3,(H,19,20) WTDAIZHVKAFYEN-UHFFFAOYSA-N 50211419 CHEMBL3914596 Cholinesterase 107220 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211419 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211419&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 234262 375982979 CHEMBL3914596 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554869 CC(C)c1ccc(C)cc1OC(=O)Nc1ccc(I)cc1 InChI=1S/C17H18INO2/c1-11(2)15-9-4-12(3)10-16(15)21-17(20)19-14-7-5-13(18)6-8-14/h4-11H,1-3H3,(H,19,20) XIGCZRSDBZZJEX-UHFFFAOYSA-N 50211409 CHEMBL3984420 Cholinesterase 4770 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211409 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211409&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134157380 375982969 CHEMBL3984420 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554870 CC(C)c1ccc(C)cc1OC(=O)Nc1ccccc1 InChI=1S/C17H19NO2/c1-12(2)15-10-9-13(3)11-16(15)20-17(19)18-14-7-5-4-6-8-14/h4-12H,1-3H3,(H,18,19) PDHPDCFLYCZWRS-UHFFFAOYSA-N 50211418 CHEMBL3977602 Cholinesterase 5020 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211418 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211418&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 237293 375982978 CHEMBL3977602 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554871 CC(C)c1ccc(C)c(OC(=O)NC2CCCCC2)c1 InChI=1S/C17H25NO2/c1-12(2)14-10-9-13(3)16(11-14)20-17(19)18-15-7-5-4-6-8-15/h9-12,15H,4-8H2,1-3H3,(H,18,19) DMTOVYYEEHJHMR-UHFFFAOYSA-N 50211466 CHEMBL3939362 Cholinesterase 1030 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211466 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211466&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 306584 375982983 CHEMBL3939362 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554872 CC(C)c1ccc(C)c(OC(=O)NC2CCCCCC2)c1 InChI=1S/C18H27NO2/c1-13(2)15-11-10-14(3)17(12-15)21-18(20)19-16-8-6-4-5-7-9-16/h10-13,16H,4-9H2,1-3H3,(H,19,20) AUQMVRJLPAUPEB-UHFFFAOYSA-N 50211292 CHEMBL3937636 Cholinesterase 112200 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211292 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211292&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134148509 375982963 CHEMBL3937636 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554873 COc1ccc(NC(=O)Oc2cc(ccc2C)C(C)C)cc1 InChI=1S/C18H21NO3/c1-12(2)14-6-5-13(3)17(11-14)22-18(20)19-15-7-9-16(21-4)10-8-15/h5-12H,1-4H3,(H,19,20) LWQLIIOSCPUZLP-UHFFFAOYSA-N 50211467 CHEMBL3927529 Cholinesterase 520 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211467 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211467&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 303325 375982984 CHEMBL3927529 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554874 CC(C)c1ccc(C)cc1OC(=O)Nc1ccc(cc1)C(F)(F)F InChI=1S/C18H18F3NO2/c1-11(2)15-9-4-12(3)10-16(15)24-17(23)22-14-7-5-13(6-8-14)18(19,20)21/h4-11H,1-3H3,(H,22,23) VRJODSUTTZDSLD-UHFFFAOYSA-N 50211417 CHEMBL3967840 Cholinesterase 147850 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211417 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211417&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134151010 375982977 CHEMBL3967840 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554875 CC(C)c1ccc(C)c(OC(=O)Nc2ccc(F)cc2)c1 InChI=1S/C17H18FNO2/c1-11(2)13-5-4-12(3)16(10-13)21-17(20)19-15-8-6-14(18)7-9-15/h4-11H,1-3H3,(H,19,20) JDVPKNAMYZDOGL-UHFFFAOYSA-N 50211404 CHEMBL3979846 Cholinesterase 20 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134152928 104087599 CHEMBL3979846 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554876 CC(C)c1ccc(C)c(OC(=O)Nc2ccc(Cl)c(Cl)c2)c1 InChI=1S/C17H17Cl2NO2/c1-10(2)12-5-4-11(3)16(8-12)22-17(21)20-13-6-7-14(18)15(19)9-13/h4-10H,1-3H3,(H,20,21) HDOJLGGPQNDPOP-UHFFFAOYSA-N 50211411 CHEMBL3912692 Cholinesterase 410 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211411 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211411&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134142424 375982971 CHEMBL3912692 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554877 CC(C)c1ccc(C)c(OC(=O)Nc2ccc(Br)cc2)c1 InChI=1S/C17H18BrNO2/c1-11(2)13-5-4-12(3)16(10-13)21-17(20)19-15-8-6-14(18)7-9-15/h4-11H,1-3H3,(H,19,20) NADYCAUIZOZSQG-UHFFFAOYSA-N 50211468 CHEMBL3966774 Cholinesterase 150 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211468 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211468&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134149823 375982985 CHEMBL3966774 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554878 CC(C)c1ccc(C)c(OC(=O)Nc2ccc(I)cc2)c1 InChI=1S/C17H18INO2/c1-11(2)13-5-4-12(3)16(10-13)21-17(20)19-15-8-6-14(18)7-9-15/h4-11H,1-3H3,(H,19,20) VFVBWNCOJYCYJY-UHFFFAOYSA-N 50211291 CHEMBL3984273 Cholinesterase 210 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211291 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211291&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134157859 375982962 CHEMBL3984273 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554879 CC(C)c1ccc(C)c(OC(=O)Nc2cccc(c2)[N+]([O-])=O)c1 InChI=1S/C17H18N2O4/c1-11(2)13-8-7-12(3)16(9-13)23-17(20)18-14-5-4-6-15(10-14)19(21)22/h4-11H,1-3H3,(H,18,20) IIRSYCMFEMYJHR-UHFFFAOYSA-N 50211400 CHEMBL3976227 Cholinesterase 560 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211400 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211400&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134152367 375982966 CHEMBL3976227 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554880 CC(C)c1ccc(C)c(OC(=O)Nc2ccc(cc2)[N+]([O-])=O)c1 InChI=1S/C17H18N2O4/c1-11(2)13-5-4-12(3)16(10-13)23-17(20)18-14-6-8-15(9-7-14)19(21)22/h4-11H,1-3H3,(H,18,20) LZLYDYHOVOCCAU-UHFFFAOYSA-N 50211469 CHEMBL3946935 Cholinesterase 1050 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211469 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211469&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134147352 375982986 CHEMBL3946935 C02125 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554881 CC(C)c1ccc(C)c(O)c1 InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)10(11)6-9/h4-7,11H,1-3H3 RECUKUPTGUEGMW-UHFFFAOYSA-N 50240433 5-Isopropyl-2-methyl-phenol::CARVACROL::CHEMBL281202 Cholinesterase 410790 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50240433 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50240433&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search S5V 8BXW 10364 104098282 3440 CHEMBL281202 2497 C09840 ZINC00967563 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554882 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 18130 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554883 COc1cccc(NC(=O)Oc2cc(ccc2C)C(C)C)c1 InChI=1S/C18H21NO3/c1-12(2)14-9-8-13(3)17(10-14)22-18(20)19-15-6-5-7-16(11-15)21-4/h5-12H,1-4H3,(H,19,20) HFFBJJMQHTVHIQ-UHFFFAOYSA-N 50211415 CHEMBL3899501 Cholinesterase 1640 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211415 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211415&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134134378 375982975 CHEMBL3899501 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554886 CC(C)c1ccc(C)c(OC(=O)Nc2ccc(C)cc2)c1 InChI=1S/C18H21NO2/c1-12(2)15-8-7-14(4)17(11-15)21-18(20)19-16-9-5-13(3)6-10-16/h5-12H,1-4H3,(H,19,20) SJGICWWJDAAZJC-UHFFFAOYSA-N 50211414 CHEMBL3890538 Cholinesterase 310 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211414 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211414&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134136815 375982974 CHEMBL3890538 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554887 COc1ccc(NC(=O)Oc2cc(C)ccc2C(C)C)cc1 InChI=1S/C18H21NO3/c1-12(2)16-10-5-13(3)11-17(16)22-18(20)19-14-6-8-15(21-4)9-7-14/h5-12H,1-4H3,(H,19,20) VUMWMUKIMAYLFG-UHFFFAOYSA-N 50420662 CHEMBL1385022 Cholinesterase 59960 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50420662 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50420662&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 234263 163369686 CHEMBL1385022 ZINC01665940 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554894 CC(C)c1ccc(C)cc1OC(=O)NCc1ccccc1 InChI=1S/C18H21NO2/c1-13(2)16-10-9-14(3)11-17(16)21-18(20)19-12-15-7-5-4-6-8-15/h4-11,13H,12H2,1-3H3,(H,19,20) ZXIYNIPYBRAICT-UHFFFAOYSA-N 50211405 CHEMBL3983884 Cholinesterase 1450 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211405 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211405&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134157278 104087600 CHEMBL3983884 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534762 COC(=O)c1cccc(CN2CCC(CC3Cc4cc(OC)c(OC)cc4C3=O)CC2)n1 InChI=1S/C25H30N2O5/c1-30-22-13-17-12-18(24(28)20(17)14-23(22)31-2)11-16-7-9-27(10-8-16)15-19-5-4-6-21(26-19)25(29)32-3/h4-6,13-14,16,18H,7-12,15H2,1-3H3 JVZHCFKOAOKJII-UHFFFAOYSA-N 50204750 CHEMBL3889713 Cholinesterase 29500 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50204750 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50204750&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134129916 375980650 CHEMBL3889713 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554895 CC(C)c1ccc(C)cc1OC(=O)Nc1ccc(Cl)cc1 InChI=1S/C17H18ClNO2/c1-11(2)15-9-4-12(3)10-16(15)21-17(20)19-14-7-5-13(18)6-8-14/h4-11H,1-3H3,(H,19,20) WUGUWZPWFYXRSR-UHFFFAOYSA-N 50211472 CHEMBL3976349 Cholinesterase 137410 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211472 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211472&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 310646 375982989 CHEMBL3976349 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554896 CC(C)c1ccc(C)cc1OC(=O)Nc1cccc(c1)[N+]([O-])=O InChI=1S/C17H18N2O4/c1-11(2)15-8-7-12(3)9-16(15)23-17(20)18-13-5-4-6-14(10-13)19(21)22/h4-11H,1-3H3,(H,18,20) HTIFGFNYRRKYGJ-UHFFFAOYSA-N 50211471 CHEMBL3906079 Cholinesterase 3310 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211471 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211471&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12941455 375982988 CHEMBL3906079 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554897 CC(C)c1ccc(C)c(OC(=O)NC2CCCC2)c1 InChI=1S/C16H23NO2/c1-11(2)13-9-8-12(3)15(10-13)19-16(18)17-14-6-4-5-7-14/h8-11,14H,4-7H2,1-3H3,(H,17,18) RPCUBISWWVQZIS-UHFFFAOYSA-N 50211416 CHEMBL3968901 Cholinesterase 1010 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211416 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211416&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134150140 375982976 CHEMBL3968901 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554899 CC(C)c1ccc(C)c(OC(=O)NCC2CCCCC2)c1 InChI=1S/C18H27NO2/c1-13(2)16-10-9-14(3)17(11-16)21-18(20)19-12-15-7-5-4-6-8-15/h9-11,13,15H,4-8,12H2,1-3H3,(H,19,20) WWLFRRMEORDALC-UHFFFAOYSA-N 50211412 CHEMBL3917505 Cholinesterase 300 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211412 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211412&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134143173 375982972 CHEMBL3917505 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554902 CC(C)c1ccc(C)cc1OC(=O)Nc1ccc(C)cc1 InChI=1S/C18H21NO2/c1-12(2)16-10-7-14(4)11-17(16)21-18(20)19-15-8-5-13(3)6-9-15/h5-12H,1-4H3,(H,19,20) RLGJUNMGZWGDIS-UHFFFAOYSA-N 50211420 CHEMBL3967366 Cholinesterase 9400 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211420 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211420&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 310198 375982980 CHEMBL3967366 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554903 CC(C)c1ccc(C)c(OC(=O)Nc2cccc(F)c2)c1 InChI=1S/C17H18FNO2/c1-11(2)13-8-7-12(3)16(9-13)21-17(20)19-15-6-4-5-14(18)10-15/h4-11H,1-3H3,(H,19,20) JLYPLAOLUDFOOW-UHFFFAOYSA-N 50211473 CHEMBL3918594 Cholinesterase 1020 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211473 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211473&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134139482 375982990 CHEMBL3918594 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554904 CC(C)c1ccc(C)c(OC(=O)Nc2ccc(Cl)cc2)c1 InChI=1S/C17H18ClNO2/c1-11(2)13-5-4-12(3)16(10-13)21-17(20)19-15-8-6-14(18)7-9-15/h4-11H,1-3H3,(H,19,20) GCPFOKOABJMKPO-UHFFFAOYSA-N 50211413 CHEMBL3895476 Cholinesterase 130 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211413 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211413&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134136226 375982973 CHEMBL3895476 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554905 CC(C)c1ccc(C)cc1O InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3 MGSRCZKZVOBKFT-UHFFFAOYSA-N 50240432 1-hydroxy-5-methyl-2-isopropylbenzene::2-isopropyl-5-methylphenol::3-p-cymenol::5-methyl-2-(propan-2-yl)phenol::5-methyl-2-isopropylphenol::6-isopropyl-3-methylphenol::6-isopropyl-m-cresol::CHEMBL29411::thymol Cholinesterase 226130 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50240432 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50240432&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search IPB 7T9C,8BXV,1E06,7SJF 6989 104098281 27607 CHEMBL29411 DB02513 2499 C09908 ZINC00967597 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554906 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 11682 2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::Rivastigmine.tartrate::US9586925, Rivastigmine Cholinesterase 1000 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=11682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=11682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46512204 DB00989 C11766 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50554907 CC(C)c1ccc(C)cc1OC(=O)Nc1ccc(F)cc1 InChI=1S/C17H18FNO2/c1-11(2)15-9-4-12(3)10-16(15)21-17(20)19-14-7-5-13(18)6-8-14/h4-11H,1-3H3,(H,19,20) WAJAVBMRQYWVAY-UHFFFAOYSA-N 50211470 CHEMBL3938764 Cholinesterase 405150 ChEMBL 10.1016/j.bmc.2016.12.037 10.7270/Q2W95CC5 28089589 Kurt, BZ; Gazioglu, I; Dag, A; Salmas, RE; Kayik, G; Durdagi, S; Sonmez, F Bezmialem Vakif University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50211470 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50211470&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134148440 375982987 CHEMBL3938764 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534774 COc1cc2CC(CC3CCN(Cc4ccccc4C)CC3)C(=O)c2cc1OC InChI=1S/C25H31NO3/c1-17-6-4-5-7-19(17)16-26-10-8-18(9-11-26)12-21-13-20-14-23(28-2)24(29-3)15-22(20)25(21)27/h4-7,14-15,18,21H,8-13,16H2,1-3H3 UXCHLNWWKFZKMW-UHFFFAOYSA-N 50029945 5,6-Dimethoxy-2-[1-(2-methyl-benzyl)-piperidin-4-ylmethyl]-indan-1-one; hydrochloride::CHEMBL353468::CHEMBL538069 Cholinesterase 38100 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50029945 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50029945&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10620599 103938963 CHEMBL538069CHEMBL353468 ZINC13744623 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534775 COc1cc2CC(CC3CCN(Cc4ccccc4C(F)(F)F)CC3)C(=O)c2cc1OC InChI=1S/C25H28F3NO3/c1-31-22-13-18-12-19(24(30)20(18)14-23(22)32-2)11-16-7-9-29(10-8-16)15-17-5-3-4-6-21(17)25(26,27)28/h3-6,13-14,16,19H,7-12,15H2,1-2H3 AEVWXIOQXSMEOS-UHFFFAOYSA-N 50204760 CHEMBL3890758 Cholinesterase 31700 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50204760 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50204760&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134136355 375980660 CHEMBL3890758 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534776 COc1cc2CC(CC3CCN(Cc4ncccc4C)CC3)C(=O)c2cc1OC InChI=1S/C24H30N2O3/c1-16-5-4-8-25-21(16)15-26-9-6-17(7-10-26)11-19-12-18-13-22(28-2)23(29-3)14-20(18)24(19)27/h4-5,8,13-14,17,19H,6-7,9-12,15H2,1-3H3 GMORXUFYAMIBNR-UHFFFAOYSA-N 50204758 CHEMBL3891369 Cholinesterase 15600 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50204758 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50204758&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134136825 375980658 CHEMBL3891369 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534777 COc1cc2CC(CC3CCN(Cc4ccc(cc4)[N+]([O-])=O)CC3)C(=O)c2cc1OC InChI=1S/C24H28N2O5/c1-30-22-13-18-12-19(24(27)21(18)14-23(22)31-2)11-16-7-9-25(10-8-16)15-17-3-5-20(6-4-17)26(28)29/h3-6,13-14,16,19H,7-12,15H2,1-2H3 ACJJKDSOGZQROR-UHFFFAOYSA-N 50029934 5,6-Dimethoxy-2-[1-(4-nitro-benzyl)-piperidin-4-ylmethyl]-indan-1-one; hydrochloride::CHEMBL171048::CHEMBL543924 Cholinesterase 12200 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50029934 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50029934&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10526350 103938952 CHEMBL171048CHEMBL543924 ZINC13744631 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534782 COc1cc2CC(CC3CCN(Cc4ccc(C)cc4)CC3)C(=O)c2cc1OC InChI=1S/C25H31NO3/c1-17-4-6-19(7-5-17)16-26-10-8-18(9-11-26)12-21-13-20-14-23(28-2)24(29-3)15-22(20)25(21)27/h4-7,14-15,18,21H,8-13,16H2,1-3H3 XKRGRLGLKJEACL-UHFFFAOYSA-N 50029937 5,6-Dimethoxy-2-[1-(4-methyl-benzyl)-piperidin-4-ylmethyl]-indan-1-one; hydrochloride::CHEMBL354848::CHEMBL539073 Cholinesterase 6670 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50029937 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50029937&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10763156 103938955 CHEMBL539073CHEMBL354848 ZINC13744627 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534783 COc1cc2CC(CC3CCN(Cc4cccc(Cl)n4)CC3)C(=O)c2cc1OC InChI=1S/C23H27ClN2O3/c1-28-20-12-16-11-17(23(27)19(16)13-21(20)29-2)10-15-6-8-26(9-7-15)14-18-4-3-5-22(24)25-18/h3-5,12-13,15,17H,6-11,14H2,1-2H3 NQXMJGWHWLUOTH-UHFFFAOYSA-N 50204761 CHEMBL3944652 Cholinesterase 31600 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50204761 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50204761&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134146339 375980661 CHEMBL3944652 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534785 COc1cc2CC(CC3CCN(Cc4ccc(F)cc4)CC3)C(=O)c2cc1OC InChI=1S/C24H28FNO3/c1-28-22-13-18-12-19(24(27)21(18)14-23(22)29-2)11-16-7-9-26(10-8-16)15-17-3-5-20(25)6-4-17/h3-6,13-14,16,19H,7-12,15H2,1-2H3 MXYQBFFZAMEOHM-UHFFFAOYSA-N 50204754 CHEMBL3985059 Cholinesterase 2310 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50204754 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50204754&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54097201 375980654 CHEMBL3985059 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534787 COc1cc2CC(CC3CCN(Cc4cccc(Cl)c4)CC3)C(=O)c2cc1OC InChI=1S/C24H28ClNO3/c1-28-22-13-18-12-19(24(27)21(18)14-23(22)29-2)10-16-6-8-26(9-7-16)15-17-4-3-5-20(25)11-17/h3-5,11,13-14,16,19H,6-10,12,15H2,1-2H3 CSYVGFFWWUUSDU-UHFFFAOYSA-N 50204757 CHEMBL3960861 Cholinesterase 68900 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50204757 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50204757&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134155675 375980657 CHEMBL3960861 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534788 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 46 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534795 COc1cc2CC(CC3CCN(Cc4ccccn4)CC3)C(=O)c2cc1OC InChI=1S/C23H28N2O3/c1-27-21-13-17-12-18(23(26)20(17)14-22(21)28-2)11-16-6-9-25(10-7-16)15-19-5-3-4-8-24-19/h3-5,8,13-14,16,18H,6-7,9-12,15H2,1-2H3 HASPOWFDQOETTJ-UHFFFAOYSA-N 50204755 CHEMBL3910513 Cholinesterase 7830 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50204755 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50204755&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 23448959 375980655 CHEMBL3910513 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534811 COc1cc2CC(CC3CCN(Cc4cccc(C)c4)CC3)C(=O)c2cc1OC InChI=1S/C25H31NO3/c1-17-5-4-6-19(11-17)16-26-9-7-18(8-10-26)12-21-13-20-14-23(28-2)24(29-3)15-22(20)25(21)27/h4-6,11,14-15,18,21H,7-10,12-13,16H2,1-3H3 QBOHSSFTEGRUFM-UHFFFAOYSA-N 50029944 5,6-Dimethoxy-2-[1-(3-methyl-benzyl)-piperidin-4-ylmethyl]-indan-1-one; hydrochloride::CHEMBL170946::CHEMBL544860 Cholinesterase 5830 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50029944 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50029944&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 9886877 103938962 CHEMBL170946CHEMBL544860 ZINC13744625 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534812 COc1cc2CC(CC3CCN(Cc4ccccc4F)CC3)C(=O)c2cc1OC InChI=1S/C24H28FNO3/c1-28-22-13-18-12-19(24(27)20(18)14-23(22)29-2)11-16-7-9-26(10-8-16)15-17-5-3-4-6-21(17)25/h3-6,13-14,16,19H,7-12,15H2,1-2H3 WJIWWKMTCQJEPQ-UHFFFAOYSA-N 50204751 CHEMBL3943450 Cholinesterase 3710 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50204751 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50204751&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134146128 375980651 CHEMBL3943450 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534813 COc1cc2CC(CC3CCN(Cc4ccc(Cl)cc4)CC3)C(=O)c2cc1OC InChI=1S/C24H28ClNO3/c1-28-22-13-18-12-19(24(27)21(18)14-23(22)29-2)11-16-7-9-26(10-8-16)15-17-3-5-20(25)6-4-17/h3-6,13-14,16,19H,7-12,15H2,1-2H3 VGQNXCDLTRSTAF-UHFFFAOYSA-N 50204836 CHEMBL3926911 Cholinesterase 89400 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50204836 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50204836&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 68259803 375980667 CHEMBL3926911 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534814 COc1cc2CC(CC3CCN(Cc4cccc(c4)C(F)(F)F)CC3)C(=O)c2cc1OC InChI=1S/C25H28F3NO3/c1-31-22-13-18-12-19(24(30)21(18)14-23(22)32-2)10-16-6-8-29(9-7-16)15-17-4-3-5-20(11-17)25(26,27)28/h3-5,11,13-14,16,19H,6-10,12,15H2,1-2H3 MMBOOKVUXAQCOP-UHFFFAOYSA-N 50204829 CHEMBL3961494 Cholinesterase 18200 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50204829 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50204829&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134155988 375980662 CHEMBL3961494 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534815 COc1cc2CC(CC3CCN(Cc4ccccc4[N+]([O-])=O)CC3)C(=O)c2cc1OC InChI=1S/C24H28N2O5/c1-30-22-13-18-12-19(24(27)20(18)14-23(22)31-2)11-16-7-9-25(10-8-16)15-17-5-3-4-6-21(17)26(28)29/h3-6,13-14,16,19H,7-12,15H2,1-2H3 MJYITRIIINQALM-UHFFFAOYSA-N 50029921 5,6-Dimethoxy-2-[1-(2-nitro-benzyl)-piperidin-4-ylmethyl]-indan-1-one::CHEMBL145361 Cholinesterase 31100 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50029921 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50029921&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10550262 103938939 CHEMBL145361 ZINC13744629 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534816 COc1cc2CC(CC3CCN(Cc4ncc(C)cc4C)CC3)C(=O)c2cc1OC InChI=1S/C25H32N2O3/c1-16-9-17(2)22(26-14-16)15-27-7-5-18(6-8-27)10-20-11-19-12-23(29-3)24(30-4)13-21(19)25(20)28/h9,12-14,18,20H,5-8,10-11,15H2,1-4H3 PFSOXGQUNSMPSU-UHFFFAOYSA-N 50204837 CHEMBL3900401 Cholinesterase 6310 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50204837 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50204837&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134134606 375980668 CHEMBL3900401 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534817 COc1cc2CC(CC3CCN(Cc4cccc(F)n4)CC3)C(=O)c2cc1OC InChI=1S/C23H27FN2O3/c1-28-20-12-16-11-17(23(27)19(16)13-21(20)29-2)10-15-6-8-26(9-7-15)14-18-4-3-5-22(24)25-18/h3-5,12-13,15,17H,6-11,14H2,1-2H3 SKLIQILUFPGCDR-UHFFFAOYSA-N 50204830 CHEMBL3928343 Cholinesterase 21100 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50204830 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50204830&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134141898 375980663 CHEMBL3928343 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534818 COc1cc2CC(CC3CCN(Cc4cccc(Br)n4)CC3)C(=O)c2cc1OC InChI=1S/C23H27BrN2O3/c1-28-20-12-16-11-17(23(27)19(16)13-21(20)29-2)10-15-6-8-26(9-7-15)14-18-4-3-5-22(24)25-18/h3-5,12-13,15,17H,6-11,14H2,1-2H3 QSLYRRWEPSEYKU-UHFFFAOYSA-N 50204838 CHEMBL3973337 Cholinesterase 17500 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50204838 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50204838&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134154226 375980669 CHEMBL3973337 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534819 COc1cc2CC(CC3CCN(Cc4ccc5ccccc5n4)CC3)C(=O)c2cc1OC InChI=1S/C27H30N2O3/c1-31-25-15-20-14-21(27(30)23(20)16-26(25)32-2)13-18-9-11-29(12-10-18)17-22-8-7-19-5-3-4-6-24(19)28-22/h3-8,15-16,18,21H,9-14,17H2,1-2H3 QWDLRZDIIOSNHC-UHFFFAOYSA-N 50204759 CHEMBL3889625 Cholinesterase 9680 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50204759 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50204759&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134130629 375980659 CHEMBL3889625 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534820 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 2480 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534841 COc1cc2CC(CC3CCN(Cc4cccc(F)c4)CC3)C(=O)c2cc1OC InChI=1S/C24H28FNO3/c1-28-22-13-18-12-19(24(27)21(18)14-23(22)29-2)10-16-6-8-26(9-7-16)15-17-4-3-5-20(25)11-17/h3-5,11,13-14,16,19H,6-10,12,15H2,1-2H3 WIBAQCAJLVMGFE-UHFFFAOYSA-N 50204831 CHEMBL3927363 Cholinesterase 2660 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50204831 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50204831&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10200831 375980664 CHEMBL3927363 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534845 COc1cc2CC(CC3CCN(Cc4cccc(c4)[N+]([O-])=O)CC3)C(=O)c2cc1OC InChI=1S/C24H28N2O5/c1-30-22-13-18-12-19(24(27)21(18)14-23(22)31-2)10-16-6-8-25(9-7-16)15-17-4-3-5-20(11-17)26(28)29/h3-5,11,13-14,16,19H,6-10,12,15H2,1-2H3 SQRIUXQNIAMKTL-UHFFFAOYSA-N 50029932 5,6-Dimethoxy-2-[1-(3-nitro-benzyl)-piperidin-4-ylmethyl]-indan-1-one; hydrochloride::CHEMBL435071::CHEMBL557839 Cholinesterase 42400 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50029932 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50029932&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10295924 103938950 CHEMBL435071CHEMBL557839 ZINC03789953 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534857 COc1cc2CC(CC3CCN(Cc4ccccc4Cl)CC3)C(=O)c2cc1OC InChI=1S/C24H28ClNO3/c1-28-22-13-18-12-19(24(27)20(18)14-23(22)29-2)11-16-7-9-26(10-8-16)15-17-5-3-4-6-21(17)25/h3-6,13-14,16,19H,7-12,15H2,1-2H3 RHZKAWSSJKSGEO-UHFFFAOYSA-N 50204835 CHEMBL3933395 Cholinesterase 3200 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50204835 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50204835&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134137746 375980666 CHEMBL3933395 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534858 COc1cc2CC(CC3CCN(Cc4ccc(cc4)C(F)(F)F)CC3)C(=O)c2cc1OC InChI=1S/C25H28F3NO3/c1-31-22-13-18-12-19(24(30)21(18)14-23(22)32-2)11-16-7-9-29(10-8-16)15-17-3-5-20(6-4-17)25(26,27)28/h3-6,13-14,16,19H,7-12,15H2,1-2H3 SSYDSLPWPWZKOY-UHFFFAOYSA-N 50204833 CHEMBL3892502 Cholinesterase 3980 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50204833 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50204833&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134136742 375980665 CHEMBL3892502 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534859 COc1cc2CC(CC3CCN(Cc4cccc(C)n4)CC3)C(=O)c2cc1OC InChI=1S/C24H30N2O3/c1-16-5-4-6-20(25-16)15-26-9-7-17(8-10-26)11-19-12-18-13-22(28-2)23(29-3)14-21(18)24(19)27/h4-6,13-14,17,19H,7-12,15H2,1-3H3 ZBPKNQIMVQSMLB-UHFFFAOYSA-N 50204752 CHEMBL3919441 Cholinesterase 20500 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50204752 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50204752&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134139579 375980652 CHEMBL3919441 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534860 COc1cc2CC(CC3CCN(Cc4ccc5cccc(O)c5n4)CC3)C(=O)c2cc1OC InChI=1S/C27H30N2O4/c1-32-24-14-19-13-20(27(31)22(19)15-25(24)33-2)12-17-8-10-29(11-9-17)16-21-7-6-18-4-3-5-23(30)26(18)28-21/h3-7,14-15,17,20,30H,8-13,16H2,1-2H3 DIRWKSCWOCKTCI-UHFFFAOYSA-N 50204756 CHEMBL3934564 Cholinesterase 4530 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50204756 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50204756&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134138725 375980656 CHEMBL3934564 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50534866 COc1cc2CC(CC3CCN(Cc4ccc(O)c5ncccc45)CC3)C(=O)c2cc1OC InChI=1S/C27H30N2O4/c1-32-24-14-19-13-20(27(31)22(19)15-25(24)33-2)12-17-7-10-29(11-8-17)16-18-5-6-23(30)26-21(18)4-3-9-28-26/h3-6,9,14-15,17,20,30H,7-8,10-13,16H2,1-2H3 BJXKNPYYQJEEKX-UHFFFAOYSA-N 50204753 CHEMBL3950063 Cholinesterase 7650 ChEMBL 10.1016/j.ejmech.2016.07.052 10.7270/Q2ZW1NW5 27484514 Wang, ZM; Cai, P; Liu, QH; Xu, DQ; Yang, XL; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50204753 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50204753&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134147979 375980653 CHEMBL3950063 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543786 O=S(=O)(c1ccccc1)n1ccc2c(cccc12)N1CCN(CCCNCc2ccccc2)CC1 InChI=1S/C28H32N4O2S/c33-35(34,25-11-5-2-6-12-25)32-18-15-26-27(13-7-14-28(26)32)31-21-19-30(20-22-31)17-8-16-29-23-24-9-3-1-4-10-24/h1-7,9-15,18,29H,8,16-17,19-23H2 RJFZRWZZAMXOMY-UHFFFAOYSA-N 50208252 CHEMBL3884154 Cholinesterase 608 ChEMBL 10.1016/j.ejmech.2016.08.016 10.7270/Q2PZ5BT8 27560283 Wieckowska, A; Kolaczkowski, M; Bucki, A; Godyn, J; Marcinkowska, M; Wieckowski, K; Zareba, P; Siwek, A; Kazek, G; Gluch-Lutwin, M; Mierzejewski, P; Bienkowski, P; Sienkiewicz-Jarosz, H; Knez, D; Wichur, T; Gobec, S; Malawska, B Jagiellonian University Collegium Medicum http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208252 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208252&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134131115 375981945 CHEMBL3884154 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543787 CN(CCCCN1CCN(CC1)c1cccc2n(ccc12)S(=O)(=O)c1ccccc1)Cc1ccccc1 InChI=1S/C30H36N4O2S/c1-31(25-26-11-4-2-5-12-26)18-8-9-19-32-21-23-33(24-22-32)29-15-10-16-30-28(29)17-20-34(30)37(35,36)27-13-6-3-7-14-27/h2-7,10-17,20H,8-9,18-19,21-25H2,1H3 AFWXZBBWSCOFSI-UHFFFAOYSA-N 50208254 CHEMBL3883921 Cholinesterase 6221 ChEMBL 10.1016/j.ejmech.2016.08.016 10.7270/Q2PZ5BT8 27560283 Wieckowska, A; Kolaczkowski, M; Bucki, A; Godyn, J; Marcinkowska, M; Wieckowski, K; Zareba, P; Siwek, A; Kazek, G; Gluch-Lutwin, M; Mierzejewski, P; Bienkowski, P; Sienkiewicz-Jarosz, H; Knez, D; Wichur, T; Gobec, S; Malawska, B Jagiellonian University Collegium Medicum http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208254 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208254&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134131307 375981947 CHEMBL3883921 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543790 O=S(=O)(c1ccccc1)n1ccc2c(cccc12)N1CCN(CCCNc2c3CCCCc3nc3ccccc23)CC1 InChI=1S/C34H37N5O2S/c40-42(41,26-10-2-1-3-11-26)39-21-18-29-32(16-8-17-33(29)39)38-24-22-37(23-25-38)20-9-19-35-34-27-12-4-6-14-30(27)36-31-15-7-5-13-28(31)34/h1-4,6,8,10-12,14,16-18,21H,5,7,9,13,15,19-20,22-25H2,(H,35,36) DHTIEPUWNIRXPY-UHFFFAOYSA-N 50208256 CHEMBL3884618 Cholinesterase 14 ChEMBL 10.1016/j.ejmech.2016.08.016 10.7270/Q2PZ5BT8 27560283 Wieckowska, A; Kolaczkowski, M; Bucki, A; Godyn, J; Marcinkowska, M; Wieckowski, K; Zareba, P; Siwek, A; Kazek, G; Gluch-Lutwin, M; Mierzejewski, P; Bienkowski, P; Sienkiewicz-Jarosz, H; Knez, D; Wichur, T; Gobec, S; Malawska, B Jagiellonian University Collegium Medicum http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208256 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208256&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134130413 375981949 CHEMBL3884618 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543791 O=S(=O)(c1ccccc1)n1ccc2c(cccc12)N1CCN(CCCCCCCCNc2c3CCCCc3nc3ccccc23)CC1 InChI=1S/C39H47N5O2S/c45-47(46,31-15-6-5-7-16-31)44-26-23-34-37(21-14-22-38(34)44)43-29-27-42(28-30-43)25-13-4-2-1-3-12-24-40-39-32-17-8-10-19-35(32)41-36-20-11-9-18-33(36)39/h5-8,10,14-17,19,21-23,26H,1-4,9,11-13,18,20,24-25,27-30H2,(H,40,41) FZNAHZCVWVQRSJ-UHFFFAOYSA-N 50208218 CHEMBL3883432 Cholinesterase 12 ChEMBL 10.1016/j.ejmech.2016.08.016 10.7270/Q2PZ5BT8 27560283 Wieckowska, A; Kolaczkowski, M; Bucki, A; Godyn, J; Marcinkowska, M; Wieckowski, K; Zareba, P; Siwek, A; Kazek, G; Gluch-Lutwin, M; Mierzejewski, P; Bienkowski, P; Sienkiewicz-Jarosz, H; Knez, D; Wichur, T; Gobec, S; Malawska, B Jagiellonian University Collegium Medicum http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208218 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208218&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134131482 375981944 CHEMBL3883432 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543848 CCOC(=O)N1CCC(CC1)=NNC(=O)c1ccc(C)cc1 InChI=1S/C16H21N3O3/c1-3-22-16(21)19-10-8-14(9-11-19)17-18-15(20)13-6-4-12(2)5-7-13/h4-7H,3,8-11H2,1-2H3,(H,18,20) BPUVHUFPADEUQU-UHFFFAOYSA-N 50208293 CHEMBL3884946 Cholinesterase 76930 ChEMBL 10.1016/j.ejmech.2016.08.037 10.7270/Q2FF3VCJ 27592396 Karaman, N; Sicak, Y; Taskin-Tok, T; Öztürk, M; Karaküçük-Iyidogan, A; Dikmen, M; Koçyigit-Kaymakçioglu, B; Oruç-Emre, EE Gaziantep University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208293 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208293&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 9175249 375981986 CHEMBL3884946 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543849 COc1ccc(cc1)C(=O)NN=C1CC(NC(C1)c1ccccc1)c1ccccc1 InChI=1S/C25H25N3O2/c1-30-22-14-12-20(13-15-22)25(29)28-27-21-16-23(18-8-4-2-5-9-18)26-24(17-21)19-10-6-3-7-11-19/h2-15,23-24,26H,16-17H2,1H3,(H,28,29) YFVRQFBSOWLFTB-UHFFFAOYSA-N 50208294 CHEMBL3884920 Cholinesterase 110070 ChEMBL 10.1016/j.ejmech.2016.08.037 10.7270/Q2FF3VCJ 27592396 Karaman, N; Sicak, Y; Taskin-Tok, T; Öztürk, M; Karaküçük-Iyidogan, A; Dikmen, M; Koçyigit-Kaymakçioglu, B; Oruç-Emre, EE Gaziantep University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208294 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208294&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134130790 375981987 CHEMBL3884920 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543850 Fc1cc(ccc1C(=O)NN=C1CC(NC(C1)c1ccccc1)c1ccccc1)C(F)(F)F InChI=1S/C25H21F4N3O/c26-21-13-18(25(27,28)29)11-12-20(21)24(33)32-31-19-14-22(16-7-3-1-4-8-16)30-23(15-19)17-9-5-2-6-10-17/h1-13,22-23,30H,14-15H2,(H,32,33) IPRSNMLWTNXASL-UHFFFAOYSA-N 50208295 CHEMBL3884157 Cholinesterase 117290 ChEMBL 10.1016/j.ejmech.2016.08.037 10.7270/Q2FF3VCJ 27592396 Karaman, N; Sicak, Y; Taskin-Tok, T; Öztürk, M; Karaküçük-Iyidogan, A; Dikmen, M; Koçyigit-Kaymakçioglu, B; Oruç-Emre, EE Gaziantep University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208295 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208295&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134131118 375981988 CHEMBL3884157 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543853 CCOC(=O)N1CCC(CC1)=NNC(=O)c1ccc(OC)cc1 InChI=1S/C16H21N3O4/c1-3-23-16(21)19-10-8-13(9-11-19)17-18-15(20)12-4-6-14(22-2)7-5-12/h4-7H,3,8-11H2,1-2H3,(H,18,20) ODTNFDKQXURJRU-UHFFFAOYSA-N 50208298 CHEMBL3885294 Cholinesterase 82230 ChEMBL 10.1016/j.ejmech.2016.08.037 10.7270/Q2FF3VCJ 27592396 Karaman, N; Sicak, Y; Taskin-Tok, T; Öztürk, M; Karaküçük-Iyidogan, A; Dikmen, M; Koçyigit-Kaymakçioglu, B; Oruç-Emre, EE Gaziantep University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208298 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208298&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 9359345 375981991 CHEMBL3885294 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543854 CCOC(=O)N1CCC(CC1)=NNC(=O)c1ccc(cc1[N+]([O-])=O)[N+]([O-])=O InChI=1S/C15H17N5O7/c1-2-27-15(22)18-7-5-10(6-8-18)16-17-14(21)12-4-3-11(19(23)24)9-13(12)20(25)26/h3-4,9H,2,5-8H2,1H3,(H,17,21) ZHNLDIGDDVGFJH-UHFFFAOYSA-N 50208299 CHEMBL3884685 Cholinesterase 103150 ChEMBL 10.1016/j.ejmech.2016.08.037 10.7270/Q2FF3VCJ 27592396 Karaman, N; Sicak, Y; Taskin-Tok, T; Öztürk, M; Karaküçük-Iyidogan, A; Dikmen, M; Koçyigit-Kaymakçioglu, B; Oruç-Emre, EE Gaziantep University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208299 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208299&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134131154 375981992 CHEMBL3884685 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543856 CCOC(=O)N1CCC(CC1)=NNC(=O)c1ccc(cc1)C(F)(F)F InChI=1S/C16H18F3N3O3/c1-2-25-15(24)22-9-7-13(8-10-22)20-21-14(23)11-3-5-12(6-4-11)16(17,18)19/h3-6H,2,7-10H2,1H3,(H,21,23) ZUMCOXFWRVPCHW-UHFFFAOYSA-N 50208300 CHEMBL3884514 Cholinesterase 91590 ChEMBL 10.1016/j.ejmech.2016.08.037 10.7270/Q2FF3VCJ 27592396 Karaman, N; Sicak, Y; Taskin-Tok, T; Öztürk, M; Karaküçük-Iyidogan, A; Dikmen, M; Koçyigit-Kaymakçioglu, B; Oruç-Emre, EE Gaziantep University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208300 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208300&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134130200 375981993 CHEMBL3884514 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50555456 OC(=O)c1ccc(cc1)\N=C\c1ccccc1O InChI=1S/C14H11NO3/c16-13-4-2-1-3-11(13)9-15-12-7-5-10(6-8-12)14(17)18/h1-9,16H,(H,17,18)/b15-9+ CZNXQJHAMQNIHB-OQLLNIDSSA-N 50212062 CHEMBL3939899 Cholinesterase 717200 ChEMBL 10.1016/j.bmc.2017.01.010 10.7270/Q27M0B3G 28126439 Shrivastava, SK; Srivastava, P; Upendra, TVR; Tripathi, PN; Sinha, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50212062 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50212062&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5474948 375983092 CHEMBL3939899 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50555462 COc1ccc(cc1)C(=N/c1cc(OC)cc(OC)c1)\c1ccccc1 InChI=1S/C22H21NO3/c1-24-19-11-9-17(10-12-19)22(16-7-5-4-6-8-16)23-18-13-20(25-2)15-21(14-18)26-3/h4-15H,1-3H3/b23-22- MLVLBESAKNNEFJ-FCQUAONHSA-N 50212065 CHEMBL3949725 Cholinesterase 284200 ChEMBL 10.1016/j.bmc.2017.01.010 10.7270/Q27M0B3G 28126439 Shrivastava, SK; Srivastava, P; Upendra, TVR; Tripathi, PN; Sinha, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50212065 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50212065&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134146823 375983095 CHEMBL3949725 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50555466 COc1ccc(cc1)C(=N/c1ccc(cc1)C(O)=O)\c1ccccc1 InChI=1S/C21H17NO3/c1-25-19-13-9-16(10-14-19)20(15-5-3-2-4-6-15)22-18-11-7-17(8-12-18)21(23)24/h2-14H,1H3,(H,23,24)/b22-20- UVMKYWHLHFWYBL-XDOYNYLZSA-N 50212064 CHEMBL3913423 Cholinesterase 291500 ChEMBL 10.1016/j.bmc.2017.01.010 10.7270/Q27M0B3G 28126439 Shrivastava, SK; Srivastava, P; Upendra, TVR; Tripathi, PN; Sinha, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50212064 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50212064&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134142634 375983094 CHEMBL3913423 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50555468 OC(=O)c1ccc(cc1)\N=C\c1ccc(cc1)[N+]([O-])=O InChI=1S/C14H10N2O4/c17-14(18)11-3-5-12(6-4-11)15-9-10-1-7-13(8-2-10)16(19)20/h1-9H,(H,17,18)/b15-9+ FICVOBBOEGEMHD-OQLLNIDSSA-N 50212066 CHEMBL3904419 Cholinesterase 217100 ChEMBL 10.1016/j.bmc.2017.01.010 10.7270/Q27M0B3G 28126439 Shrivastava, SK; Srivastava, P; Upendra, TVR; Tripathi, PN; Sinha, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50212066 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50212066&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 2306400 375983096 CHEMBL3904419 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50555542 OC(=O)c1ccc(cc1)\N=C\c1ccccc1[N+]([O-])=O InChI=1S/C14H10N2O4/c17-14(18)10-5-7-12(8-6-10)15-9-11-3-1-2-4-13(11)16(19)20/h1-9H,(H,17,18)/b15-9+ LYLHJEBTKAVHSR-OQLLNIDSSA-N 50212067 CHEMBL3932425 Cholinesterase 386900 ChEMBL 10.1016/j.bmc.2017.01.010 10.7270/Q27M0B3G 28126439 Shrivastava, SK; Srivastava, P; Upendra, TVR; Tripathi, PN; Sinha, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50212067 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50212067&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 15845926 375983097 CHEMBL3932425 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50555543 COc1cc(OC)cc(c1)\N=C\c1ccccc1[N+]([O-])=O InChI=1S/C15H14N2O4/c1-20-13-7-12(8-14(9-13)21-2)16-10-11-5-3-4-6-15(11)17(18)19/h3-10H,1-2H3/b16-10+ CPZBSEYJHFUMSR-MHWRWJLKSA-N 50212061 CHEMBL3940959 Cholinesterase 456700 ChEMBL 10.1016/j.bmc.2017.01.010 10.7270/Q27M0B3G 28126439 Shrivastava, SK; Srivastava, P; Upendra, TVR; Tripathi, PN; Sinha, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50212061 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50212061&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134145361 375983091 CHEMBL3940959 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50555544 COc1cc(OC)cc(c1)\N=C\c1ccc(cc1)[N+]([O-])=O InChI=1S/C15H14N2O4/c1-20-14-7-12(8-15(9-14)21-2)16-10-11-3-5-13(6-4-11)17(18)19/h3-10H,1-2H3/b16-10+ NTFTWACNCJWKBJ-MHWRWJLKSA-N 50212063 CHEMBL3921956 Cholinesterase 452400 ChEMBL 10.1016/j.bmc.2017.01.010 10.7270/Q27M0B3G 28126439 Shrivastava, SK; Srivastava, P; Upendra, TVR; Tripathi, PN; Sinha, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50212063 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50212063&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134140518 375983093 CHEMBL3921956 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50555545 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 15240 ChEMBL 10.1016/j.bmc.2017.01.010 10.7270/Q27M0B3G 28126439 Shrivastava, SK; Srivastava, P; Upendra, TVR; Tripathi, PN; Sinha, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50555582 COc1cc(OC)cc(c1)\N=C\c1cc(OC)c(OC)c(OC)c1 InChI=1S/C18H21NO5/c1-20-14-8-13(9-15(10-14)21-2)19-11-12-6-16(22-3)18(24-5)17(7-12)23-4/h6-11H,1-5H3/b19-11+ JMMLNWTXWWEMPV-YBFXNURJSA-N 50212069 CHEMBL3912967 Cholinesterase 328000 ChEMBL 10.1016/j.bmc.2017.01.010 10.7270/Q27M0B3G 28126439 Shrivastava, SK; Srivastava, P; Upendra, TVR; Tripathi, PN; Sinha, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50212069 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50212069&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 132961622 375983099 CHEMBL3912967 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50555583 OC(=O)c1ccc(cc1)\N=C\c1ccccc1 InChI=1S/C14H11NO2/c16-14(17)12-6-8-13(9-7-12)15-10-11-4-2-1-3-5-11/h1-10H,(H,16,17)/b15-10+ MREPJQZHXSDMKL-XNTDXEJSSA-N 50299292 4-(benzylideneamino)benzoic acid::CHEMBL567820 Cholinesterase 502100 ChEMBL 10.1016/j.bmc.2017.01.010 10.7270/Q27M0B3G 28126439 Shrivastava, SK; Srivastava, P; Upendra, TVR; Tripathi, PN; Sinha, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50299292 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50299292&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 687887 104140821 CHEMBL567820 ZINC00056233 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50555585 COc1cc(\C=N\c2ccc(cc2)C(O)=O)cc(OC)c1OC InChI=1S/C17H17NO5/c1-21-14-8-11(9-15(22-2)16(14)23-3)10-18-13-6-4-12(5-7-13)17(19)20/h4-10H,1-3H3,(H,19,20)/b18-10+ QVWMHFJKKZWRMW-VCHYOVAHSA-N 50212071 CHEMBL3941403 Cholinesterase 378200 ChEMBL 10.1016/j.bmc.2017.01.010 10.7270/Q27M0B3G 28126439 Shrivastava, SK; Srivastava, P; Upendra, TVR; Tripathi, PN; Sinha, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50212071 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50212071&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3055054 375983101 CHEMBL3941403 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50555586 COc1cc(ccc1O)C(\C)=N\c1ccc(cc1)C(O)=O InChI=1S/C16H15NO4/c1-10(12-5-8-14(18)15(9-12)21-2)17-13-6-3-11(4-7-13)16(19)20/h3-9,18H,1-2H3,(H,19,20)/b17-10+ SSGKEWUICBVXPW-LICLKQGHSA-N 50212068 CHEMBL3950148 Cholinesterase 839000 ChEMBL 10.1016/j.bmc.2017.01.010 10.7270/Q27M0B3G 28126439 Shrivastava, SK; Srivastava, P; Upendra, TVR; Tripathi, PN; Sinha, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50212068 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50212068&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134147882 375983098 CHEMBL3950148 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50555587 COc1cc(OC)cc(c1)\N=C\c1ccccc1O InChI=1S/C15H15NO3/c1-18-13-7-12(8-14(9-13)19-2)16-10-11-5-3-4-6-15(11)17/h3-10,17H,1-2H3/b16-10+ NREPXPYVXIADHY-MHWRWJLKSA-N 50212070 CHEMBL3923000 Cholinesterase 746700 ChEMBL 10.1016/j.bmc.2017.01.010 10.7270/Q27M0B3G 28126439 Shrivastava, SK; Srivastava, P; Upendra, TVR; Tripathi, PN; Sinha, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50212070 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50212070&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 51047031 375983100 CHEMBL3923000 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543866 CCOC(=O)N1CCC(CC1)=NNC(=O)c1ccc(F)cc1C(F)(F)F InChI=1S/C16H17F4N3O3/c1-2-26-15(25)23-7-5-11(6-8-23)21-22-14(24)12-4-3-10(17)9-13(12)16(18,19)20/h3-4,9H,2,5-8H2,1H3,(H,22,24) UIFOPKVZWRVGEM-UHFFFAOYSA-N 50208291 CHEMBL3885095 Cholinesterase 99610 ChEMBL 10.1016/j.ejmech.2016.08.037 10.7270/Q2FF3VCJ 27592396 Karaman, N; Sicak, Y; Taskin-Tok, T; Öztürk, M; Karaküçük-Iyidogan, A; Dikmen, M; Koçyigit-Kaymakçioglu, B; Oruç-Emre, EE Gaziantep University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208291 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208291&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134130833 375981984 CHEMBL3885095 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543867 O=C(NN=C1CC(NC(C1)c1ccccc1)c1ccccc1)c1ccccc1 InChI=1S/C24H23N3O/c28-24(20-14-8-3-9-15-20)27-26-21-16-22(18-10-4-1-5-11-18)25-23(17-21)19-12-6-2-7-13-19/h1-15,22-23,25H,16-17H2,(H,27,28) MADTVHUKJREECX-UHFFFAOYSA-N 50208304 CHEMBL3884571 Cholinesterase 65960 ChEMBL 10.1016/j.ejmech.2016.08.037 10.7270/Q2FF3VCJ 27592396 Karaman, N; Sicak, Y; Taskin-Tok, T; Öztürk, M; Karaküçük-Iyidogan, A; Dikmen, M; Koçyigit-Kaymakçioglu, B; Oruç-Emre, EE Gaziantep University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208304 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208304&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134130409 375981997 CHEMBL3884571 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543868 Fc1ccc(cc1)C(=O)NN=C1CC(NC(C1)c1ccccc1)c1ccccc1 InChI=1S/C24H22FN3O/c25-20-13-11-19(12-14-20)24(29)28-27-21-15-22(17-7-3-1-4-8-17)26-23(16-21)18-9-5-2-6-10-18/h1-14,22-23,26H,15-16H2,(H,28,29) MMVBABLKLWKZPY-UHFFFAOYSA-N 50208308 CHEMBL3885249 Cholinesterase 72810 ChEMBL 10.1016/j.ejmech.2016.08.037 10.7270/Q2FF3VCJ 27592396 Karaman, N; Sicak, Y; Taskin-Tok, T; Öztürk, M; Karaküçük-Iyidogan, A; Dikmen, M; Koçyigit-Kaymakçioglu, B; Oruç-Emre, EE Gaziantep University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208308 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208308&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134131190 375982001 CHEMBL3885249 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543869 Cc1ccc(cc1)C(=O)NN=C1CC(NC(C1)c1ccccc1)c1ccccc1 InChI=1S/C25H25N3O/c1-18-12-14-21(15-13-18)25(29)28-27-22-16-23(19-8-4-2-5-9-19)26-24(17-22)20-10-6-3-7-11-20/h2-15,23-24,26H,16-17H2,1H3,(H,28,29) RTTQSGJLKJCOQE-UHFFFAOYSA-N 50208292 CHEMBL3885375 Cholinesterase 50100 ChEMBL 10.1016/j.ejmech.2016.08.037 10.7270/Q2FF3VCJ 27592396 Karaman, N; Sicak, Y; Taskin-Tok, T; Öztürk, M; Karaküçük-Iyidogan, A; Dikmen, M; Koçyigit-Kaymakçioglu, B; Oruç-Emre, EE Gaziantep University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208292 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208292&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134130458 375981985 CHEMBL3885375 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543870 FC(F)(F)c1ccc(cc1)C(=O)NN=C1CC(NC(C1)c1ccccc1)c1ccccc1 InChI=1S/C25H22F3N3O/c26-25(27,28)20-13-11-19(12-14-20)24(32)31-30-21-15-22(17-7-3-1-4-8-17)29-23(16-21)18-9-5-2-6-10-18/h1-14,22-23,29H,15-16H2,(H,31,32) ARKAWIUZGYLJJK-UHFFFAOYSA-N 50208296 CHEMBL3883629 Cholinesterase 99140 ChEMBL 10.1016/j.ejmech.2016.08.037 10.7270/Q2FF3VCJ 27592396 Karaman, N; Sicak, Y; Taskin-Tok, T; Öztürk, M; Karaküçük-Iyidogan, A; Dikmen, M; Koçyigit-Kaymakçioglu, B; Oruç-Emre, EE Gaziantep University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208296 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208296&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134131512 375981989 CHEMBL3883629 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543871 [O-][N+](=O)c1ccc(C(=O)NN=C2CC(NC(C2)c2ccccc2)c2ccccc2)c(c1)[N+]([O-])=O InChI=1S/C24H21N5O5/c30-24(20-12-11-19(28(31)32)15-23(20)29(33)34)27-26-18-13-21(16-7-3-1-4-8-16)25-22(14-18)17-9-5-2-6-10-17/h1-12,15,21-22,25H,13-14H2,(H,27,30) MUMOGPKSBMJVAC-UHFFFAOYSA-N 50208302 CHEMBL3883826 Cholinesterase 93900 ChEMBL 10.1016/j.ejmech.2016.08.037 10.7270/Q2FF3VCJ 27592396 Karaman, N; Sicak, Y; Taskin-Tok, T; Öztürk, M; Karaküçük-Iyidogan, A; Dikmen, M; Koçyigit-Kaymakçioglu, B; Oruç-Emre, EE Gaziantep University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208302 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208302&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134131099 375981995 CHEMBL3883826 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543872 Fc1ccc(C(=O)NN=C2CC(NC(C2)c2ccccc2)c2ccccc2)c(c1)C(F)(F)F InChI=1S/C25H21F4N3O/c26-18-11-12-20(21(13-18)25(27,28)29)24(33)32-31-19-14-22(16-7-3-1-4-8-16)30-23(15-19)17-9-5-2-6-10-17/h1-13,22-23,30H,14-15H2,(H,32,33) WBLAAOYAEKZCRC-UHFFFAOYSA-N 50208307 CHEMBL3883584 Cholinesterase 52380 ChEMBL 10.1016/j.ejmech.2016.08.037 10.7270/Q2FF3VCJ 27592396 Karaman, N; Sicak, Y; Taskin-Tok, T; Öztürk, M; Karaküçük-Iyidogan, A; Dikmen, M; Koçyigit-Kaymakçioglu, B; Oruç-Emre, EE Gaziantep University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208307 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208307&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134131501 375982000 CHEMBL3883584 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543875 [O-][N+](=O)c1ccc(cc1)C(=O)NN=C1CC(NC(C1)c1ccccc1)c1ccccc1 InChI=1S/C24H22N4O3/c29-24(19-11-13-21(14-12-19)28(30)31)27-26-20-15-22(17-7-3-1-4-8-17)25-23(16-20)18-9-5-2-6-10-18/h1-14,22-23,25H,15-16H2,(H,27,29) NUULJRBDTRBNRE-UHFFFAOYSA-N 50208306 CHEMBL3883957 Cholinesterase 86820 ChEMBL 10.1016/j.ejmech.2016.08.037 10.7270/Q2FF3VCJ 27592396 Karaman, N; Sicak, Y; Taskin-Tok, T; Öztürk, M; Karaküçük-Iyidogan, A; Dikmen, M; Koçyigit-Kaymakçioglu, B; Oruç-Emre, EE Gaziantep University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208306 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208306&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134129969 375981999 CHEMBL3883957 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543876 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 46030 ChEMBL 10.1016/j.ejmech.2016.08.037 10.7270/Q2FF3VCJ 27592396 Karaman, N; Sicak, Y; Taskin-Tok, T; Öztürk, M; Karaküçük-Iyidogan, A; Dikmen, M; Koçyigit-Kaymakçioglu, B; Oruç-Emre, EE Gaziantep University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543877 CCOC(=O)N1CCC(CC1)=NNC(=O)c1ccc(cc1F)C(F)(F)F InChI=1S/C16H17F4N3O3/c1-2-26-15(25)23-7-5-11(6-8-23)21-22-14(24)12-4-3-10(9-13(12)17)16(18,19)20/h3-4,9H,2,5-8H2,1H3,(H,22,24) RQXQZFCHXAWFLM-UHFFFAOYSA-N 50208309 CHEMBL3884675 Cholinesterase 95060 ChEMBL 10.1016/j.ejmech.2016.08.037 10.7270/Q2FF3VCJ 27592396 Karaman, N; Sicak, Y; Taskin-Tok, T; Öztürk, M; Karaküçük-Iyidogan, A; Dikmen, M; Koçyigit-Kaymakçioglu, B; Oruç-Emre, EE Gaziantep University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208309 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208309&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134130768 375982002 CHEMBL3884675 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543881 CCOC(=O)N1CCC(CC1)=NNC(=O)c1ccc(Cl)cc1 InChI=1S/C15H18ClN3O3/c1-2-22-15(21)19-9-7-13(8-10-19)17-18-14(20)11-3-5-12(16)6-4-11/h3-6H,2,7-10H2,1H3,(H,18,20) LIOZYIKAHRMYSG-UHFFFAOYSA-N 50208297 CHEMBL3885089 Cholinesterase 69490 ChEMBL 10.1016/j.ejmech.2016.08.037 10.7270/Q2FF3VCJ 27592396 Karaman, N; Sicak, Y; Taskin-Tok, T; Öztürk, M; Karaküçük-Iyidogan, A; Dikmen, M; Koçyigit-Kaymakçioglu, B; Oruç-Emre, EE Gaziantep University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208297 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208297&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 9060276 375981990 CHEMBL3885089 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543882 Clc1ccc(cc1)C(=O)NN=C1CC(NC(C1)c1ccccc1)c1ccccc1 InChI=1S/C24H22ClN3O/c25-20-13-11-19(12-14-20)24(29)28-27-21-15-22(17-7-3-1-4-8-17)26-23(16-21)18-9-5-2-6-10-18/h1-14,22-23,26H,15-16H2,(H,28,29) JHTUKDCFZIIUCG-UHFFFAOYSA-N 50208305 CHEMBL3884922 Cholinesterase 35300 ChEMBL 10.1016/j.ejmech.2016.08.037 10.7270/Q2FF3VCJ 27592396 Karaman, N; Sicak, Y; Taskin-Tok, T; Öztürk, M; Karaküçük-Iyidogan, A; Dikmen, M; Koçyigit-Kaymakçioglu, B; Oruç-Emre, EE Gaziantep University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208305 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208305&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134130972 375981998 CHEMBL3884922 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543884 CCOC(=O)N1CCC(CC1)=NNC(=O)c1ccc(cc1)[N+]([O-])=O InChI=1S/C15H18N4O5/c1-2-24-15(21)18-9-7-12(8-10-18)16-17-14(20)11-3-5-13(6-4-11)19(22)23/h3-6H,2,7-10H2,1H3,(H,17,20) OGMMTLKNRAOBNS-UHFFFAOYSA-N 50208303 CHEMBL3885314 Cholinesterase 155570 ChEMBL 10.1016/j.ejmech.2016.08.037 10.7270/Q2FF3VCJ 27592396 Karaman, N; Sicak, Y; Taskin-Tok, T; Öztürk, M; Karaküçük-Iyidogan, A; Dikmen, M; Koçyigit-Kaymakçioglu, B; Oruç-Emre, EE Gaziantep University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208303 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208303&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 9014958 375981996 CHEMBL3885314 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50543885 CCOC(=O)N1CCC(CC1)=NNC(=O)c1ccc(F)cc1 InChI=1S/C15H18FN3O3/c1-2-22-15(21)19-9-7-13(8-10-19)17-18-14(20)11-3-5-12(16)6-4-11/h3-6H,2,7-10H2,1H3,(H,18,20) JWWYAQWZOZFSBN-UHFFFAOYSA-N 50208301 CHEMBL3885058 Cholinesterase 113440 ChEMBL 10.1016/j.ejmech.2016.08.037 10.7270/Q2FF3VCJ 27592396 Karaman, N; Sicak, Y; Taskin-Tok, T; Öztürk, M; Karaküçük-Iyidogan, A; Dikmen, M; Koçyigit-Kaymakçioglu, B; Oruç-Emre, EE Gaziantep University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50208301 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50208301&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 9016706 375981994 CHEMBL3885058 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553249 Cl.C(Cn1c2CCCNCc2c2ccccc12)c1ccccc1 InChI=1S/C20H22N2/c1-2-7-16(8-3-1)12-14-22-19-10-5-4-9-17(19)18-15-21-13-6-11-20(18)22/h1-5,7-10,21H,6,11-15H2 ADDBZSDFPYZCRV-UHFFFAOYSA-N 50210768 CHEMBL3914751 Cholinesterase 1140 ChEMBL 10.1016/j.ejmech.2016.09.037 10.7270/Q2G44S9D 27688184 de Candia, M; Zaetta, G; Denora, N; Tricarico, D; Majellaro, M; Cellamare, S; Altomare, CD University of Bari"A. Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210768 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210768&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134143534 375982735 CHEMBL3914751 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50552531 Clc1ccccc1NC(=N)NC(=N)N1CCN(CC1)C(=N)NC(=N)Nc1ccccc1Cl InChI=1S/C20H24Cl2N10/c21-13-5-1-3-7-15(13)27-17(23)29-19(25)31-9-11-32(12-10-31)20(26)30-18(24)28-16-8-4-2-6-14(16)22/h1-8H,9-12H2,(H4,23,25,27,29)(H4,24,26,28,30) ZURHVEUHPFBNOE-UHFFFAOYSA-N 50210171 CHEMBL3978195 Cholinesterase 12700 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210171 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210171&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134151702 375982591 CHEMBL3978195 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553251 Ic1ccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2ccc(I)cc2)cc1 InChI=1S/C20H24I2N10/c21-13-1-5-15(6-2-13)27-17(23)29-19(25)31-9-11-32(12-10-31)20(26)30-18(24)28-16-7-3-14(22)4-8-16/h1-8H,9-12H2,(H4,23,25,27,29)(H4,24,26,28,30) XIKDNDCIYBBUOE-UHFFFAOYSA-N 50210782 CHEMBL3905115 Cholinesterase 310 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210782 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210782&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134135144 375982749 CHEMBL3905115 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553253 COc1cc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC InChI=1S/C26H38N10O6/c1-37-17-11-15(12-18(38-2)21(17)41-5)31-23(27)33-25(29)35-7-9-36(10-8-35)26(30)34-24(28)32-16-13-19(39-3)22(42-6)20(14-16)40-4/h11-14H,7-10H2,1-6H3,(H4,27,29,31,33)(H4,28,30,32,34) HJXLFJWQLBRGLE-UHFFFAOYSA-N 50210169 CHEMBL3959216 Cholinesterase 9030 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210169 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210169&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134155548 375982589 CHEMBL3959216 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553255 Clc1ccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2ccc(Cl)cc2)cc1 InChI=1S/C20H24Cl2N10/c21-13-1-5-15(6-2-13)27-17(23)29-19(25)31-9-11-32(12-10-31)20(26)30-18(24)28-16-7-3-14(22)4-8-16/h1-8H,9-12H2,(H4,23,25,27,29)(H4,24,26,28,30) YNCLPFSAZFGQCD-UHFFFAOYSA-N 50210775 Picloxydine Cholinesterase 9370 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210775 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210775&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5371549 375982742 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553256 Clc1cccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2cccc(Cl)c2)c1 InChI=1S/C20H24Cl2N10/c21-13-3-1-5-15(11-13)27-17(23)29-19(25)31-7-9-32(10-8-31)20(26)30-18(24)28-16-6-2-4-14(22)12-16/h1-6,11-12H,7-10H2,(H4,23,25,27,29)(H4,24,26,28,30) DIXVYOBIBCACKX-UHFFFAOYSA-N 50210787 CHEMBL3957684 Cholinesterase 740 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210787 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210787&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 6338179 375982754 CHEMBL3957684 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553258 Ic1cccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2cccc(I)c2)c1 InChI=1S/C20H24I2N10/c21-13-3-1-5-15(11-13)27-17(23)29-19(25)31-7-9-32(10-8-31)20(26)30-18(24)28-16-6-2-4-14(22)12-16/h1-6,11-12H,7-10H2,(H4,23,25,27,29)(H4,24,26,28,30) PBWAAJYRJOTWFC-UHFFFAOYSA-N 50210771 CHEMBL3941312 Cholinesterase 3040 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210771 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210771&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134145270 375982738 CHEMBL3941312 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553260 N=C(NC(=N)N1CCN(CC1)C(=N)NC(=N)Nc1ccccc1)Nc1ccccc1 InChI=1S/C20H26N10/c21-17(25-15-7-3-1-4-8-15)27-19(23)29-11-13-30(14-12-29)20(24)28-18(22)26-16-9-5-2-6-10-16/h1-10H,11-14H2,(H4,21,23,25,27)(H4,22,24,26,28) CSZRZZFDERCVRH-UHFFFAOYSA-N 50210769 CHEMBL3963893 Cholinesterase 950 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210769 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210769&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134151155 375982736 CHEMBL3963893 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553262 FC(F)(F)Oc1ccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2ccc(OC(F)(F)F)cc2)cc1 InChI=1S/C22H24F6N10O2/c23-21(24,25)39-15-5-1-13(2-6-15)33-17(29)35-19(31)37-9-11-38(12-10-37)20(32)36-18(30)34-14-3-7-16(8-4-14)40-22(26,27)28/h1-8H,9-12H2,(H4,29,31,33,35)(H4,30,32,34,36) AIAPWZRCQZHLIY-UHFFFAOYSA-N 50210776 CHEMBL3947927 Cholinesterase 3340 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210776 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210776&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134146789 375982743 CHEMBL3947927 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553264 Brc1ccccc1NC(=N)NC(=N)N1CCN(CC1)C(=N)NC(=N)Nc1ccccc1Br InChI=1S/C20H24Br2N10/c21-13-5-1-3-7-15(13)27-17(23)29-19(25)31-9-11-32(12-10-31)20(26)30-18(24)28-16-8-4-2-6-14(16)22/h1-8H,9-12H2,(H4,23,25,27,29)(H4,24,26,28,30) DLVYHKGKJSZZFH-UHFFFAOYSA-N 50210770 CHEMBL3897572 Cholinesterase 1250 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210770 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210770&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134133777 375982737 CHEMBL3897572 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553266 Brc1ccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2ccc(Br)cc2)cc1 InChI=1S/C20H24Br2N10/c21-13-1-5-15(6-2-13)27-17(23)29-19(25)31-9-11-32(12-10-31)20(26)30-18(24)28-16-7-3-14(22)4-8-16/h1-8H,9-12H2,(H4,23,25,27,29)(H4,24,26,28,30) PFJZXBKRVXIKEG-UHFFFAOYSA-N 50210170 CHEMBL3894580 Cholinesterase 610 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210170 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210170&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 6338181 375982590 CHEMBL3894580 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553269 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 2070 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553271 CC(C)(C)c1ccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2ccc(cc2)C(C)(C)C)cc1 InChI=1S/C28H42N10/c1-27(2,3)19-7-11-21(12-8-19)33-23(29)35-25(31)37-15-17-38(18-16-37)26(32)36-24(30)34-22-13-9-20(10-14-22)28(4,5)6/h7-14H,15-18H2,1-6H3,(H4,29,31,33,35)(H4,30,32,34,36) GKZFZZDAFYGRQR-UHFFFAOYSA-N 50210778 CHEMBL3922793 Cholinesterase 4410 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210778 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210778&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134140456 375982745 CHEMBL3922793 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553272 COc1ccccc1NC(=N)NC(=N)N1CCN(CC1)C(=N)NC(=N)Nc1ccccc1OC InChI=1S/C22H30N10O2/c1-33-17-9-5-3-7-15(17)27-19(23)29-21(25)31-11-13-32(14-12-31)22(26)30-20(24)28-16-8-4-6-10-18(16)34-2/h3-10H,11-14H2,1-2H3,(H4,23,25,27,29)(H4,24,26,28,30) BOXGPKAGNWVHRS-UHFFFAOYSA-N 50210777 CHEMBL3949522 Cholinesterase 33960 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210777 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210777&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134147776 375982744 CHEMBL3949522 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553273 COc1cccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2cccc(OC)c2)c1 InChI=1S/C22H30N10O2/c1-33-17-7-3-5-15(13-17)27-19(23)29-21(25)31-9-11-32(12-10-31)22(26)30-20(24)28-16-6-4-8-18(14-16)34-2/h3-8,13-14H,9-12H2,1-2H3,(H4,23,25,27,29)(H4,24,26,28,30) XENLQHPXZAUTNT-UHFFFAOYSA-N 50210785 CHEMBL3975982 Cholinesterase 3020 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210785 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210785&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134152566 375982752 CHEMBL3975982 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553274 Brc1cccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2cccc(Br)c2)c1 InChI=1S/C20H24Br2N10/c21-13-3-1-5-15(11-13)27-17(23)29-19(25)31-7-9-32(10-8-31)20(26)30-18(24)28-16-6-2-4-14(22)12-16/h1-6,11-12H,7-10H2,(H4,23,25,27,29)(H4,24,26,28,30) ZLRYRMQYXBEZIT-UHFFFAOYSA-N 50210781 CHEMBL3921743 Cholinesterase 10320 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210781 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210781&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134139892 375982748 CHEMBL3921743 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553275 COc1ccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2ccc(OC)cc2)cc1 InChI=1S/C22H30N10O2/c1-33-17-7-3-15(4-8-17)27-19(23)29-21(25)31-11-13-32(14-12-31)22(26)30-20(24)28-16-5-9-18(34-2)10-6-16/h3-10H,11-14H2,1-2H3,(H4,23,25,27,29)(H4,24,26,28,30) XGPJMZJKYNWFKH-UHFFFAOYSA-N 50210783 CHEMBL3940753 Cholinesterase 35130 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210783 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210783&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 20844723 375982750 CHEMBL3940753 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553276 Clc1ccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2ccc(Cl)cc2Cl)c(Cl)c1 InChI=1S/C20H22Cl4N10/c21-11-1-3-15(13(23)9-11)29-17(25)31-19(27)33-5-7-34(8-6-33)20(28)32-18(26)30-16-4-2-12(22)10-14(16)24/h1-4,9-10H,5-8H2,(H4,25,27,29,31)(H4,26,28,30,32) QOJPDZLAORGAEU-UHFFFAOYSA-N 50210773 CHEMBL3968731 Cholinesterase 410 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210773 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210773&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134151239 375982740 CHEMBL3968731 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553277 Fc1ccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2ccc(F)cc2)cc1 InChI=1S/C20H24F2N10/c21-13-1-5-15(6-2-13)27-17(23)29-19(25)31-9-11-32(12-10-31)20(26)30-18(24)28-16-7-3-14(22)4-8-16/h1-8H,9-12H2,(H4,23,25,27,29)(H4,24,26,28,30) JSVRPFBEQBIJIL-UHFFFAOYSA-N 50210780 CHEMBL3949066 Cholinesterase 1180 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210780 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210780&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 6338182 375982747 CHEMBL3949066 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553279 [O-][N+](=O)c1ccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2ccc(cc2)[N+]([O-])=O)cc1 InChI=1S/C20H24N12O4/c21-17(25-13-1-5-15(6-2-13)31(33)34)27-19(23)29-9-11-30(12-10-29)20(24)28-18(22)26-14-3-7-16(8-4-14)32(35)36/h1-8H,9-12H2,(H4,21,23,25,27)(H4,22,24,26,28) SPDPQNRBXLDTDZ-UHFFFAOYSA-N 50210772 CHEMBL3916022 Cholinesterase 22870 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210772 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210772&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134142685 375982739 CHEMBL3916022 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553281 Cc1ccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2ccc(C)cc2)cc1 InChI=1S/C22H30N10/c1-15-3-7-17(8-4-15)27-19(23)29-21(25)31-11-13-32(14-12-31)22(26)30-20(24)28-18-9-5-16(2)6-10-18/h3-10H,11-14H2,1-2H3,(H4,23,25,27,29)(H4,24,26,28,30) XOVYMAOCHFJDIB-UHFFFAOYSA-N 50210779 CHEMBL3950513 Cholinesterase 450 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210779 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210779&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 6338183 375982746 CHEMBL3950513 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553282 Fc1ccccc1NC(=N)NC(=N)N1CCN(CC1)C(=N)NC(=N)Nc1ccccc1F InChI=1S/C20H24F2N10/c21-13-5-1-3-7-15(13)27-17(23)29-19(25)31-9-11-32(12-10-31)20(26)30-18(24)28-16-8-4-2-6-14(16)22/h1-8H,9-12H2,(H4,23,25,27,29)(H4,24,26,28,30) SVAUEUFROJRERJ-UHFFFAOYSA-N 50210774 CHEMBL3964220 Cholinesterase 25490 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210774 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210774&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134150545 375982741 CHEMBL3964220 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553287 Fc1cccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2cccc(F)c2)c1 InChI=1S/C20H24F2N10/c21-13-3-1-5-15(11-13)27-17(23)29-19(25)31-7-9-32(10-8-31)20(26)30-18(24)28-16-6-2-4-14(22)12-16/h1-6,11-12H,7-10H2,(H4,23,25,27,29)(H4,24,26,28,30) UFDYZXHUXFXBJD-UHFFFAOYSA-N 50210786 CHEMBL3924020 Cholinesterase 1700 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210786 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210786&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134141444 375982753 CHEMBL3924020 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553290 Ic1ccccc1NC(=N)NC(=N)N1CCN(CC1)C(=N)NC(=N)Nc1ccccc1I InChI=1S/C20H24I2N10/c21-13-5-1-3-7-15(13)27-17(23)29-19(25)31-9-11-32(12-10-31)20(26)30-18(24)28-16-8-4-2-6-14(16)22/h1-8H,9-12H2,(H4,23,25,27,29)(H4,24,26,28,30) MNLZKBNLWQGHDR-UHFFFAOYSA-N 50210784 CHEMBL3913329 Cholinesterase 1960 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210784 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210784&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134142333 375982751 CHEMBL3913329 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553292 Ic1ccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2ccc(I)cc2)cc1 InChI=1S/C20H24I2N10/c21-13-1-5-15(6-2-13)27-17(23)29-19(25)31-9-11-32(12-10-31)20(26)30-18(24)28-16-7-3-14(22)4-8-16/h1-8H,9-12H2,(H4,23,25,27,29)(H4,24,26,28,30) XIKDNDCIYBBUOE-UHFFFAOYSA-N 50210782 CHEMBL3905115 Cholinesterase 2740 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210782 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210782&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134135144 375982749 CHEMBL3905115 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553295 Ic1ccccc1NC(=N)NC(=N)N1CCN(CC1)C(=N)NC(=N)Nc1ccccc1I InChI=1S/C20H24I2N10/c21-13-5-1-3-7-15(13)27-17(23)29-19(25)31-9-11-32(12-10-31)20(26)30-18(24)28-16-8-4-2-6-14(16)22/h1-8H,9-12H2,(H4,23,25,27,29)(H4,24,26,28,30) MNLZKBNLWQGHDR-UHFFFAOYSA-N 50210784 CHEMBL3913329 Cholinesterase 11190 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210784 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210784&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134142333 375982751 CHEMBL3913329 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553296 Clc1ccccc1NC(=N)NC(=N)N1CCN(CC1)C(=N)NC(=N)Nc1ccccc1Cl InChI=1S/C20H24Cl2N10/c21-13-5-1-3-7-15(13)27-17(23)29-19(25)31-9-11-32(12-10-31)20(26)30-18(24)28-16-8-4-2-6-14(16)22/h1-8H,9-12H2,(H4,23,25,27,29)(H4,24,26,28,30) ZURHVEUHPFBNOE-UHFFFAOYSA-N 50210171 CHEMBL3978195 Cholinesterase 1850 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210171 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210171&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134151702 375982591 CHEMBL3978195 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553299 FC(F)(F)Oc1ccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2ccc(OC(F)(F)F)cc2)cc1 InChI=1S/C22H24F6N10O2/c23-21(24,25)39-15-5-1-13(2-6-15)33-17(29)35-19(31)37-9-11-38(12-10-37)20(32)36-18(30)34-14-3-7-16(8-4-14)40-22(26,27)28/h1-8H,9-12H2,(H4,29,31,33,35)(H4,30,32,34,36) AIAPWZRCQZHLIY-UHFFFAOYSA-N 50210776 CHEMBL3947927 Cholinesterase >20000 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210776 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210776&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134146789 375982743 CHEMBL3947927 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553301 Brc1ccccc1NC(=N)NC(=N)N1CCN(CC1)C(=N)NC(=N)Nc1ccccc1Br InChI=1S/C20H24Br2N10/c21-13-5-1-3-7-15(13)27-17(23)29-19(25)31-9-11-32(12-10-31)20(26)30-18(24)28-16-8-4-2-6-14(16)22/h1-8H,9-12H2,(H4,23,25,27,29)(H4,24,26,28,30) DLVYHKGKJSZZFH-UHFFFAOYSA-N 50210770 CHEMBL3897572 Cholinesterase 12340 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210770 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210770&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134133777 375982737 CHEMBL3897572 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553302 N=C(NC(=N)N1CCN(CC1)C(=N)NC(=N)Nc1ccccc1)Nc1ccccc1 InChI=1S/C20H26N10/c21-17(25-15-7-3-1-4-8-15)27-19(23)29-11-13-30(14-12-29)20(24)28-18(22)26-16-9-5-2-6-10-16/h1-10H,11-14H2,(H4,21,23,25,27)(H4,22,24,26,28) CSZRZZFDERCVRH-UHFFFAOYSA-N 50210769 CHEMBL3963893 Cholinesterase >40000 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210769 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210769&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134151155 375982736 CHEMBL3963893 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553304 Brc1ccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2ccc(Br)cc2)cc1 InChI=1S/C20H24Br2N10/c21-13-1-5-15(6-2-13)27-17(23)29-19(25)31-9-11-32(12-10-31)20(26)30-18(24)28-16-7-3-14(22)4-8-16/h1-8H,9-12H2,(H4,23,25,27,29)(H4,24,26,28,30) PFJZXBKRVXIKEG-UHFFFAOYSA-N 50210170 CHEMBL3894580 Cholinesterase 3840 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210170 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210170&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 6338181 375982590 CHEMBL3894580 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553306 Ic1cccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2cccc(I)c2)c1 InChI=1S/C20H24I2N10/c21-13-3-1-5-15(11-13)27-17(23)29-19(25)31-7-9-32(10-8-31)20(26)30-18(24)28-16-6-2-4-14(22)12-16/h1-6,11-12H,7-10H2,(H4,23,25,27,29)(H4,24,26,28,30) PBWAAJYRJOTWFC-UHFFFAOYSA-N 50210771 CHEMBL3941312 Cholinesterase 210 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210771 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210771&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134145270 375982738 CHEMBL3941312 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553307 Clc1ccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2ccc(Cl)cc2)cc1 InChI=1S/C20H24Cl2N10/c21-13-1-5-15(6-2-13)27-17(23)29-19(25)31-9-11-32(12-10-31)20(26)30-18(24)28-16-7-3-14(22)4-8-16/h1-8H,9-12H2,(H4,23,25,27,29)(H4,24,26,28,30) YNCLPFSAZFGQCD-UHFFFAOYSA-N 50210775 Picloxydine Cholinesterase 620 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210775 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210775&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5371549 375982742 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553314 Fc1cccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2cccc(F)c2)c1 InChI=1S/C20H24F2N10/c21-13-3-1-5-15(11-13)27-17(23)29-19(25)31-7-9-32(10-8-31)20(26)30-18(24)28-16-6-2-4-14(22)12-16/h1-6,11-12H,7-10H2,(H4,23,25,27,29)(H4,24,26,28,30) UFDYZXHUXFXBJD-UHFFFAOYSA-N 50210786 CHEMBL3924020 Cholinesterase 32850 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210786 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210786&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134141444 375982753 CHEMBL3924020 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553316 COc1cccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2cccc(OC)c2)c1 InChI=1S/C22H30N10O2/c1-33-17-7-3-5-15(13-17)27-19(23)29-21(25)31-9-11-32(12-10-31)22(26)30-20(24)28-16-6-4-8-18(14-16)34-2/h3-8,13-14H,9-12H2,1-2H3,(H4,23,25,27,29)(H4,24,26,28,30) XENLQHPXZAUTNT-UHFFFAOYSA-N 50210785 CHEMBL3975982 Cholinesterase 54840 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210785 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210785&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134152566 375982752 CHEMBL3975982 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553319 COc1ccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2ccc(OC)cc2)cc1 InChI=1S/C22H30N10O2/c1-33-17-7-3-15(4-8-17)27-19(23)29-21(25)31-11-13-32(14-12-31)22(26)30-20(24)28-16-5-9-18(34-2)10-6-16/h3-10H,11-14H2,1-2H3,(H4,23,25,27,29)(H4,24,26,28,30) XGPJMZJKYNWFKH-UHFFFAOYSA-N 50210783 CHEMBL3940753 Cholinesterase 1780 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210783 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210783&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 20844723 375982750 CHEMBL3940753 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553320 Cc1ccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2ccc(C)cc2)cc1 InChI=1S/C22H30N10/c1-15-3-7-17(8-4-15)27-19(23)29-21(25)31-11-13-32(14-12-31)22(26)30-20(24)28-18-9-5-16(2)6-10-18/h3-10H,11-14H2,1-2H3,(H4,23,25,27,29)(H4,24,26,28,30) XOVYMAOCHFJDIB-UHFFFAOYSA-N 50210779 CHEMBL3950513 Cholinesterase 11800 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210779 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210779&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 6338183 375982746 CHEMBL3950513 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553321 Fc1ccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2ccc(F)cc2)cc1 InChI=1S/C20H24F2N10/c21-13-1-5-15(6-2-13)27-17(23)29-19(25)31-9-11-32(12-10-31)20(26)30-18(24)28-16-7-3-14(22)4-8-16/h1-8H,9-12H2,(H4,23,25,27,29)(H4,24,26,28,30) JSVRPFBEQBIJIL-UHFFFAOYSA-N 50210780 CHEMBL3949066 Cholinesterase 15180 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210780 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210780&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 6338182 375982747 CHEMBL3949066 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553322 Brc1cccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2cccc(Br)c2)c1 InChI=1S/C20H24Br2N10/c21-13-3-1-5-15(11-13)27-17(23)29-19(25)31-7-9-32(10-8-31)20(26)30-18(24)28-16-6-2-4-14(22)12-16/h1-6,11-12H,7-10H2,(H4,23,25,27,29)(H4,24,26,28,30) ZLRYRMQYXBEZIT-UHFFFAOYSA-N 50210781 CHEMBL3921743 Cholinesterase 230 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210781 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210781&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134139892 375982748 CHEMBL3921743 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553325 [O-][N+](=O)c1ccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2ccc(cc2)[N+]([O-])=O)cc1 InChI=1S/C20H24N12O4/c21-17(25-13-1-5-15(6-2-13)31(33)34)27-19(23)29-9-11-30(12-10-29)20(24)28-18(22)26-14-3-7-16(8-4-14)32(35)36/h1-8H,9-12H2,(H4,21,23,25,27)(H4,22,24,26,28) SPDPQNRBXLDTDZ-UHFFFAOYSA-N 50210772 CHEMBL3916022 Cholinesterase 10780 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210772 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210772&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134142685 375982739 CHEMBL3916022 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553326 Fc1ccccc1NC(=N)NC(=N)N1CCN(CC1)C(=N)NC(=N)Nc1ccccc1F InChI=1S/C20H24F2N10/c21-13-5-1-3-7-15(13)27-17(23)29-19(25)31-9-11-32(12-10-31)20(26)30-18(24)28-16-8-4-2-6-14(16)22/h1-8H,9-12H2,(H4,23,25,27,29)(H4,24,26,28,30) SVAUEUFROJRERJ-UHFFFAOYSA-N 50210774 CHEMBL3964220 Cholinesterase 6820 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210774 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210774&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134150545 375982741 CHEMBL3964220 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553328 Clc1ccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2ccc(Cl)cc2Cl)c(Cl)c1 InChI=1S/C20H22Cl4N10/c21-11-1-3-15(13(23)9-11)29-17(25)31-19(27)33-5-7-34(8-6-33)20(28)32-18(26)30-16-4-2-12(22)10-14(16)24/h1-4,9-10H,5-8H2,(H4,25,27,29,31)(H4,26,28,30,32) QOJPDZLAORGAEU-UHFFFAOYSA-N 50210773 CHEMBL3968731 Cholinesterase 7510 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210773 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210773&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134151239 375982740 CHEMBL3968731 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553329 CC(C)(C)c1ccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2ccc(cc2)C(C)(C)C)cc1 InChI=1S/C28H42N10/c1-27(2,3)19-7-11-21(12-8-19)33-23(29)35-25(31)37-15-17-38(18-16-37)26(32)36-24(30)34-22-13-9-20(10-14-22)28(4,5)6/h7-14H,15-18H2,1-6H3,(H4,29,31,33,35)(H4,30,32,34,36) GKZFZZDAFYGRQR-UHFFFAOYSA-N 50210778 CHEMBL3922793 Cholinesterase 120 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210778 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210778&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134140456 375982745 CHEMBL3922793 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553330 Clc1cccc(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)Nc2cccc(Cl)c2)c1 InChI=1S/C20H24Cl2N10/c21-13-3-1-5-15(11-13)27-17(23)29-19(25)31-7-9-32(10-8-31)20(26)30-18(24)28-16-6-2-4-14(22)12-16/h1-6,11-12H,7-10H2,(H4,23,25,27,29)(H4,24,26,28,30) DIXVYOBIBCACKX-UHFFFAOYSA-N 50210787 CHEMBL3957684 Cholinesterase 12240 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210787 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210787&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 6338179 375982754 CHEMBL3957684 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553333 COc1ccccc1NC(=N)NC(=N)N1CCN(CC1)C(=N)NC(=N)Nc1ccccc1OC InChI=1S/C22H30N10O2/c1-33-17-9-5-3-7-15(17)27-19(23)29-21(25)31-11-13-32(14-12-31)22(26)30-20(24)28-16-8-4-6-10-18(16)34-2/h3-10H,11-14H2,1-2H3,(H4,23,25,27,29)(H4,24,26,28,30) BOXGPKAGNWVHRS-UHFFFAOYSA-N 50210777 CHEMBL3949522 Cholinesterase 5200 ChEMBL 10.1016/j.ejmech.2016.09.051 10.7270/Q2RJ4MG6 27689726 Loesche, A; Wiese, J; Sommerwerk, S; Simon, V; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210777 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210777&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134147776 375982744 CHEMBL3949522 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553606 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 2.0 ChEMBL 10.1016/j.ejmech.2016.09.078 10.7270/Q22Z17QK 27721153 Panek, D; Wieckowska, A; Wichur, T; Bajda, M; Godyn, J; Jonczyk, J; Mika, K; Janockova, J; Soukup, O; Knez, D; Korabecny, J; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553690 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 1830 ChEMBL 10.1016/j.ejmech.2016.09.078 10.7270/Q22Z17QK 27721153 Panek, D; Wieckowska, A; Wichur, T; Bajda, M; Godyn, J; Jonczyk, J; Mika, K; Janockova, J; Soukup, O; Knez, D; Korabecny, J; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553696 COc1cc2C\C(=C/c3ccc(cc3)N3CCN(CC3)c3ccc(C)cc3C)C(=O)c2cc1OC InChI=1S/C30H32N2O3/c1-20-5-10-27(21(2)15-20)32-13-11-31(12-14-32)25-8-6-22(7-9-25)16-24-17-23-18-28(34-3)29(35-4)19-26(23)30(24)33/h5-10,15-16,18-19H,11-14,17H2,1-4H3/b24-16+ PTPWVJRBTQXHNO-LFVJCYFKSA-N 50210837 CHEMBL3916256 Cholinesterase 5132 ChEMBL 10.1016/j.ejmech.2016.09.057 10.7270/Q2Z89FJ1 27721157 Mishra, CB; Kumari, S; Manral, A; Prakash, A; Saini, V; Lynn, AM; Tiwari, M University of Delhi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210837 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210837&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134142174 375982800 CHEMBL3916256 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553702 Fc1cccc(CCn2c3CCCNC(=O)c3c3ccccc23)c1 InChI=1S/C20H19FN2O/c21-15-6-3-5-14(13-15)10-12-23-17-8-2-1-7-16(17)19-18(23)9-4-11-22-20(19)24/h1-3,5-8,13H,4,9-12H2,(H,22,24) KRPJPNQVNAQLEE-UHFFFAOYSA-N 50210854 CHEMBL3960040 Cholinesterase 1.5 ChEMBL 10.1016/j.ejmech.2016.09.037 10.7270/Q2G44S9D 27688184 de Candia, M; Zaetta, G; Denora, N; Tricarico, D; Majellaro, M; Cellamare, S; Altomare, CD University of Bari"A. Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210854 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210854&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134155051 375982817 CHEMBL3960040 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553703 O=C1NCCCc2c1c1ccccc1n2CCc1ccccc1 InChI=1S/C20H20N2O/c23-20-19-16-9-4-5-10-17(16)22(18(19)11-6-13-21-20)14-12-15-7-2-1-3-8-15/h1-5,7-10H,6,11-14H2,(H,21,23) MGCVMPGXEBMMCL-UHFFFAOYSA-N 50210852 CHEMBL3971112 Cholinesterase 24 ChEMBL 10.1016/j.ejmech.2016.09.037 10.7270/Q2G44S9D 27688184 de Candia, M; Zaetta, G; Denora, N; Tricarico, D; Majellaro, M; Cellamare, S; Altomare, CD University of Bari"A. Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210852 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210852&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134153533 375982815 CHEMBL3971112 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553704 Fc1ccc(CCn2c3CCCNC(=O)c3c3ccccc23)cc1 InChI=1S/C20H19FN2O/c21-15-9-7-14(8-10-15)11-13-23-17-5-2-1-4-16(17)19-18(23)6-3-12-22-20(19)24/h1-2,4-5,7-10H,3,6,11-13H2,(H,22,24) LTIQFVDJDQJRPP-UHFFFAOYSA-N 50210842 CHEMBL3919289 Cholinesterase 230 ChEMBL 10.1016/j.ejmech.2016.09.037 10.7270/Q2G44S9D 27688184 de Candia, M; Zaetta, G; Denora, N; Tricarico, D; Majellaro, M; Cellamare, S; Altomare, CD University of Bari"A. Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210842 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210842&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134140048 375982805 CHEMBL3919289 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553705 Cc1ccc(CCn2c3CCCNC(=O)c3c3ccccc23)cc1 InChI=1S/C21H22N2O/c1-15-8-10-16(11-9-15)12-14-23-18-6-3-2-5-17(18)20-19(23)7-4-13-22-21(20)24/h2-3,5-6,8-11H,4,7,12-14H2,1H3,(H,22,24) WVRIJJWQTMVCQA-UHFFFAOYSA-N 50210850 CHEMBL3979295 Cholinesterase 68200 ChEMBL 10.1016/j.ejmech.2016.09.037 10.7270/Q2G44S9D 27688184 de Candia, M; Zaetta, G; Denora, N; Tricarico, D; Majellaro, M; Cellamare, S; Altomare, CD University of Bari"A. Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210850 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210850&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134151540 375982813 CHEMBL3979295 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553706 O=C1CCCc2c1c1ccccc1n2CCc1ccccc1 InChI=1S/C20H19NO/c22-19-12-6-11-18-20(19)16-9-4-5-10-17(16)21(18)14-13-15-7-2-1-3-8-15/h1-5,7-10H,6,11-14H2 LWNZKUWDEYKUNL-UHFFFAOYSA-N 50210851 CHEMBL3962358 Cholinesterase 10000 ChEMBL 10.1016/j.ejmech.2016.09.037 10.7270/Q2G44S9D 27688184 de Candia, M; Zaetta, G; Denora, N; Tricarico, D; Majellaro, M; Cellamare, S; Altomare, CD University of Bari"A. Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210851 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210851&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134155516 375982814 CHEMBL3962358 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553708 Clc1ccc(CCn2c3CCCNC(=O)c3c3ccccc23)cc1 InChI=1S/C20H19ClN2O/c21-15-9-7-14(8-10-15)11-13-23-17-5-2-1-4-16(17)19-18(23)6-3-12-22-20(19)24/h1-2,4-5,7-10H,3,6,11-13H2,(H,22,24) BGXCXGKCOFGUOB-UHFFFAOYSA-N 50210849 CHEMBL3962431 Cholinesterase 1900 ChEMBL 10.1016/j.ejmech.2016.09.037 10.7270/Q2G44S9D 27688184 de Candia, M; Zaetta, G; Denora, N; Tricarico, D; Majellaro, M; Cellamare, S; Altomare, CD University of Bari"A. Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210849 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210849&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134155197 375982812 CHEMBL3962431 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553710 Clc1cccc(CCn2c3CCCNC(=O)c3c3ccccc23)c1 InChI=1S/C20H19ClN2O/c21-15-6-3-5-14(13-15)10-12-23-17-8-2-1-7-16(17)19-18(23)9-4-11-22-20(19)24/h1-3,5-8,13H,4,9-12H2,(H,22,24) KJZDDMXCCUUGJW-UHFFFAOYSA-N 50210847 CHEMBL3889911 Cholinesterase 65 ChEMBL 10.1016/j.ejmech.2016.09.037 10.7270/Q2G44S9D 27688184 de Candia, M; Zaetta, G; Denora, N; Tricarico, D; Majellaro, M; Cellamare, S; Altomare, CD University of Bari"A. Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210847 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210847&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134130655 375982810 CHEMBL3889911 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553712 CC(=O)OCCCCn1c2CCCNC(=O)c2c2ccccc12 InChI=1S/C18H22N2O3/c1-13(21)23-12-5-4-11-20-15-8-3-2-7-14(15)17-16(20)9-6-10-19-18(17)22/h2-3,7-8H,4-6,9-12H2,1H3,(H,19,22) ZEGWLWUDMZIVNX-UHFFFAOYSA-N 50210844 CHEMBL3937926 Cholinesterase 10700 ChEMBL 10.1016/j.ejmech.2016.09.037 10.7270/Q2G44S9D 27688184 de Candia, M; Zaetta, G; Denora, N; Tricarico, D; Majellaro, M; Cellamare, S; Altomare, CD University of Bari"A. Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210844 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210844&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134149093 375982807 CHEMBL3937926 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553713 CCOC(=O)NCCCn1c2CCCNC(=O)c2c2ccccc12 InChI=1S/C18H23N3O3/c1-2-24-18(23)20-11-6-12-21-14-8-4-3-7-13(14)16-15(21)9-5-10-19-17(16)22/h3-4,7-8H,2,5-6,9-12H2,1H3,(H,19,22)(H,20,23) FQIMGJDLFVKXOB-UHFFFAOYSA-N 50210843 CHEMBL3971444 Cholinesterase 15000 ChEMBL 10.1016/j.ejmech.2016.09.037 10.7270/Q2G44S9D 27688184 de Candia, M; Zaetta, G; Denora, N; Tricarico, D; Majellaro, M; Cellamare, S; Altomare, CD University of Bari"A. Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210843 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210843&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134154499 375982806 CHEMBL3971444 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553714 CCOC(=O)CCCn1c2CCCNC(=O)c2c2ccccc12 InChI=1S/C18H22N2O3/c1-2-23-16(21)10-6-12-20-14-8-4-3-7-13(14)17-15(20)9-5-11-19-18(17)22/h3-4,7-8H,2,5-6,9-12H2,1H3,(H,19,22) QIBRRTAITYHQCW-UHFFFAOYSA-N 50210853 CHEMBL3900327 Cholinesterase 25700 ChEMBL 10.1016/j.ejmech.2016.09.037 10.7270/Q2G44S9D 27688184 de Candia, M; Zaetta, G; Denora, N; Tricarico, D; Majellaro, M; Cellamare, S; Altomare, CD University of Bari"A. Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210853 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210853&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134133184 375982816 CHEMBL3900327 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553716 CCCNC(=O)c1cn(CCc2ccccc2)c2ccccc12 InChI=1S/C20H22N2O/c1-2-13-21-20(23)18-15-22(19-11-7-6-10-17(18)19)14-12-16-8-4-3-5-9-16/h3-11,15H,2,12-14H2,1H3,(H,21,23) YRVAVYWGYKZDNC-UHFFFAOYSA-N 50210855 CHEMBL3935090 Cholinesterase 12600 ChEMBL 10.1016/j.ejmech.2016.09.037 10.7270/Q2G44S9D 27688184 de Candia, M; Zaetta, G; Denora, N; Tricarico, D; Majellaro, M; Cellamare, S; Altomare, CD University of Bari"A. Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210855 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210855&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134149352 375982818 CHEMBL3935090 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553719 Fc1ccc2n(CCc3ccccc3)c3CCCNC(=O)c3c2c1 InChI=1S/C20H19FN2O/c21-15-8-9-17-16(13-15)19-18(7-4-11-22-20(19)24)23(17)12-10-14-5-2-1-3-6-14/h1-3,5-6,8-9,13H,4,7,10-12H2,(H,22,24) CCBXYVOCHXEAGU-UHFFFAOYSA-N 50210848 CHEMBL3907854 Cholinesterase 28 ChEMBL 10.1016/j.ejmech.2016.09.037 10.7270/Q2G44S9D 27688184 de Candia, M; Zaetta, G; Denora, N; Tricarico, D; Majellaro, M; Cellamare, S; Altomare, CD University of Bari"A. Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210848 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210848&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134131934 375982811 CHEMBL3907854 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553721 CC(C)CCn1c2CCCNC(=O)c2c2ccccc12 InChI=1S/C17H22N2O/c1-12(2)9-11-19-14-7-4-3-6-13(14)16-15(19)8-5-10-18-17(16)20/h3-4,6-7,12H,5,8-11H2,1-2H3,(H,18,20) BQYNUGNKCXYXRM-UHFFFAOYSA-N 50210846 CHEMBL3910836 Cholinesterase 22300 ChEMBL 10.1016/j.ejmech.2016.09.037 10.7270/Q2G44S9D 27688184 de Candia, M; Zaetta, G; Denora, N; Tricarico, D; Majellaro, M; Cellamare, S; Altomare, CD University of Bari"A. Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210846 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210846&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134131979 375982809 CHEMBL3910836 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553724 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 11900 ChEMBL 10.1016/j.ejmech.2016.09.037 10.7270/Q2G44S9D 27688184 de Candia, M; Zaetta, G; Denora, N; Tricarico, D; Majellaro, M; Cellamare, S; Altomare, CD University of Bari"A. Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50553727 Fc1cccc(CCn2c3CCCNC(=O)c3c3ccccc23)c1 InChI=1S/C20H19FN2O/c21-15-6-3-5-14(13-15)10-12-23-17-8-2-1-7-16(17)19-18(23)9-4-11-22-20(19)24/h1-3,5-8,13H,4,9-12H2,(H,22,24) KRPJPNQVNAQLEE-UHFFFAOYSA-N 50210854 CHEMBL3960040 Cholinesterase 0.700000 ChEMBL 10.1016/j.ejmech.2016.09.037 10.7270/Q2G44S9D 27688184 de Candia, M; Zaetta, G; Denora, N; Tricarico, D; Majellaro, M; Cellamare, S; Altomare, CD University of Bari"A. Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50210854 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50210854&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134155051 375982817 CHEMBL3960040 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713127 C[C@@H](N)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(O)=O InChI=1S/C31H51NO4/c1-18(32)20-10-15-31(26(34)35)17-16-29(6)21(25(20)31)8-9-23-28(5)13-12-24(36-19(2)33)27(3,4)22(28)11-14-30(23,29)7/h18,20-25H,8-17,32H2,1-7H3,(H,34,35)/t18-,20+,21-,22+,23-,24+,25-,28+,29-,30-,31+/m1/s1 AHLSUHCHFBPXPL-WXLGKVTISA-N 50234799 CHEMBL4096275 Cholinesterase 2750 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234799 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234799&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137655301 384584854 CHEMBL4096275 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713128 COC(=O)[C@]12CC[C@@H]([C@@H](C)N)[C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2 InChI=1S/C32H53NO4/c1-19(33)21-11-16-32(27(35)36-8)18-17-30(6)22(26(21)32)9-10-24-29(5)14-13-25(37-20(2)34)28(3,4)23(29)12-15-31(24,30)7/h19,21-26H,9-18,33H2,1-8H3/t19-,21+,22-,23+,24-,25+,26-,29+,30-,31-,32+/m1/s1 BPAOPCJIWHFMFP-LAJFLCPKSA-N 50234782 CHEMBL4086293 Cholinesterase 90 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234782 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234782&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137644079 384584838 CHEMBL4086293 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713129 COC(=O)[C@]12CC[C@@H]([C@H](C)N)[C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2 InChI=1S/C32H53NO4/c1-19(33)21-11-16-32(27(35)36-8)18-17-30(6)22(26(21)32)9-10-24-29(5)14-13-25(37-20(2)34)28(3,4)23(29)12-15-31(24,30)7/h19,21-26H,9-18,33H2,1-8H3/t19-,21-,22+,23-,24+,25-,26+,29-,30+,31+,32-/m0/s1 BPAOPCJIWHFMFP-VTQIQSHQSA-N 50234783 CHEMBL4104205 Cholinesterase 230 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234783 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234783&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137658141 384584839 CHEMBL4104205 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713130 CCC(=O)O\N=C(/C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(=O)OC InChI=1S/C35H55NO6/c1-10-28(38)42-36-21(2)23-13-18-35(30(39)40-9)20-19-33(7)24(29(23)35)11-12-26-32(6)16-15-27(41-22(3)37)31(4,5)25(32)14-17-34(26,33)8/h23-27,29H,10-20H2,1-9H3/b36-21+/t23-,24+,25-,26+,27-,29+,32-,33+,34+,35-/m0/s1 DYSICABQDKIFIT-FNYALGGQSA-N 50234784 CHEMBL4066524 Cholinesterase >30000 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234784 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234784&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137631901 384584840 CHEMBL4066524 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713145 COC(=O)[C@]12CC[C@@H]([C@@H](C)N)[C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2 InChI=1S/C32H53NO4/c1-19(33)21-11-16-32(27(35)36-8)18-17-30(6)22(26(21)32)9-10-24-29(5)14-13-25(37-20(2)34)28(3,4)23(29)12-15-31(24,30)7/h19,21-26H,9-18,33H2,1-8H3/t19-,21+,22-,23+,24-,25+,26-,29+,30-,31-,32+/m1/s1 BPAOPCJIWHFMFP-LAJFLCPKSA-N 50234782 CHEMBL4086293 Cholinesterase 50 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234782 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234782&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137644079 384584838 CHEMBL4086293 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713146 COC(=O)[C@]12CC[C@@H]([C@H](C)N)[C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2 InChI=1S/C32H53NO4/c1-19(33)21-11-16-32(27(35)36-8)18-17-30(6)22(26(21)32)9-10-24-29(5)14-13-25(37-20(2)34)28(3,4)23(29)12-15-31(24,30)7/h19,21-26H,9-18,33H2,1-8H3/t19-,21-,22+,23-,24+,25-,26+,29-,30+,31+,32-/m0/s1 BPAOPCJIWHFMFP-VTQIQSHQSA-N 50234783 CHEMBL4104205 Cholinesterase 3890 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234783 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234783&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137658141 384584839 CHEMBL4104205 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713147 CC(=O)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@@H](N)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(=O)OCc1ccccc1 InChI=1S/C36H53NO3/c1-23(38)25-14-19-36(31(39)40-22-24-10-8-7-9-11-24)21-20-34(5)26(30(25)36)12-13-28-33(4)17-16-29(37)32(2,3)27(33)15-18-35(28,34)6/h7-11,25-30H,12-22,37H2,1-6H3/t25-,26+,27-,28+,29+,30+,33-,34+,35+,36-/m0/s1 UKGWDYVLLIGGSX-YGHXCOSRSA-N 50234788 CHEMBL4093124 Cholinesterase 5980 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234788 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234788&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137653018 384584844 CHEMBL4093124 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713210 CC(=O)[C@@H]1CC[C@]2(N)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12 InChI=1S/C28H47NO2/c1-17(30)18-9-14-28(29)16-15-26(5)19(23(18)28)7-8-21-25(4)12-11-22(31)24(2,3)20(25)10-13-27(21,26)6/h18-23,31H,7-16,29H2,1-6H3/t18-,19+,20-,21+,22-,23+,25-,26+,27+,28-/m0/s1 GXYWIFGERZLEPW-OBMFRFHBSA-N 50234791 CHEMBL4062563 Cholinesterase 38910 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234791 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234791&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137634579 384584846 CHEMBL4062563 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713385 CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC[C@@H]2[C@H]4[C@@H](CC[C@@]4(CC[C@@]32C)C(=O)NCCN)C(C)=O)C1(C)C InChI=1S/C33H54N2O4/c1-20(36)22-10-15-33(28(38)35-19-18-34)17-16-31(6)23(27(22)33)8-9-25-30(5)13-12-26(39-21(2)37)29(3,4)24(30)11-14-32(25,31)7/h22-27H,8-19,34H2,1-7H3,(H,35,38)/t22-,23+,24-,25+,26-,27+,30-,31+,32+,33-/m0/s1 RSOVTNYEAZHTKD-ODLWIBRJSA-N 50234792 CHEMBL4100709 Cholinesterase 17140 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234792 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234792&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137659829 384584847 CHEMBL4100709 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713386 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 4240 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713387 C[C@@H](N)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(O)=O InChI=1S/C31H51NO4/c1-18(32)20-10-15-31(26(34)35)17-16-29(6)21(25(20)31)8-9-23-28(5)13-12-24(36-19(2)33)27(3,4)22(28)11-14-30(23,29)7/h18,20-25H,8-17,32H2,1-7H3,(H,34,35)/t18-,20+,21-,22+,23-,24+,25-,28+,29-,30-,31+/m1/s1 AHLSUHCHFBPXPL-WXLGKVTISA-N 50234799 CHEMBL4096275 Cholinesterase 100 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234799 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234799&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137655301 384584854 CHEMBL4096275 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713388 C[C@@H](N)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(=O)OCc1ccccc1 InChI=1S/C36H55NO3/c1-23(37)25-14-19-36(31(39)40-22-24-10-8-7-9-11-24)21-20-34(5)26(30(25)36)12-13-28-33(4)17-16-29(38)32(2,3)27(33)15-18-35(28,34)6/h7-11,23,25-30,38H,12-22,37H2,1-6H3/t23-,25+,26-,27+,28-,29+,30-,33+,34-,35-,36+/m1/s1 BRMYJHHZBRQLRJ-HYKGQQBESA-N 50234800 CHEMBL4084140 Cholinesterase 70 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234800 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234800&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137646090 384584855 CHEMBL4084140 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713389 C[C@H](N)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(=O)OCc1ccccc1 InChI=1S/C38H57NO4/c1-24(39)27-15-20-38(33(41)42-23-26-11-9-8-10-12-26)22-21-36(6)28(32(27)38)13-14-30-35(5)18-17-31(43-25(2)40)34(3,4)29(35)16-19-37(30,36)7/h8-12,24,27-32H,13-23,39H2,1-7H3/t24-,27-,28+,29-,30+,31-,32+,35-,36+,37+,38-/m0/s1 OKYHOBSZADFCSF-PRAKDZCNSA-N 50234797 CHEMBL4062429 Cholinesterase 380 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234797 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234797&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137635971 384584852 CHEMBL4062429 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713390 C[C@@H](N)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(=O)OCc1ccccc1 InChI=1S/C38H57NO4/c1-24(39)27-15-20-38(33(41)42-23-26-11-9-8-10-12-26)22-21-36(6)28(32(27)38)13-14-30-35(5)18-17-31(43-25(2)40)34(3,4)29(35)16-19-37(30,36)7/h8-12,24,27-32H,13-23,39H2,1-7H3/t24-,27+,28-,29+,30-,31+,32-,35+,36-,37-,38+/m1/s1 OKYHOBSZADFCSF-IFYLCWDUSA-N 50234798 CHEMBL4091899 Cholinesterase 10.0 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234798 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234798&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137654172 384584853 CHEMBL4091899 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713391 C[C@@H](N)[C@@H]1CC[C@]2(COC(C)=O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12 InChI=1S/C33H55NO4/c1-20(34)23-11-16-33(19-37-21(2)35)18-17-31(7)24(28(23)33)9-10-26-30(6)14-13-27(38-22(3)36)29(4,5)25(30)12-15-32(26,31)8/h20,23-28H,9-19,34H2,1-8H3/t20-,23+,24-,25+,26-,27+,28-,30+,31-,32-,33-/m1/s1 MFXQEPNZKMYOJG-VIFUSZNRSA-N 50234803 CHEMBL4099629 Cholinesterase 60 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234803 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234803&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137659301 384584858 CHEMBL4099629 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713392 C[C@@H](N)[C@@H]1CC[C@]2(CO)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12 InChI=1S/C29H51NO2/c1-18(30)19-9-14-29(17-31)16-15-27(5)20(24(19)29)7-8-22-26(4)12-11-23(32)25(2,3)21(26)10-13-28(22,27)6/h18-24,31-32H,7-17,30H2,1-6H3/t18-,19+,20-,21+,22-,23+,24-,26+,27-,28-,29-/m1/s1 GWNHIYKSBLCVKG-NMCQIWJFSA-N 50234780 CHEMBL4081627 Cholinesterase 140 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234780 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234780&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137648576 384584836 CHEMBL4081627 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713393 COC(=O)[C@]12CC[C@@H]([C@H](C)NC(C)=O)[C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2 InChI=1S/C34H55NO5/c1-20(35-21(2)36)23-12-17-34(29(38)39-9)19-18-32(7)24(28(23)34)10-11-26-31(6)15-14-27(40-22(3)37)30(4,5)25(31)13-16-33(26,32)8/h20,23-28H,10-19H2,1-9H3,(H,35,36)/t20-,23-,24+,25-,26+,27-,28+,31-,32+,33+,34-/m0/s1 DHFQQSLQLNFUBK-MNISUIATSA-N 50234804 CHEMBL4089507 Cholinesterase >40000 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234804 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234804&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137641893 384584859 CHEMBL4089507 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713394 COC(=O)[C@]12CC[C@H]([C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(\C)=N\OC(C)=O InChI=1S/C34H53NO6/c1-20(35-41-22(3)37)23-12-17-34(29(38)39-9)19-18-32(7)24(28(23)34)10-11-26-31(6)15-14-27(40-21(2)36)30(4,5)25(31)13-16-33(26,32)8/h23-28H,10-19H2,1-9H3/b35-20+/t23-,24+,25-,26+,27-,28+,31-,32+,33+,34-/m0/s1 GPVVHWRHADOYCG-QZVHHEKXSA-N 50234785 CHEMBL4101798 Cholinesterase >15000 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234785 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234785&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137661494 384584841 CHEMBL4101798 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713395 COC(=O)[C@]12CC[C@H]([C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(\C)=N/O InChI=1S/C32H51NO5/c1-19(33-36)21-11-16-32(27(35)37-8)18-17-30(6)22(26(21)32)9-10-24-29(5)14-13-25(38-20(2)34)28(3,4)23(29)12-15-31(24,30)7/h21-26,36H,9-18H2,1-8H3/b33-19-/t21-,22+,23-,24+,25-,26+,29-,30+,31+,32-/m0/s1 GEGSJYUMWPWWMT-TWAIEWBISA-N 50234786 CHEMBL4075135 Cholinesterase >40000 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234786 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234786&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137650160 384584842 CHEMBL4075135 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713396 COC(=O)[C@]12CC[C@H]([C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(C)=O InChI=1S/C30H48O4/c1-18(31)19-10-15-30(25(33)34-7)17-16-28(5)20(24(19)30)8-9-22-27(4)13-12-23(32)26(2,3)21(27)11-14-29(22,28)6/h19-24,32H,8-17H2,1-7H3/t19-,20+,21-,22+,23-,24+,27-,28+,29+,30-/m0/s1 ZHIVKEAQDLRABF-FZFNOLFKSA-N 50058819 CHEMBL3325723 Cholinesterase >4000 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50058819 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50058819&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 107543 103954721 CHEMBL3325723 ZINC26170378 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713397 CC(=O)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](N)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(=O)OCc1ccccc1 InChI=1S/C36H53NO3/c1-23(38)25-14-19-36(31(39)40-22-24-10-8-7-9-11-24)21-20-34(5)26(30(25)36)12-13-28-33(4)17-16-29(37)32(2,3)27(33)15-18-35(28,34)6/h7-11,25-30H,12-22,37H2,1-6H3/t25-,26+,27-,28+,29-,30+,33-,34+,35+,36-/m0/s1 UKGWDYVLLIGGSX-KYIMJNNYSA-N 50234787 CHEMBL4072365 Cholinesterase 560 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234787 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234787&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137639634 384584843 CHEMBL4072365 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713398 CC(=O)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(=O)OCc1ccccc1 InChI=1S/C36H50O4/c1-23(37)25-14-19-36(31(39)40-22-24-10-8-7-9-11-24)21-20-34(5)26(30(25)36)12-13-28-33(4)17-16-29(38)32(2,3)27(33)15-18-35(28,34)6/h7-11,25-28,30H,12-22H2,1-6H3/t25-,26+,27-,28+,30+,33-,34+,35+,36-/m0/s1 KSHSPHPLCMNIBH-BYRIPPSCSA-N 50234802 CHEMBL4085251 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234802 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234802&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137648690 384584857 CHEMBL4085251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713399 CC(=O)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(=O)OCc1ccccc1 InChI=1S/C36H52O4/c1-23(37)25-14-19-36(31(39)40-22-24-10-8-7-9-11-24)21-20-34(5)26(30(25)36)12-13-28-33(4)17-16-29(38)32(2,3)27(33)15-18-35(28,34)6/h7-11,25-30,38H,12-22H2,1-6H3/t25-,26+,27-,28+,29-,30+,33-,34+,35+,36-/m0/s1 TZPWJFBZFIGPET-KYIMJNNYSA-N 50234789 CHEMBL4063629 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234789 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234789&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 90315054 384584845 CHEMBL4063629 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713400 CC(=O)[C@@H]1CC[C@]2(N)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12 InChI=1S/C28H47NO2/c1-17(30)18-9-14-28(29)16-15-26(5)19(23(18)28)7-8-21-25(4)12-11-22(31)24(2,3)20(25)10-13-27(21,26)6/h18-23,31H,7-16,29H2,1-6H3/t18-,19+,20-,21+,22-,23+,25-,26+,27+,28-/m0/s1 GXYWIFGERZLEPW-OBMFRFHBSA-N 50234791 CHEMBL4062563 Cholinesterase 6390 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234791 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234791&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137634579 384584846 CHEMBL4062563 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713401 CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC[C@@H]2[C@H]4[C@@H](CC[C@@]4(CC[C@@]32C)C(N)=O)C(C)=O)C1(C)C InChI=1S/C31H49NO4/c1-18(33)20-10-15-31(26(32)35)17-16-29(6)21(25(20)31)8-9-23-28(5)13-12-24(36-19(2)34)27(3,4)22(28)11-14-30(23,29)7/h20-25H,8-17H2,1-7H3,(H2,32,35)/t20-,21+,22-,23+,24-,25+,28-,29+,30+,31-/m0/s1 GNTQFXMOUJXIJM-JVRMVBBZSA-N 50234793 CHEMBL4082718 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234793 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234793&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137646263 384584848 CHEMBL4082718 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713402 CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC[C@@H]2[C@H]4[C@@H](CC[C@@]4(CC[C@@]32C)C(O)=O)C(C)=O)C1(C)C InChI=1S/C31H48O5/c1-18(32)20-10-15-31(26(34)35)17-16-29(6)21(25(20)31)8-9-23-28(5)13-12-24(36-19(2)33)27(3,4)22(28)11-14-30(23,29)7/h20-25H,8-17H2,1-7H3,(H,34,35)/t20-,21+,22-,23+,24-,25+,28-,29+,30+,31-/m0/s1 LGKVEEDZMZBMEV-JVRMVBBZSA-N 50234794 CHEMBL4081749 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234794 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234794&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 57045767 384584849 CHEMBL4081749 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713405 CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC[C@@H]2[C@H]4[C@@H](CC[C@@]4(CC[C@@]32C)C(=O)OCc2ccccc2)C(C)=O)C1(C)C InChI=1S/C38H54O5/c1-24(39)27-15-20-38(33(41)42-23-26-11-9-8-10-12-26)22-21-36(6)28(32(27)38)13-14-30-35(5)18-17-31(43-25(2)40)34(3,4)29(35)16-19-37(30,36)7/h8-12,27-32H,13-23H2,1-7H3/t27-,28+,29-,30+,31-,32+,35-,36+,37+,38-/m0/s1 HKCXUCQJGZDBKL-FSLXGGOMSA-N 50234796 CHEMBL4071069 Cholinesterase 33130 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234796 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234796&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137639820 384584851 CHEMBL4071069 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713738 COC(=O)[C@]12CC[C@@H]([C@@H](C)NC(C)=O)[C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2 InChI=1S/C34H55NO5/c1-20(35-21(2)36)23-12-17-34(29(38)39-9)19-18-32(7)24(28(23)34)10-11-26-31(6)15-14-27(40-22(3)37)30(4,5)25(31)13-16-33(26,32)8/h20,23-28H,10-19H2,1-9H3,(H,35,36)/t20-,23+,24-,25+,26-,27+,28-,31+,32-,33-,34+/m1/s1 DHFQQSLQLNFUBK-FDXLJYBGSA-N 50234781 CHEMBL4061347 Cholinesterase >4000 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234781 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234781&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137635445 384584837 CHEMBL4061347 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713741 COC(=O)[C@]12CC[C@H]([C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(\C)=N\O InChI=1S/C32H51NO5/c1-19(33-36)21-11-16-32(27(35)37-8)18-17-30(6)22(26(21)32)9-10-24-29(5)14-13-25(38-20(2)34)28(3,4)23(29)12-15-31(24,30)7/h21-26,36H,9-18H2,1-8H3/b33-19+/t21-,22+,23-,24+,25-,26+,29-,30+,31+,32-/m0/s1 GEGSJYUMWPWWMT-QGIQMELQSA-N 50234805 CHEMBL4063777 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234805 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234805&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137634441 384584860 CHEMBL4063777 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713744 CC(=O)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@@H](N)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(=O)OCc1ccccc1 InChI=1S/C36H53NO3/c1-23(38)25-14-19-36(31(39)40-22-24-10-8-7-9-11-24)21-20-34(5)26(30(25)36)12-13-28-33(4)17-16-29(37)32(2,3)27(33)15-18-35(28,34)6/h7-11,25-30H,12-22,37H2,1-6H3/t25-,26+,27-,28+,29+,30+,33-,34+,35+,36-/m0/s1 UKGWDYVLLIGGSX-YGHXCOSRSA-N 50234788 CHEMBL4093124 Cholinesterase 1800 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234788 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234788&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137653018 384584844 CHEMBL4093124 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713794 CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC[C@@H]2[C@H]4[C@@H](CC[C@@]4(CC[C@@]32C)C(=O)NCCN)C(C)=O)C1(C)C InChI=1S/C33H54N2O4/c1-20(36)22-10-15-33(28(38)35-19-18-34)17-16-31(6)23(27(22)33)8-9-25-30(5)13-12-26(39-21(2)37)29(3,4)24(30)11-14-32(25,31)7/h22-27H,8-19,34H2,1-7H3,(H,35,38)/t22-,23+,24-,25+,26-,27+,30-,31+,32+,33-/m0/s1 RSOVTNYEAZHTKD-ODLWIBRJSA-N 50234792 CHEMBL4100709 Cholinesterase 11940 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234792 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234792&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137659829 384584847 CHEMBL4100709 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713795 CC(=O)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(O)=O InChI=1S/C29H46O4/c1-17(30)18-9-14-29(24(32)33)16-15-27(5)19(23(18)29)7-8-21-26(4)12-11-22(31)25(2,3)20(26)10-13-28(21,27)6/h18-23,31H,7-16H2,1-6H3,(H,32,33)/t18-,19+,20-,21+,22-,23+,26-,27+,28+,29-/m0/s1 RVMPLOSJMIQORE-FUAAEJBOSA-N 50103962 (1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bS)-1-Acetyl-9-hydroxy-5a,5b,8,8,11a-pentamethyl-icosahydro-cyclopenta[a]chrysene-3a-carboxylic acid::1-Acetyl-9-hydroxy-5alpha,5beta,8,8,11alpha-pentamethylicosahydro-3rHcyclopenta[alpha]chrysene-3alpha-carboxylic Acid::CHEMBL80460::platanic acid Cholinesterase >50000 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50103962 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50103962&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 64980 103999957 65487 CHEMBL80460 ZINC26472270 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713810 C[C@@H](N)[C@@H]1CC[C@]2(COC(C)=O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12 InChI=1S/C33H55NO4/c1-20(34)23-11-16-33(19-37-21(2)35)18-17-31(7)24(28(23)33)9-10-26-30(6)14-13-27(38-22(3)36)29(4,5)25(30)12-15-32(26,31)8/h20,23-28H,9-19,34H2,1-8H3/t20-,23+,24-,25+,26-,27+,28-,30+,31-,32-,33-/m1/s1 MFXQEPNZKMYOJG-VIFUSZNRSA-N 50234803 CHEMBL4099629 Cholinesterase 370 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234803 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234803&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137659301 384584858 CHEMBL4099629 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713811 C[C@@H](N)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(=O)OCc1ccccc1 InChI=1S/C36H55NO3/c1-23(37)25-14-19-36(31(39)40-22-24-10-8-7-9-11-24)21-20-34(5)26(30(25)36)12-13-28-33(4)17-16-29(38)32(2,3)27(33)15-18-35(28,34)6/h7-11,23,25-30,38H,12-22,37H2,1-6H3/t23-,25+,26-,27+,28-,29+,30-,33+,34-,35-,36+/m1/s1 BRMYJHHZBRQLRJ-HYKGQQBESA-N 50234800 CHEMBL4084140 Cholinesterase 190 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234800 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234800&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137646090 384584855 CHEMBL4084140 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713812 COC(=O)[C@]12CC[C@@H](NC(C)=O)[C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2 InChI=1S/C32H51NO5/c1-19(34)33-22-11-16-32(27(36)37-8)18-17-30(6)21(26(22)32)9-10-24-29(5)14-13-25(38-20(2)35)28(3,4)23(29)12-15-31(24,30)7/h21-26H,9-18H2,1-8H3,(H,33,34)/t21-,22-,23+,24-,25+,26+,29+,30-,31-,32+/m1/s1 YFRGPCLZSSLMDA-PNQQEPAJSA-N 50234806 CHEMBL4094059 Cholinesterase >20000 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234806 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234806&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137655414 384584861 CHEMBL4094059 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713813 CC(=O)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](N)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(=O)OCc1ccccc1 InChI=1S/C36H53NO3/c1-23(38)25-14-19-36(31(39)40-22-24-10-8-7-9-11-24)21-20-34(5)26(30(25)36)12-13-28-33(4)17-16-29(37)32(2,3)27(33)15-18-35(28,34)6/h7-11,25-30H,12-22,37H2,1-6H3/t25-,26+,27-,28+,29-,30+,33-,34+,35+,36-/m0/s1 UKGWDYVLLIGGSX-KYIMJNNYSA-N 50234787 CHEMBL4072365 Cholinesterase 3500 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234787 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234787&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137639634 384584843 CHEMBL4072365 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713814 CC(=O)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(=O)NCCN InChI=1S/C31H52N2O3/c1-19(34)20-9-14-31(26(36)33-18-17-32)16-15-29(5)21(25(20)31)7-8-23-28(4)12-11-24(35)27(2,3)22(28)10-13-30(23,29)6/h20-25,35H,7-18,32H2,1-6H3,(H,33,36)/t20-,21+,22-,23+,24-,25+,28-,29+,30+,31-/m0/s1 FTANKQIZJOHADH-JVRMVBBZSA-N 50234779 CHEMBL4090532 Cholinesterase >110000 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234779 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234779&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137644038 384584835 CHEMBL4090532 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713815 CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC[C@@H]2[C@H]4[C@@H](CC[C@@]4(CC[C@@]32C)C(O)=O)C(\C)=N\O)C1(C)C InChI=1S/C31H49NO5/c1-18(32-36)20-10-15-31(26(34)35)17-16-29(6)21(25(20)31)8-9-23-28(5)13-12-24(37-19(2)33)27(3,4)22(28)11-14-30(23,29)7/h20-25,36H,8-17H2,1-7H3,(H,34,35)/b32-18+/t20-,21+,22-,23+,24-,25+,28-,29+,30+,31-/m0/s1 YJOCZVZYORIYKP-XINVUCMASA-N 50234801 CHEMBL4078221 Cholinesterase >40000 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234801 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234801&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137650064 384584856 CHEMBL4078221 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50688501 COC(=O)CC1N(C2CCCCC2)C(=Nc2ccccc12)N1CCN(C)CC1 InChI=1S/C22H32N4O2/c1-24-12-14-25(15-13-24)22-23-19-11-7-6-10-18(19)20(16-21(27)28-2)26(22)17-8-4-3-5-9-17/h6-7,10-11,17,20H,3-5,8-9,12-16H2,1-2H3 QTBHIJCMIXWSGR-UHFFFAOYSA-N 50232639 CHEMBL115066 Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2017.01.068 10.7270/Q2P271CH 28189420 Park, B; Nam, JH; Kim, JH; Kim, HJ; Onnis, V; Balboni, G; Lee, KT; Park, JH; Catto, M; Carotti, A; Lee, JY Kyung Hee University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50232639 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50232639&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44342130 384578156 CHEMBL115066 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50688509 CN1CCN(CC1)C1=Nc2ccccc2C(CC(=O)NCc2ccccc2)N1c1ccccc1 InChI=1S/C28H31N5O/c1-31-16-18-32(19-17-31)28-30-25-15-9-8-14-24(25)26(33(28)23-12-6-3-7-13-23)20-27(34)29-21-22-10-4-2-5-11-22/h2-15,26H,16-21H2,1H3,(H,29,34) MVQDDDPVGORFBZ-UHFFFAOYSA-N 50148173 CHEMBL326854::N-Benzyl-2-[2-(4-methyl-piperazin-1-yl)-3-phenyl-3,4-dihydro-quinazolin-4-yl]-acetamide::N-benzyl-2-(2-(4-methylpiperazin-1-yl)-3-phenyl-3,4-dihydroquinazolin-4-yl)acetamide Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2017.01.068 10.7270/Q2P271CH 28189420 Park, B; Nam, JH; Kim, JH; Kim, HJ; Onnis, V; Balboni, G; Lee, KT; Park, JH; Catto, M; Carotti, A; Lee, JY Kyung Hee University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50148173 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50148173&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11201837 104036539 CHEMBL326854 ZINC27081067 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50688513 COc1ccc(CNC(=O)CC2N(C(=Nc3ccccc23)N2CCN(CCN(C)C)CC2)c2ccc(cc2)-c2ccccc2)cc1 InChI=1S/C38H44N6O2/c1-41(2)21-22-42-23-25-43(26-24-42)38-40-35-12-8-7-11-34(35)36(27-37(45)39-28-29-13-19-33(46-3)20-14-29)44(38)32-17-15-31(16-18-32)30-9-5-4-6-10-30/h4-20,36H,21-28H2,1-3H3,(H,39,45) NVUOOHYUOQYRFG-UHFFFAOYSA-N 50232642 CHEMBL3093781 Cholinesterase 6100 ChEMBL 10.1016/j.bmcl.2017.01.068 10.7270/Q2P271CH 28189420 Park, B; Nam, JH; Kim, JH; Kim, HJ; Onnis, V; Balboni, G; Lee, KT; Park, JH; Catto, M; Carotti, A; Lee, JY Kyung Hee University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50232642 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50232642&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71660495 384578159 CHEMBL3093781 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50688531 COC(=O)CC1N(C(=Nc2ccccc12)N(C)CCCCCN)c1ccc(cc1)-c1ccccc1 InChI=1S/C29H34N4O2/c1-32(20-10-4-9-19-30)29-31-26-14-8-7-13-25(26)27(21-28(34)35-2)33(29)24-17-15-23(16-18-24)22-11-5-3-6-12-22/h3,5-8,11-18,27H,4,9-10,19-21,30H2,1-2H3 PSGCVUJGUZXNSS-UHFFFAOYSA-N 50232663 CHEMBL4081075 Cholinesterase 140 ChEMBL 10.1016/j.bmcl.2017.01.068 10.7270/Q2P271CH 28189420 Park, B; Nam, JH; Kim, JH; Kim, HJ; Onnis, V; Balboni, G; Lee, KT; Park, JH; Catto, M; Carotti, A; Lee, JY Kyung Hee University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50232663 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50232663&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 67498800 384578162 CHEMBL4081075 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50688532 Fc1ccc(CNC(=O)CC2N(C(=Nc3ccccc23)N2CCN(CCN3CCCC3)CC2)c2ccc(cc2)C2CCCCC2)cc1 InChI=1S/C39H49FN6O/c40-33-16-12-30(13-17-33)29-41-38(47)28-37-35-10-4-5-11-36(35)42-39(45-26-24-44(25-27-45)23-22-43-20-6-7-21-43)46(37)34-18-14-32(15-19-34)31-8-2-1-3-9-31/h4-5,10-19,31,37H,1-3,6-9,20-29H2,(H,41,47) FUTZHZIZLYMBRN-UHFFFAOYSA-N 50232641 CHEMBL4065933 Cholinesterase 2130 ChEMBL 10.1016/j.bmcl.2017.01.068 10.7270/Q2P271CH 28189420 Park, B; Nam, JH; Kim, JH; Kim, HJ; Onnis, V; Balboni, G; Lee, KT; Park, JH; Catto, M; Carotti, A; Lee, JY Kyung Hee University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50232641 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50232641&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 132609272 384578158 CHEMBL4065933 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50688541 CN(C)CCN1CCN(CC1)C1=Nc2ccccc2C(CC(=O)NCc2ccc(F)cc2)N1c1ccc(cc1)-c1ccccc1 InChI=1S/C37H41FN6O/c1-41(2)20-21-42-22-24-43(25-23-42)37-40-34-11-7-6-10-33(34)35(26-36(45)39-27-28-12-16-31(38)17-13-28)44(37)32-18-14-30(15-19-32)29-8-4-3-5-9-29/h3-19,35H,20-27H2,1-2H3,(H,39,45) UYJHSEVBDADVIO-UHFFFAOYSA-N 50232643 CHEMBL3093780 Cholinesterase 2600 ChEMBL 10.1016/j.bmcl.2017.01.068 10.7270/Q2P271CH 28189420 Park, B; Nam, JH; Kim, JH; Kim, HJ; Onnis, V; Balboni, G; Lee, KT; Park, JH; Catto, M; Carotti, A; Lee, JY Kyung Hee University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50232643 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50232643&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71660493 384578160 CHEMBL3093780 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50688544 CN(C)CCCCCN(C)C1=Nc2c(F)cc(F)cc2C(CC(=O)NCc2ccccc2)N1c1ccc(cc1)-c1ccccc1 InChI=1S/C37H41F2N5O/c1-42(2)21-11-6-12-22-43(3)37-41-36-32(23-30(38)24-33(36)39)34(25-35(45)40-26-27-13-7-4-8-14-27)44(37)31-19-17-29(18-20-31)28-15-9-5-10-16-28/h4-5,7-10,13-20,23-24,34H,6,11-12,21-22,25-26H2,1-3H3,(H,40,45) HXAIKCGBLJLXQU-UHFFFAOYSA-N 50232637 CHEMBL4061274 Cholinesterase 380 ChEMBL 10.1016/j.bmcl.2017.01.068 10.7270/Q2P271CH 28189420 Park, B; Nam, JH; Kim, JH; Kim, HJ; Onnis, V; Balboni, G; Lee, KT; Park, JH; Catto, M; Carotti, A; Lee, JY Kyung Hee University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50232637 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50232637&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137636153 384578154 CHEMBL4061274 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50688545 CN(CCCCCN)C1=Nc2ccccc2C(CC(=O)NCc2ccccc2)N1c1ccc(cc1)-c1ccccc1 InChI=1S/C35H39N5O/c1-39(24-12-4-11-23-36)35-38-32-18-10-9-17-31(32)33(25-34(41)37-26-27-13-5-2-6-14-27)40(35)30-21-19-29(20-22-30)28-15-7-3-8-16-28/h2-3,5-10,13-22,33H,4,11-12,23-26,36H2,1H3,(H,37,41) WQGVFXHBNLPUBY-UHFFFAOYSA-N 50232644 CHEMBL4067745 Cholinesterase 5300 ChEMBL 10.1016/j.bmcl.2017.01.068 10.7270/Q2P271CH 28189420 Park, B; Nam, JH; Kim, JH; Kim, HJ; Onnis, V; Balboni, G; Lee, KT; Park, JH; Catto, M; Carotti, A; Lee, JY Kyung Hee University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50232644 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50232644&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 25107452 384578161 CHEMBL4067745 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50688548 CN(C)CCCCCN(C)C1=Nc2ccccc2C(CC(=O)NCc2ccccc2)N1c1ccc(cc1)-c1ccccc1 InChI=1S/C37H43N5O/c1-40(2)25-13-6-14-26-41(3)37-39-34-20-12-11-19-33(34)35(27-36(43)38-28-29-15-7-4-8-16-29)42(37)32-23-21-31(22-24-32)30-17-9-5-10-18-30/h4-5,7-12,15-24,35H,6,13-14,25-28H2,1-3H3,(H,38,43) QVXCZTNUVKNCGU-UHFFFAOYSA-N 50222222 CHEMBL394956::KYS-05090::N-benzyl-2-(3-(biphenyl-4-yl)-2-((5-(dimethylamino)pentyl)(methyl)amino)-3,4-dihydroquinazolin-4-yl)acetamide::N-benzyl-2-{3-biphenyl-4-yl-2-[(5-dimethylamino-pentyl)-methyl-amino]-3,4-dihydro-quinazolin-4-yl}-acetamide Cholinesterase 62 ChEMBL 10.1016/j.bmcl.2017.01.068 10.7270/Q2P271CH 28189420 Park, B; Nam, JH; Kim, JH; Kim, HJ; Onnis, V; Balboni, G; Lee, KT; Park, JH; Catto, M; Carotti, A; Lee, JY Kyung Hee University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50222222 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50222222&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 23661603 104094638 CHEMBL394956 ZINC28824858 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50688550 Fc1ccc(CNC(=O)CC2N(C(=Nc3ccccc23)N2CCN(CCN3CCCC3)CC2)c2ccc(cc2)-c2ccccc2)cc1 InChI=1S/C39H43FN6O/c40-33-16-12-30(13-17-33)29-41-38(47)28-37-35-10-4-5-11-36(35)42-39(45-26-24-44(25-27-45)23-22-43-20-6-7-21-43)46(37)34-18-14-32(15-19-34)31-8-2-1-3-9-31/h1-5,8-19,37H,6-7,20-29H2,(H,41,47) BIODDABJQKPLQA-UHFFFAOYSA-N 50232664 CHEMBL4076211 Cholinesterase 1470 ChEMBL 10.1016/j.bmcl.2017.01.068 10.7270/Q2P271CH 28189420 Park, B; Nam, JH; Kim, JH; Kim, HJ; Onnis, V; Balboni, G; Lee, KT; Park, JH; Catto, M; Carotti, A; Lee, JY Kyung Hee University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50232664 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50232664&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137652520 384578163 CHEMBL4076211 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50688551 Fc1ccc(CNC(=O)CC2N(C(=Nc3c(F)cccc23)N2CCN(CCN3CCCC3)CC2)c2ccc(cc2)C2CCCCC2)cc1 InChI=1S/C39H48F2N6O/c40-32-15-11-29(12-16-32)28-42-37(48)27-36-34-9-6-10-35(41)38(34)43-39(46-25-23-45(24-26-46)22-21-44-19-4-5-20-44)47(36)33-17-13-31(14-18-33)30-7-2-1-3-8-30/h6,9-18,30,36H,1-5,7-8,19-28H2,(H,42,48) MLJATNOQNVVZNN-UHFFFAOYSA-N 50232665 CHEMBL4076174 Cholinesterase 2040 ChEMBL 10.1016/j.bmcl.2017.01.068 10.7270/Q2P271CH 28189420 Park, B; Nam, JH; Kim, JH; Kim, HJ; Onnis, V; Balboni, G; Lee, KT; Park, JH; Catto, M; Carotti, A; Lee, JY Kyung Hee University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50232665 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50232665&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137650907 384578164 CHEMBL4076174 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50688553 CN(CCCCCN1CCCC1)C1=Nc2ccccc2C(CC(=O)NCc2ccccc2)N1c1ccc(cc1)-c1ccccc1 InChI=1S/C39H45N5O/c1-42(25-11-4-12-26-43-27-13-14-28-43)39-41-36-20-10-9-19-35(36)37(29-38(45)40-30-31-15-5-2-6-16-31)44(39)34-23-21-33(22-24-34)32-17-7-3-8-18-32/h2-3,5-10,15-24,37H,4,11-14,25-30H2,1H3,(H,40,45) SXLKSZQOUGOJGV-UHFFFAOYSA-N 50197240 CHEMBL248088::KYS-05080::N-Benzyl-2-{3-biphenyl-4-yl-2-[methyl-(5-pyrrolidin-1-yl-pentyl)-amino]-3,4-dihydro-quinazolin-4-yl}-acetamide::N-benzyl-2-(3-(biphenyl-4-yl)-2-(methyl(5-(pyrrolidin-1-yl)pentyl)amino)-3,4-dihydroquinazolin-4-yl)acetamide Cholinesterase 45 ChEMBL 10.1016/j.bmcl.2017.01.068 10.7270/Q2P271CH 28189420 Park, B; Nam, JH; Kim, JH; Kim, HJ; Onnis, V; Balboni, G; Lee, KT; Park, JH; Catto, M; Carotti, A; Lee, JY Kyung Hee University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50197240 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50197240&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 16048644 104078670 CHEMBL248088 ZINC49949622 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50688554 CN(CCCCCN1CCCC1)C1=Nc2ccccc2C(CC(=O)NCc2ccccc2)N1c1ccc(cc1)-c1ccccc1 InChI=1S/C39H45N5O/c1-42(25-11-4-12-26-43-27-13-14-28-43)39-41-36-20-10-9-19-35(36)37(29-38(45)40-30-31-15-5-2-6-16-31)44(39)34-23-21-33(22-24-34)32-17-7-3-8-18-32/h2-3,5-10,15-24,37H,4,11-14,25-30H2,1H3,(H,40,45) SXLKSZQOUGOJGV-UHFFFAOYSA-N 50197240 CHEMBL248088::KYS-05080::N-Benzyl-2-{3-biphenyl-4-yl-2-[methyl-(5-pyrrolidin-1-yl-pentyl)-amino]-3,4-dihydro-quinazolin-4-yl}-acetamide::N-benzyl-2-(3-(biphenyl-4-yl)-2-(methyl(5-(pyrrolidin-1-yl)pentyl)amino)-3,4-dihydroquinazolin-4-yl)acetamide Cholinesterase 29 ChEMBL 10.1016/j.bmcl.2017.01.068 10.7270/Q2P271CH 28189420 Park, B; Nam, JH; Kim, JH; Kim, HJ; Onnis, V; Balboni, G; Lee, KT; Park, JH; Catto, M; Carotti, A; Lee, JY Kyung Hee University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50197240 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50197240&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 16048644 104078670 CHEMBL248088 ZINC49949622 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50688556 CN(C)CCCCCN(C)C1=Nc2ccccc2C(CC(=O)NCc2ccc(F)cc2)N1c1ccc(cc1)C1CCCCC1 InChI=1S/C37H48FN5O/c1-41(2)24-10-5-11-25-42(3)37-40-34-15-9-8-14-33(34)35(26-36(44)39-27-28-16-20-31(38)21-17-28)43(37)32-22-18-30(19-23-32)29-12-6-4-7-13-29/h8-9,14-23,29,35H,4-7,10-13,24-27H2,1-3H3,(H,39,44) GDGSKOUHHNEEIO-UHFFFAOYSA-N 50232640 CHEMBL4086668 Cholinesterase 400 ChEMBL 10.1016/j.bmcl.2017.01.068 10.7270/Q2P271CH 28189420 Park, B; Nam, JH; Kim, JH; Kim, HJ; Onnis, V; Balboni, G; Lee, KT; Park, JH; Catto, M; Carotti, A; Lee, JY Kyung Hee University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50232640 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50232640&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137645046 384578157 CHEMBL4086668 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50688558 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 2300 ChEMBL 10.1016/j.bmcl.2017.01.068 10.7270/Q2P271CH 28189420 Park, B; Nam, JH; Kim, JH; Kim, HJ; Onnis, V; Balboni, G; Lee, KT; Park, JH; Catto, M; Carotti, A; Lee, JY Kyung Hee University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50688559 CN(C)CCCCCN(C)C1=Nc2ccccc2C(CC(=O)NCc2ccccc2)N1c1ccc(cc1)-c1ccccc1 InChI=1S/C37H43N5O/c1-40(2)25-13-6-14-26-41(3)37-39-34-20-12-11-19-33(34)35(27-36(43)38-28-29-15-7-4-8-16-29)42(37)32-23-21-31(22-24-32)30-17-9-5-10-18-30/h4-5,7-12,15-24,35H,6,13-14,25-28H2,1-3H3,(H,38,43) QVXCZTNUVKNCGU-UHFFFAOYSA-N 50222222 CHEMBL394956::KYS-05090::N-benzyl-2-(3-(biphenyl-4-yl)-2-((5-(dimethylamino)pentyl)(methyl)amino)-3,4-dihydroquinazolin-4-yl)acetamide::N-benzyl-2-{3-biphenyl-4-yl-2-[(5-dimethylamino-pentyl)-methyl-amino]-3,4-dihydro-quinazolin-4-yl}-acetamide Cholinesterase 51 ChEMBL 10.1016/j.bmcl.2017.01.068 10.7270/Q2P271CH 28189420 Park, B; Nam, JH; Kim, JH; Kim, HJ; Onnis, V; Balboni, G; Lee, KT; Park, JH; Catto, M; Carotti, A; Lee, JY Kyung Hee University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50222222 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50222222&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 23661603 104094638 CHEMBL394956 ZINC28824858 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50688578 CN(C)CCCCCN(C)C1=Nc2ccccc2C(CC(=O)NCc2ccc(F)cc2)N1c1ccc(cc1)-c1ccc(F)cc1 InChI=1S/C37H41F2N5O/c1-42(2)23-7-4-8-24-43(3)37-41-34-10-6-5-9-33(34)35(25-36(45)40-26-27-11-17-30(38)18-12-27)44(37)32-21-15-29(16-22-32)28-13-19-31(39)20-14-28/h5-6,9-22,35H,4,7-8,23-26H2,1-3H3,(H,40,45) MRZKXWVAWNAMLW-UHFFFAOYSA-N 50232638 CHEMBL4084185 Cholinesterase 240 ChEMBL 10.1016/j.bmcl.2017.01.068 10.7270/Q2P271CH 28189420 Park, B; Nam, JH; Kim, JH; Kim, HJ; Onnis, V; Balboni, G; Lee, KT; Park, JH; Catto, M; Carotti, A; Lee, JY Kyung Hee University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50232638 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50232638&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137645397 384578155 CHEMBL4084185 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50712730 COc1ccc(cc1)C1c2ccc3cccnc3c2Oc2nc3CCCCc3c(N)c12 InChI=1S/C26H23N3O2/c1-30-17-11-8-15(9-12-17)21-19-13-10-16-5-4-14-28-24(16)25(19)31-26-22(21)23(27)18-6-2-3-7-20(18)29-26/h4-5,8-14,21H,2-3,6-7H2,1H3,(H2,27,29) UIYNBKZEXYKPIY-UHFFFAOYSA-N 50234768 CHEMBL4085738 Cholinesterase 1300 ChEMBL 10.1016/j.ejmech.2016.11.050 10.7270/Q21R6SR5 27918993 Dgachi, Y; Sokolov, O; Luzet, V; Godyn, J; Panek, D; Bonet, A; Martin, H; Iriepa, I; Moraleda, I; García-Iriepa, C; Janockova, J; Richert, L; Soukup, O; Malawska, B; Chabchoub, F; Marco-Contelles, J; Ismaili, L University of Sfax http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234768 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234768&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137642405 384584824 CHEMBL4085738 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50712731 COc1cccc(c1)C1c2ccc3cccnc3c2Oc2nc3CCCCc3c(N)c12 InChI=1S/C26H23N3O2/c1-30-17-8-4-6-16(14-17)21-19-12-11-15-7-5-13-28-24(15)25(19)31-26-22(21)23(27)18-9-2-3-10-20(18)29-26/h4-8,11-14,21H,2-3,9-10H2,1H3,(H2,27,29) VQICOKOVXNVBBA-UHFFFAOYSA-N 50234769 CHEMBL4095908 Cholinesterase 1300 ChEMBL 10.1016/j.ejmech.2016.11.050 10.7270/Q21R6SR5 27918993 Dgachi, Y; Sokolov, O; Luzet, V; Godyn, J; Panek, D; Bonet, A; Martin, H; Iriepa, I; Moraleda, I; García-Iriepa, C; Janockova, J; Richert, L; Soukup, O; Malawska, B; Chabchoub, F; Marco-Contelles, J; Ismaili, L University of Sfax http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234769 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234769&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137652924 384584825 CHEMBL4095908 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50712732 COc1ccccc1C1c2ccc3cccnc3c2Oc2nc3CCCCc3c(N)c12 InChI=1S/C26H23N3O2/c1-30-20-11-5-3-9-17(20)21-18-13-12-15-7-6-14-28-24(15)25(18)31-26-22(21)23(27)16-8-2-4-10-19(16)29-26/h3,5-7,9,11-14,21H,2,4,8,10H2,1H3,(H2,27,29) NTXYPVKZEBUMKH-UHFFFAOYSA-N 50234770 CHEMBL4077878 Cholinesterase 1510 ChEMBL 10.1016/j.ejmech.2016.11.050 10.7270/Q21R6SR5 27918993 Dgachi, Y; Sokolov, O; Luzet, V; Godyn, J; Panek, D; Bonet, A; Martin, H; Iriepa, I; Moraleda, I; García-Iriepa, C; Janockova, J; Richert, L; Soukup, O; Malawska, B; Chabchoub, F; Marco-Contelles, J; Ismaili, L University of Sfax http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234770 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234770&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137651228 384584826 CHEMBL4077878 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50712733 Nc1c2CCCCc2nc2Oc3c(ccc4cccnc34)C(c3ccccc3F)c12 InChI=1S/C25H20FN3O/c26-18-9-3-1-7-15(18)20-17-12-11-14-6-5-13-28-23(14)24(17)30-25-21(20)22(27)16-8-2-4-10-19(16)29-25/h1,3,5-7,9,11-13,20H,2,4,8,10H2,(H2,27,29) SQQDLLGEQWLTLB-UHFFFAOYSA-N 50234771 CHEMBL4094917 Cholinesterase 630 ChEMBL 10.1016/j.ejmech.2016.11.050 10.7270/Q21R6SR5 27918993 Dgachi, Y; Sokolov, O; Luzet, V; Godyn, J; Panek, D; Bonet, A; Martin, H; Iriepa, I; Moraleda, I; García-Iriepa, C; Janockova, J; Richert, L; Soukup, O; Malawska, B; Chabchoub, F; Marco-Contelles, J; Ismaili, L University of Sfax http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234771 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234771&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137654050 384584827 CHEMBL4094917 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50712742 Nc1c2CCCCc2nc2Oc3c(ccc4cccnc34)C(c3ccccc3)c12 InChI=1S/C25H21N3O/c26-22-17-10-4-5-11-19(17)28-25-21(22)20(15-7-2-1-3-8-15)18-13-12-16-9-6-14-27-23(16)24(18)29-25/h1-3,6-9,12-14,20H,4-5,10-11H2,(H2,26,28) KIKQXFWUWFWQLD-UHFFFAOYSA-N 50234772 CHEMBL4067497 Cholinesterase 1110 ChEMBL 10.1016/j.ejmech.2016.11.050 10.7270/Q21R6SR5 27918993 Dgachi, Y; Sokolov, O; Luzet, V; Godyn, J; Panek, D; Bonet, A; Martin, H; Iriepa, I; Moraleda, I; García-Iriepa, C; Janockova, J; Richert, L; Soukup, O; Malawska, B; Chabchoub, F; Marco-Contelles, J; Ismaili, L University of Sfax http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234772 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234772&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137634181 384584828 CHEMBL4067497 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50712811 Nc1c2CCCCc2nc2Oc3c(ccc4cccnc34)C(c3cccnc3Br)c12 InChI=1S/C24H19BrN4O/c25-23-16(7-4-12-28-23)18-15-10-9-13-5-3-11-27-21(13)22(15)30-24-19(18)20(26)14-6-1-2-8-17(14)29-24/h3-5,7,9-12,18H,1-2,6,8H2,(H2,26,29) FYZYSPFXKBMVEH-UHFFFAOYSA-N 50234773 CHEMBL4065862 Cholinesterase 2860 ChEMBL 10.1016/j.ejmech.2016.11.050 10.7270/Q21R6SR5 27918993 Dgachi, Y; Sokolov, O; Luzet, V; Godyn, J; Panek, D; Bonet, A; Martin, H; Iriepa, I; Moraleda, I; García-Iriepa, C; Janockova, J; Richert, L; Soukup, O; Malawska, B; Chabchoub, F; Marco-Contelles, J; Ismaili, L University of Sfax http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234773 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234773&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137631513 384584829 CHEMBL4065862 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50712812 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 0.050000 ChEMBL 10.1016/j.ejmech.2016.11.050 10.7270/Q21R6SR5 27918993 Dgachi, Y; Sokolov, O; Luzet, V; Godyn, J; Panek, D; Bonet, A; Martin, H; Iriepa, I; Moraleda, I; García-Iriepa, C; Janockova, J; Richert, L; Soukup, O; Malawska, B; Chabchoub, F; Marco-Contelles, J; Ismaili, L University of Sfax http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50712916 Cc1ccc(cc1)C1c2ccc3cccnc3c2Oc2nc3CCCCc3c(N)c12 InChI=1S/C26H23N3O/c1-15-8-10-16(11-9-15)21-19-13-12-17-5-4-14-28-24(17)25(19)30-26-22(21)23(27)18-6-2-3-7-20(18)29-26/h4-5,8-14,21H,2-3,6-7H2,1H3,(H2,27,29) QWBLOIWIJRGVSF-UHFFFAOYSA-N 50234775 CHEMBL4103664 Cholinesterase 530 ChEMBL 10.1016/j.ejmech.2016.11.050 10.7270/Q21R6SR5 27918993 Dgachi, Y; Sokolov, O; Luzet, V; Godyn, J; Panek, D; Bonet, A; Martin, H; Iriepa, I; Moraleda, I; García-Iriepa, C; Janockova, J; Richert, L; Soukup, O; Malawska, B; Chabchoub, F; Marco-Contelles, J; Ismaili, L University of Sfax http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234775 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234775&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137657871 384584831 CHEMBL4103664 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50712918 Nc1c2CCCCc2nc2Oc3c(ccc4cccnc34)C(c3ccccc3Br)c12 InChI=1S/C25H20BrN3O/c26-18-9-3-1-7-15(18)20-17-12-11-14-6-5-13-28-23(14)24(17)30-25-21(20)22(27)16-8-2-4-10-19(16)29-25/h1,3,5-7,9,11-13,20H,2,4,8,10H2,(H2,27,29) YSWHSIGBEGDENC-UHFFFAOYSA-N 50234777 CHEMBL4080318 Cholinesterase 210 ChEMBL 10.1016/j.ejmech.2016.11.050 10.7270/Q21R6SR5 27918993 Dgachi, Y; Sokolov, O; Luzet, V; Godyn, J; Panek, D; Bonet, A; Martin, H; Iriepa, I; Moraleda, I; García-Iriepa, C; Janockova, J; Richert, L; Soukup, O; Malawska, B; Chabchoub, F; Marco-Contelles, J; Ismaili, L University of Sfax http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234777 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234777&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137646391 384584833 CHEMBL4080318 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50712924 CC(=O)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(=O)NCCN InChI=1S/C31H52N2O3/c1-19(34)20-9-14-31(26(36)33-18-17-32)16-15-29(5)21(25(20)31)7-8-23-28(4)12-11-24(35)27(2,3)22(28)10-13-30(23,29)6/h20-25,35H,7-18,32H2,1-6H3,(H,33,36)/t20-,21+,22-,23+,24-,25+,28-,29+,30+,31-/m0/s1 FTANKQIZJOHADH-JVRMVBBZSA-N 50234779 CHEMBL4090532 Cholinesterase 8370 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234779 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234779&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137644038 384584835 CHEMBL4090532 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713024 C[C@@H](N)[C@@H]1CC[C@]2(CO)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12 InChI=1S/C29H51NO2/c1-18(30)19-9-14-29(17-31)16-15-27(5)20(24(19)29)7-8-22-26(4)12-11-23(32)25(2,3)21(26)10-13-28(22,27)6/h18-24,31-32H,7-17,30H2,1-6H3/t18-,19+,20-,21+,22-,23+,24-,26+,27-,28-,29-/m1/s1 GWNHIYKSBLCVKG-NMCQIWJFSA-N 50234780 CHEMBL4081627 Cholinesterase 1890 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234780 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234780&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137648576 384584836 CHEMBL4081627 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713025 CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC[C@@H]2[C@H]4[C@@H](CC[C@@]4(CC[C@@]32C)C(=O)OCc2ccccc2)C(C)=O)C1(C)C InChI=1S/C38H54O5/c1-24(39)27-15-20-38(33(41)42-23-26-11-9-8-10-12-26)22-21-36(6)28(32(27)38)13-14-30-35(5)18-17-31(43-25(2)40)34(3,4)29(35)16-19-37(30,36)7/h8-12,27-32H,13-23H2,1-7H3/t27-,28+,29-,30+,31-,32+,35-,36+,37+,38-/m0/s1 HKCXUCQJGZDBKL-FSLXGGOMSA-N 50234796 CHEMBL4071069 Cholinesterase >400000 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234796 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234796&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137639820 384584851 CHEMBL4071069 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713125 C[C@@H](N)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(=O)OCc1ccccc1 InChI=1S/C38H57NO4/c1-24(39)27-15-20-38(33(41)42-23-26-11-9-8-10-12-26)22-21-36(6)28(32(27)38)13-14-30-35(5)18-17-31(43-25(2)40)34(3,4)29(35)16-19-37(30,36)7/h8-12,24,27-32H,13-23,39H2,1-7H3/t24-,27+,28-,29+,30-,31+,32-,35+,36-,37-,38+/m1/s1 OKYHOBSZADFCSF-IFYLCWDUSA-N 50234798 CHEMBL4091899 Cholinesterase 400 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234798 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234798&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137654172 384584853 CHEMBL4091899 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50713126 C[C@H](N)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(=O)OCc1ccccc1 InChI=1S/C38H57NO4/c1-24(39)27-15-20-38(33(41)42-23-26-11-9-8-10-12-26)22-21-36(6)28(32(27)38)13-14-30-35(5)18-17-31(43-25(2)40)34(3,4)29(35)16-19-37(30,36)7/h8-12,24,27-32H,13-23,39H2,1-7H3/t24-,27-,28+,29-,30+,31-,32+,35-,36+,37+,38-/m0/s1 OKYHOBSZADFCSF-PRAKDZCNSA-N 50234797 CHEMBL4062429 Cholinesterase 6780 ChEMBL 10.1016/j.ejmech.2016.11.056 10.7270/Q2X0698K 27936444 Heller, L; Kahnt, M; Loesche, A; Grabandt, P; Schwarz, S; Brandt, W; Csuk, R Martin-Luther-University Halle-Wittenberg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50234797 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50234797&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137635971 384584852 CHEMBL4062429 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50852607 CN1c2ccccc2C(N2CCSCC2)c2ccccc12 InChI=1S/C18H20N2S/c1-19-16-8-4-2-6-14(16)18(20-10-12-21-13-11-20)15-7-3-5-9-17(15)19/h2-9,18H,10-13H2,1H3 GYHIIYHXQOHZPU-UHFFFAOYSA-N 50262660 CHEMBL4065259 Cholinesterase 840 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262660 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262660&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137631650 404341237 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50853978 F[B-](F)(F)F.C[n+]1c2ccccc2c(-c2cc(cc(c2O)C(C)(C)C)C(C)(C)C)c2ccccc12 InChI=1S/C28H31NO/c1-27(2,3)18-16-21(26(30)22(17-18)28(4,5)6)25-19-12-8-10-14-23(19)29(7)24-15-11-9-13-20(24)25/h8-17H,1-7H3/p+1 ROKAIEKBNXEGKC-UHFFFAOYSA-O 50262656 CHEMBL4067342 Cholinesterase 2740 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262656 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262656&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137631375 404341233 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50854014 F[B-](F)(F)F.C[n+]1c2ccccc2c(-c2ccc(N)cc2)c2ccccc12 InChI=1S/C20H16N2/c1-22-18-8-4-2-6-16(18)20(14-10-12-15(21)13-11-14)17-7-3-5-9-19(17)22/h2-13,21H,1H3/p+1 YFDBYNORSYBXHW-UHFFFAOYSA-O 50262666 CHEMBL4104952 Cholinesterase 39100 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262666 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262666&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137657249 404341240 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50740756 COc1cc(\C=C\C(=O)N2CCC(Cc3ccccc3)CC2)ccc1OCCCCCN1CCc2ccccc2C1 InChI=1S/C36H44N2O3/c1-40-35-27-30(15-17-36(39)38-23-18-31(19-24-38)26-29-10-4-2-5-11-29)14-16-34(35)41-25-9-3-8-21-37-22-20-32-12-6-7-13-33(32)28-37/h2,4-7,10-17,27,31H,3,8-9,18-26,28H2,1H3/b17-15+ VSHYNQQFOYDVKU-BMRADRMJSA-N 50237226 CHEMBL4100686 Cholinesterase 310 ChEMBL 10.1016/j.ejmech.2017.02.039 10.7270/Q2F76FVX 28279845 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Yang, Y; Bai, P; Leng, C; Xu, Q; Li, X; Tan, Z; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50237226 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50237226&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137658861 385453353 CHEMBL4100686 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50740781 COc1cc(\C=C\C(=O)N2CCC(Cc3ccccc3)CC2)ccc1OCCCCCCN1CCN(CC1)c1ncccn1 InChI=1S/C36H47N5O3/c1-43-34-29-31(13-15-35(42)40-21-16-32(17-22-40)28-30-10-5-4-6-11-30)12-14-33(34)44-27-8-3-2-7-20-39-23-25-41(26-24-39)36-37-18-9-19-38-36/h4-6,9-15,18-19,29,32H,2-3,7-8,16-17,20-28H2,1H3/b15-13+ DTOLYZUHZIFFNK-FYWRMAATSA-N 50237227 CHEMBL4093828 Cholinesterase 680 ChEMBL 10.1016/j.ejmech.2017.02.039 10.7270/Q2F76FVX 28279845 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Yang, Y; Bai, P; Leng, C; Xu, Q; Li, X; Tan, Z; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50237227 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50237227&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137653277 385453354 CHEMBL4093828 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50791628 O=C1CCc2ccc(OCCCCCN3CCN(CC3)c3ccccn3)cc2N1 InChI=1S/C23H30N4O2/c28-23-10-8-19-7-9-20(18-21(19)25-23)29-17-5-1-4-12-26-13-15-27(16-14-26)22-6-2-3-11-24-22/h2-3,6-7,9,11,18H,1,4-5,8,10,12-17H2,(H,25,28) BCSQVUXITOSZGN-UHFFFAOYSA-N 50252575 CHEMBL4086828 Cholinesterase 6200 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252575 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252575&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 13108122 401957596 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50791633 O=C1CCc2ccc(OCCCN(CC#C)Cc3ccccc3)cc2N1 InChI=1S/C22H24N2O2/c1-2-13-24(17-18-7-4-3-5-8-18)14-6-15-26-20-11-9-19-10-12-22(25)23-21(19)16-20/h1,3-5,7-9,11,16H,6,10,12-15,17H2,(H,23,25) GHOBXIIAMAHIFV-UHFFFAOYSA-N 50252573 CHEMBL4068237 Cholinesterase 29500 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252573 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252573&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137633264 401957594 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50791635 O=C1CCc2ccc(OCCCCCCN3CCN(Cc4ccccc4)CC3)cc2N1 InChI=1S/C26H35N3O2/c30-26-13-11-23-10-12-24(20-25(23)27-26)31-19-7-2-1-6-14-28-15-17-29(18-16-28)21-22-8-4-3-5-9-22/h3-5,8-10,12,20H,1-2,6-7,11,13-19,21H2,(H,27,30) OBHNCJRRIPBISW-UHFFFAOYSA-N 50252567 CHEMBL4063824 Cholinesterase 6600 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252567 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252567&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137636695 401957591 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50791637 CCN(CCCCCCOc1ccc2CCC(=O)Nc2c1)Cc1ccccc1 InChI=1S/C24H32N2O2/c1-2-26(19-20-10-6-5-7-11-20)16-8-3-4-9-17-28-22-14-12-21-13-15-24(27)25-23(21)18-22/h5-7,10-12,14,18H,2-4,8-9,13,15-17,19H2,1H3,(H,25,27) ITQBNPTWCHUZFK-UHFFFAOYSA-N 50252569 CHEMBL4083836 Cholinesterase 3600 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252569 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252569&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137646770 104105344 ZINC40423255 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50740817 COc1cc(\C=C\C(=O)N2CCC(Cc3ccccc3)CC2)ccc1OCCCCCN1CCN(CC1)c1ccccn1 InChI=1S/C36H46N4O3/c1-42-34-29-31(14-16-36(41)40-21-17-32(18-22-40)28-30-10-4-2-5-11-30)13-15-33(34)43-27-9-3-8-20-38-23-25-39(26-24-38)35-12-6-7-19-37-35/h2,4-7,10-16,19,29,32H,3,8-9,17-18,20-28H2,1H3/b16-14+ SJSFVWQBJGZJJF-JQIJEIRASA-N 50237542 CHEMBL4077421 Cholinesterase 1520 ChEMBL 10.1016/j.ejmech.2017.02.039 10.7270/Q2F76FVX 28279845 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Yang, Y; Bai, P; Leng, C; Xu, Q; Li, X; Tan, Z; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50237542 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50237542&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137649550 385453524 CHEMBL4077421 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50740825 COc1cc(\C=C\C(=O)N2CCC(Cc3ccccc3)CC2)ccc1OCCCN1CCc2ccccc2C1 InChI=1S/C34H40N2O3/c1-38-33-25-28(13-15-34(37)36-21-16-29(17-22-36)24-27-8-3-2-4-9-27)12-14-32(33)39-23-7-19-35-20-18-30-10-5-6-11-31(30)26-35/h2-6,8-15,25,29H,7,16-24,26H2,1H3/b15-13+ IPVNWUJUODYTSJ-FYWRMAATSA-N 50237538 CHEMBL4066362 Cholinesterase 120 ChEMBL 10.1016/j.ejmech.2017.02.039 10.7270/Q2F76FVX 28279845 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Yang, Y; Bai, P; Leng, C; Xu, Q; Li, X; Tan, Z; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50237538 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50237538&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137632823 385453520 CHEMBL4066362 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50740830 COc1cc(\C=C\C(=O)N2CCC(Cc3ccccc3)CC2)ccc1OCCCN1CCN(Cc2ccccc2)CC1 InChI=1S/C36H45N3O3/c1-41-35-28-31(14-16-36(40)39-20-17-32(18-21-39)27-30-9-4-2-5-10-30)13-15-34(35)42-26-8-19-37-22-24-38(25-23-37)29-33-11-6-3-7-12-33/h2-7,9-16,28,32H,8,17-27,29H2,1H3/b16-14+ LSEGQAWAGKQQAG-JQIJEIRASA-N 50237228 CHEMBL4102156 Cholinesterase 1220 ChEMBL 10.1016/j.ejmech.2017.02.039 10.7270/Q2F76FVX 28279845 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Yang, Y; Bai, P; Leng, C; Xu, Q; Li, X; Tan, Z; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50237228 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50237228&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137660133 385453355 CHEMBL4102156 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50740837 COc1cc(\C=C\C(=O)N2CCC(Cc3ccccc3)CC2)ccc1OCCCCN1CCc2ccccc2C1 InChI=1S/C35H42N2O3/c1-39-34-26-29(14-16-35(38)37-22-17-30(18-23-37)25-28-9-3-2-4-10-28)13-15-33(34)40-24-8-7-20-36-21-19-31-11-5-6-12-32(31)27-36/h2-6,9-16,26,30H,7-8,17-25,27H2,1H3/b16-14+ ZWIYUBCAUDUSLA-JQIJEIRASA-N 50237374 CHEMBL4085222 Cholinesterase 21 ChEMBL 10.1016/j.ejmech.2017.02.039 10.7270/Q2F76FVX 28279845 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Yang, Y; Bai, P; Leng, C; Xu, Q; Li, X; Tan, Z; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50237374 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50237374&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137648049 385453356 CHEMBL4085222 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50740852 COc1cc(\C=C\C(=O)N2CCC(Cc3ccccc3)CC2)ccc1O InChI=1S/C22H25NO3/c1-26-21-16-18(7-9-20(21)24)8-10-22(25)23-13-11-19(12-14-23)15-17-5-3-2-4-6-17/h2-10,16,19,24H,11-15H2,1H3/b10-8+ SYENGXOBRPEQKE-CSKARUKUSA-N 50237541 CHEMBL4097440 Cholinesterase 5700 ChEMBL 10.1016/j.ejmech.2017.02.039 10.7270/Q2F76FVX 28279845 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Yang, Y; Bai, P; Leng, C; Xu, Q; Li, X; Tan, Z; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50237541 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50237541&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137662009 385453523 CHEMBL4097440 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50740854 COc1cc(\C=C\C(=O)N2CCC(Cc3ccccc3)CC2)ccc1OCCCCCCN1CCN(Cc2ccccc2)CC1 InChI=1S/C39H51N3O3/c1-44-38-31-34(17-19-39(43)42-23-20-35(21-24-42)30-33-12-6-4-7-13-33)16-18-37(38)45-29-11-3-2-10-22-40-25-27-41(28-26-40)32-36-14-8-5-9-15-36/h4-9,12-19,31,35H,2-3,10-11,20-30,32H2,1H3/b19-17+ MFJRCRRBVAYYDT-HTXNQAPBSA-N 50237546 CHEMBL4098346 Cholinesterase 2200 ChEMBL 10.1016/j.ejmech.2017.02.039 10.7270/Q2F76FVX 28279845 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Yang, Y; Bai, P; Leng, C; Xu, Q; Li, X; Tan, Z; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50237546 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50237546&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137659717 385453528 CHEMBL4098346 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50740856 COc1cc(\C=C\C(=O)N2CCC(Cc3ccccc3)CC2)ccc1OCCCCN1CCN(CC1)c1ccccn1 InChI=1S/C35H44N4O3/c1-41-33-28-30(13-15-35(40)39-20-16-31(17-21-39)27-29-9-3-2-4-10-29)12-14-32(33)42-26-8-7-19-37-22-24-38(25-23-37)34-11-5-6-18-36-34/h2-6,9-15,18,28,31H,7-8,16-17,19-27H2,1H3/b15-13+ TUJGALDAMUJXGJ-FYWRMAATSA-N 50237544 CHEMBL4090419 Cholinesterase 1620 ChEMBL 10.1016/j.ejmech.2017.02.039 10.7270/Q2F76FVX 28279845 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Yang, Y; Bai, P; Leng, C; Xu, Q; Li, X; Tan, Z; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50237544 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50237544&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137644019 385453526 CHEMBL4090419 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50740858 COc1cc(\C=C\C(=O)N2CCC(Cc3ccccc3)CC2)ccc1OCCCCCN1CCN(CC1)c1ncccn1 InChI=1S/C35H45N5O3/c1-42-33-28-30(12-14-34(41)39-20-15-31(16-21-39)27-29-9-4-2-5-10-29)11-13-32(33)43-26-7-3-6-19-38-22-24-40(25-23-38)35-36-17-8-18-37-35/h2,4-5,8-14,17-18,28,31H,3,6-7,15-16,19-27H2,1H3/b14-12+ QGJXTJLWXDBWOD-WYMLVPIESA-N 50237225 CHEMBL4071307 Cholinesterase 2340 ChEMBL 10.1016/j.ejmech.2017.02.039 10.7270/Q2F76FVX 28279845 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Yang, Y; Bai, P; Leng, C; Xu, Q; Li, X; Tan, Z; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50237225 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50237225&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137638220 385453352 CHEMBL4071307 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50740859 COc1cc(\C=C\C(=O)N2CCC(Cc3ccccc3)CC2)ccc1OCCCCN1CCN(CC1)c1ncccn1 InChI=1S/C34H43N5O3/c1-41-32-27-29(11-13-33(40)38-19-14-30(15-20-38)26-28-8-3-2-4-9-28)10-12-31(32)42-25-6-5-18-37-21-23-39(24-22-37)34-35-16-7-17-36-34/h2-4,7-13,16-17,27,30H,5-6,14-15,18-26H2,1H3/b13-11+ IDQVABCQVKIOEW-ACCUITESSA-N 50237223 CHEMBL4092964 Cholinesterase 1560 ChEMBL 10.1016/j.ejmech.2017.02.039 10.7270/Q2F76FVX 28279845 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Yang, Y; Bai, P; Leng, C; Xu, Q; Li, X; Tan, Z; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50237223 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50237223&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137654211 385453351 CHEMBL4092964 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50740864 COc1cc(\C=C\C(=O)N2CCC(Cc3ccccc3)CC2)ccc1OCCCCN1CCN(Cc2ccccc2)CC1 InChI=1S/C37H47N3O3/c1-42-36-29-32(15-17-37(41)40-21-18-33(19-22-40)28-31-10-4-2-5-11-31)14-16-35(36)43-27-9-8-20-38-23-25-39(26-24-38)30-34-12-6-3-7-13-34/h2-7,10-17,29,33H,8-9,18-28,30H2,1H3/b17-15+ LPAWQOQABGZKTI-BMRADRMJSA-N 50237221 CHEMBL4095402 Cholinesterase 390 ChEMBL 10.1016/j.ejmech.2017.02.039 10.7270/Q2F76FVX 28279845 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Yang, Y; Bai, P; Leng, C; Xu, Q; Li, X; Tan, Z; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50237221 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50237221&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137653131 385453349 CHEMBL4095402 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50740867 COc1cc(\C=C\C(=O)N2CCC(Cc3ccccc3)CC2)ccc1OCCCCCCN1CCN(CC1)c1ccccn1 InChI=1S/C37H48N4O3/c1-43-35-30-32(15-17-37(42)41-22-18-33(19-23-41)29-31-11-5-4-6-12-31)14-16-34(35)44-28-10-3-2-9-21-39-24-26-40(27-25-39)36-13-7-8-20-38-36/h4-8,11-17,20,30,33H,2-3,9-10,18-19,21-29H2,1H3/b17-15+ UOTRFNUKBTXVLL-BMRADRMJSA-N 50237539 CHEMBL4059925 Cholinesterase 950 ChEMBL 10.1016/j.ejmech.2017.02.039 10.7270/Q2F76FVX 28279845 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Yang, Y; Bai, P; Leng, C; Xu, Q; Li, X; Tan, Z; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50237539 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50237539&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137637951 385453521 CHEMBL4059925 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50740870 COc1cc(\C=C\C(=O)N2CCC(Cc3ccccc3)CC2)ccc1OCCCN1CCN(CC1)c1ncccn1 InChI=1S/C33H41N5O3/c1-40-31-26-28(10-12-32(39)37-18-13-29(14-19-37)25-27-7-3-2-4-8-27)9-11-30(31)41-24-6-17-36-20-22-38(23-21-36)33-34-15-5-16-35-33/h2-5,7-12,15-16,26,29H,6,13-14,17-25H2,1H3/b12-10+ GWESSDSUHVWUKW-ZRDIBKRKSA-N 50237222 CHEMBL4074968 Cholinesterase 5120 ChEMBL 10.1016/j.ejmech.2017.02.039 10.7270/Q2F76FVX 28279845 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Yang, Y; Bai, P; Leng, C; Xu, Q; Li, X; Tan, Z; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50237222 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50237222&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137651099 385453350 CHEMBL4074968 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50740872 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 4760 ChEMBL 10.1016/j.ejmech.2017.02.039 10.7270/Q2F76FVX 28279845 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Yang, Y; Bai, P; Leng, C; Xu, Q; Li, X; Tan, Z; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50740874 COc1cc(\C=C\C(=O)N2CCC(Cc3ccccc3)CC2)ccc1OCCCCCN1CCN(Cc2ccccc2)CC1 InChI=1S/C38H49N3O3/c1-43-37-30-33(16-18-38(42)41-22-19-34(20-23-41)29-32-11-5-2-6-12-32)15-17-36(37)44-28-10-4-9-21-39-24-26-40(27-25-39)31-35-13-7-3-8-14-35/h2-3,5-8,11-18,30,34H,4,9-10,19-29,31H2,1H3/b18-16+ OKAVPNAIZIRLRQ-FBMGVBCBSA-N 50237540 CHEMBL4065298 Cholinesterase 2230 ChEMBL 10.1016/j.ejmech.2017.02.039 10.7270/Q2F76FVX 28279845 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Yang, Y; Bai, P; Leng, C; Xu, Q; Li, X; Tan, Z; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50237540 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50237540&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137632959 385453522 CHEMBL4065298 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50740879 COc1cc(\C=C\C(=O)N2CCC(Cc3ccccc3)CC2)ccc1OCCCN1CCN(CC1)c1ccccn1 InChI=1S/C34H42N4O3/c1-40-32-27-29(12-14-34(39)38-19-15-30(16-20-38)26-28-8-3-2-4-9-28)11-13-31(32)41-25-7-18-36-21-23-37(24-22-36)33-10-5-6-17-35-33/h2-6,8-14,17,27,30H,7,15-16,18-26H2,1H3/b14-12+ BRQWXEAPGVSJFQ-WYMLVPIESA-N 50237545 CHEMBL4087707 Cholinesterase 860 ChEMBL 10.1016/j.ejmech.2017.02.039 10.7270/Q2F76FVX 28279845 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Yang, Y; Bai, P; Leng, C; Xu, Q; Li, X; Tan, Z; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50237545 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50237545&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137645092 385453527 CHEMBL4087707 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50740880 COc1cc(\C=C\C(=O)N2CCC(Cc3ccccc3)CC2)ccc1OCCCCCCN1CCc2ccccc2C1 InChI=1S/C37H46N2O3/c1-41-36-28-31(16-18-37(40)39-24-19-32(20-25-39)27-30-11-5-4-6-12-30)15-17-35(36)42-26-10-3-2-9-22-38-23-21-33-13-7-8-14-34(33)29-38/h4-8,11-18,28,32H,2-3,9-10,19-27,29H2,1H3/b18-16+ JNNYJEKQVHDGIN-FBMGVBCBSA-N 50237543 CHEMBL4081846 Cholinesterase 880 ChEMBL 10.1016/j.ejmech.2017.02.039 10.7270/Q2F76FVX 28279845 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Yang, Y; Bai, P; Leng, C; Xu, Q; Li, X; Tan, Z; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50237543 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50237543&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137645992 385453525 CHEMBL4081846 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50726612 CN(C)C(=O)Oc1cc(OC(=O)N(C)C)cc(c1)C(O)CNC(C)(C)C InChI=1S/C18H29N3O5/c1-18(2,3)19-11-15(22)12-8-13(25-16(23)20(4)5)10-14(9-12)26-17(24)21(6)7/h8-10,15,19,22H,11H2,1-7H3 ANZXOIAKUNOVQU-UHFFFAOYSA-N 50235800 Bambuterol::CHEBI:553827 Cholinesterase 2400.000000 ChEMBL 10.1016/j.ejmech.2016.08.061 10.7270/Q2571F8X 27744187 Wu, J; Tian, Y; Wang, S; Pistolozzi, M; Jin, Y; Zhou, T; Roy, G; Xu, L; Tan, W South China University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50235800 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50235800&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54766 384991542 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50726613 Cl.CCC(C)(C)NCC(O)c1cc(OC(=O)N(C)C)cc(OC(=O)N(C)C)c1 InChI=1S/C19H31N3O5.ClH/c1-8-19(2,3)20-12-16(23)13-9-14(26-17(24)21(4)5)11-15(10-13)27-18(25)22(6)7;/h9-11,16,20,23H,8,12H2,1-7H3;1H JOIFZCSCZYFMFD-UHFFFAOYSA-N 50235799 CHEMBL4096024 Cholinesterase 2366.666667 ChEMBL 10.1016/j.ejmech.2016.08.061 10.7270/Q2571F8X 27744187 Wu, J; Tian, Y; Wang, S; Pistolozzi, M; Jin, Y; Zhou, T; Roy, G; Xu, L; Tan, W South China University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50235799 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50235799&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137654824 384991541 CHEMBL4096024 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50726614 Cl.CCN(C)C(=O)Oc1cc(OC(=O)N(C)CC)cc(c1)C(O)CNC(C)(C)CC InChI=1S/C21H35N3O5.ClH/c1-8-21(4,5)22-14-18(25)15-11-16(28-19(26)23(6)9-2)13-17(12-15)29-20(27)24(7)10-3;/h11-13,18,22,25H,8-10,14H2,1-7H3;1H OXLMGEHERDARNL-UHFFFAOYSA-N 50235801 CHEMBL4098455 Cholinesterase 2483.333333 ChEMBL 10.1016/j.ejmech.2016.08.061 10.7270/Q2571F8X 27744187 Wu, J; Tian, Y; Wang, S; Pistolozzi, M; Jin, Y; Zhou, T; Roy, G; Xu, L; Tan, W South China University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50235801 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50235801&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137661135 384991543 CHEMBL4098455 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50726620 Cl.CCN(C)C(=O)Oc1cc(OC(=O)N(C)CC)cc(c1)C(O)CN1CCCCC1 InChI=1S/C21H33N3O5.ClH/c1-5-22(3)20(26)28-17-12-16(19(25)15-24-10-8-7-9-11-24)13-18(14-17)29-21(27)23(4)6-2;/h12-14,19,25H,5-11,15H2,1-4H3;1H ZAXSCBVLAOJULG-UHFFFAOYSA-N 50235805 CHEMBL4100415 Cholinesterase 108 ChEMBL 10.1016/j.ejmech.2016.08.061 10.7270/Q2571F8X 27744187 Wu, J; Tian, Y; Wang, S; Pistolozzi, M; Jin, Y; Zhou, T; Roy, G; Xu, L; Tan, W South China University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50235805 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50235805&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137658616 384991547 CHEMBL4100415 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50726625 CN(C)C(=O)Oc1cc(OC(=O)N(C)C)cc(c1)C(O)CNC(C)(C)C InChI=1S/C18H29N3O5/c1-18(2,3)19-11-15(22)12-8-13(25-16(23)20(4)5)10-14(9-12)26-17(24)21(6)7/h8-10,15,19,22H,11H2,1-7H3 ANZXOIAKUNOVQU-UHFFFAOYSA-N 50235800 Bambuterol::CHEBI:553827 Cholinesterase 119 ChEMBL 10.1016/j.ejmech.2016.08.061 10.7270/Q2571F8X 27744187 Wu, J; Tian, Y; Wang, S; Pistolozzi, M; Jin, Y; Zhou, T; Roy, G; Xu, L; Tan, W South China University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50235800 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50235800&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54766 384991542 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50726641 Cl.CN(C)C(=O)Oc1cc(OC(=O)N(C)C)cc(c1)C(O)CNC(C)(C)C#N InChI=1S/C18H26N4O5.ClH/c1-18(2,11-19)20-10-15(23)12-7-13(26-16(24)21(3)4)9-14(8-12)27-17(25)22(5)6;/h7-9,15,20,23H,10H2,1-6H3;1H FTCQNVKZNSGODB-UHFFFAOYSA-N 50235802 CHEMBL4104228 Cholinesterase 1133 ChEMBL 10.1016/j.ejmech.2016.08.061 10.7270/Q2571F8X 27744187 Wu, J; Tian, Y; Wang, S; Pistolozzi, M; Jin, Y; Zhou, T; Roy, G; Xu, L; Tan, W South China University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50235802 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50235802&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137656480 384991544 CHEMBL4104228 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50726645 CN(C)C(=O)Oc1cc(OC(=O)N(C)C)cc(c1)C(O)CNc1ccccc1 InChI=1S/C20H25N3O5/c1-22(2)19(25)27-16-10-14(11-17(12-16)28-20(26)23(3)4)18(24)13-21-15-8-6-5-7-9-15/h5-12,18,21,24H,13H2,1-4H3 UCROBJNWHTYECS-UHFFFAOYSA-N 50235803 CHEMBL4065998 Cholinesterase 2402 ChEMBL 10.1016/j.ejmech.2016.08.061 10.7270/Q2571F8X 27744187 Wu, J; Tian, Y; Wang, S; Pistolozzi, M; Jin, Y; Zhou, T; Roy, G; Xu, L; Tan, W South China University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50235803 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50235803&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137633364 384991545 CHEMBL4065998 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50726648 CN(C)C(=O)Oc1cc(OC(=O)N(C)C)cc(c1)C(O)CNc1cccc(c1)C#C InChI=1S/C22H25N3O5/c1-6-15-8-7-9-17(10-15)23-14-20(26)16-11-18(29-21(27)24(2)3)13-19(12-16)30-22(28)25(4)5/h1,7-13,20,23,26H,14H2,2-5H3 NXHXIJRYYZJXJK-UHFFFAOYSA-N 50235804 CHEMBL4087400 Cholinesterase 686 ChEMBL 10.1016/j.ejmech.2016.08.061 10.7270/Q2571F8X 27744187 Wu, J; Tian, Y; Wang, S; Pistolozzi, M; Jin, Y; Zhou, T; Roy, G; Xu, L; Tan, W South China University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50235804 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50235804&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137642701 384991546 CHEMBL4087400 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50726652 CN(C)C(=O)Oc1cc(OC(=O)N(C)C)cc(c1)C(O)CNC1CCCC1 InChI=1S/C19H29N3O5/c1-21(2)18(24)26-15-9-13(10-16(11-15)27-19(25)22(3)4)17(23)12-20-14-7-5-6-8-14/h9-11,14,17,20,23H,5-8,12H2,1-4H3 NJYVMMACYXUWLA-UHFFFAOYSA-N 50235811 CHEMBL4103773 Cholinesterase 130 ChEMBL 10.1016/j.ejmech.2016.08.061 10.7270/Q2571F8X 27744187 Wu, J; Tian, Y; Wang, S; Pistolozzi, M; Jin, Y; Zhou, T; Roy, G; Xu, L; Tan, W South China University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50235811 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50235811&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137658395 384991553 CHEMBL4103773 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50726686 CN(C)C(=O)Oc1cc(OC(=O)N(C)C)cc(c1)C(O)CNC(C)(C)c1ccccc1 InChI=1S/C23H31N3O5/c1-23(2,17-10-8-7-9-11-17)24-15-20(27)16-12-18(30-21(28)25(3)4)14-19(13-16)31-22(29)26(5)6/h7-14,20,24,27H,15H2,1-6H3 VQOQSTLTDFPMIP-UHFFFAOYSA-N 50235798 CHEMBL4079521 Cholinesterase 476 ChEMBL 10.1016/j.ejmech.2016.08.061 10.7270/Q2571F8X 27744187 Wu, J; Tian, Y; Wang, S; Pistolozzi, M; Jin, Y; Zhou, T; Roy, G; Xu, L; Tan, W South China University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50235798 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50235798&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137651772 384991540 CHEMBL4079521 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50726688 Cl.CCC(C)(C)NCC(O)c1cc(OC(=O)N(C)C)cc(OC(=O)N(C)C)c1 InChI=1S/C19H31N3O5.ClH/c1-8-19(2,3)20-12-16(23)13-9-14(26-17(24)21(4)5)11-15(10-13)27-18(25)22(6)7;/h9-11,16,20,23H,8,12H2,1-7H3;1H JOIFZCSCZYFMFD-UHFFFAOYSA-N 50235799 CHEMBL4096024 Cholinesterase 126 ChEMBL 10.1016/j.ejmech.2016.08.061 10.7270/Q2571F8X 27744187 Wu, J; Tian, Y; Wang, S; Pistolozzi, M; Jin, Y; Zhou, T; Roy, G; Xu, L; Tan, W South China University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50235799 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50235799&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137654824 384991541 CHEMBL4096024 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50726718 CN(C)C(=O)Oc1cc(OC(=O)N(C)C)cc(c1)C(O)CNC1CCCCC1 InChI=1S/C20H31N3O5/c1-22(2)19(25)27-16-10-14(11-17(12-16)28-20(26)23(3)4)18(24)13-21-15-8-6-5-7-9-15/h10-12,15,18,21,24H,5-9,13H2,1-4H3 KZJKTDHDRFRRBI-UHFFFAOYSA-N 50235806 CHEMBL4068709 Cholinesterase 224 ChEMBL 10.1016/j.ejmech.2016.08.061 10.7270/Q2571F8X 27744187 Wu, J; Tian, Y; Wang, S; Pistolozzi, M; Jin, Y; Zhou, T; Roy, G; Xu, L; Tan, W South China University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50235806 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50235806&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137633130 384991548 CHEMBL4068709 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50726719 CN(C)C(=O)Oc1cc(OC(=O)N(C)C)cc(c1)C(O)CNc1ccc(I)cc1 InChI=1S/C20H24IN3O5/c1-23(2)19(26)28-16-9-13(10-17(11-16)29-20(27)24(3)4)18(25)12-22-15-7-5-14(21)6-8-15/h5-11,18,22,25H,12H2,1-4H3 OFEANRIJQRZOIX-UHFFFAOYSA-N 50235807 CHEMBL4088289 Cholinesterase 4699 ChEMBL 10.1016/j.ejmech.2016.08.061 10.7270/Q2571F8X 27744187 Wu, J; Tian, Y; Wang, S; Pistolozzi, M; Jin, Y; Zhou, T; Roy, G; Xu, L; Tan, W South China University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50235807 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50235807&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137643931 384991549 CHEMBL4088289 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50726720 CN(C)C(=O)Oc1cc(OC(=O)N(C)C)cc(c1)C(O)CN1CCCCC1 InChI=1S/C19H29N3O5/c1-20(2)18(24)26-15-10-14(11-16(12-15)27-19(25)21(3)4)17(23)13-22-8-6-5-7-9-22/h10-12,17,23H,5-9,13H2,1-4H3 PZBKLDOCHSGKAP-UHFFFAOYSA-N 50235808 CHEMBL4060055 Cholinesterase 100 ChEMBL 10.1016/j.ejmech.2016.08.061 10.7270/Q2571F8X 27744187 Wu, J; Tian, Y; Wang, S; Pistolozzi, M; Jin, Y; Zhou, T; Roy, G; Xu, L; Tan, W South China University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50235808 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50235808&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137636554 384991550 CHEMBL4060055 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50726721 CN(C)C(=O)Oc1cc(OC(=O)N(C)C)cc(c1)C(O)CN1CCCC1 InChI=1S/C18H27N3O5/c1-19(2)17(23)25-14-9-13(16(22)12-21-7-5-6-8-21)10-15(11-14)26-18(24)20(3)4/h9-11,16,22H,5-8,12H2,1-4H3 IYMBJIBCJWAVHN-UHFFFAOYSA-N 50235809 CHEMBL4080437 Cholinesterase 253 ChEMBL 10.1016/j.ejmech.2016.08.061 10.7270/Q2571F8X 27744187 Wu, J; Tian, Y; Wang, S; Pistolozzi, M; Jin, Y; Zhou, T; Roy, G; Xu, L; Tan, W South China University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50235809 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50235809&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137647354 384991551 CHEMBL4080437 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50726722 Cl.CCN(C)C(=O)Oc1cc(OC(=O)N(C)CC)cc(c1)C(O)CNC(C)(C)CC InChI=1S/C21H35N3O5.ClH/c1-8-21(4,5)22-14-18(25)15-11-16(28-19(26)23(6)9-2)13-17(12-15)29-20(27)24(7)10-3;/h11-13,18,22,25H,8-10,14H2,1-7H3;1H OXLMGEHERDARNL-UHFFFAOYSA-N 50235801 CHEMBL4098455 Cholinesterase 116 ChEMBL 10.1016/j.ejmech.2016.08.061 10.7270/Q2571F8X 27744187 Wu, J; Tian, Y; Wang, S; Pistolozzi, M; Jin, Y; Zhou, T; Roy, G; Xu, L; Tan, W South China University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50235801 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50235801&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137661135 384991543 CHEMBL4098455 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50726723 Cl.CCN(C)C(=O)Oc1cc(OC(=O)N(C)CC)cc(c1)C(O)CNC(C)(C)C InChI=1S/C20H33N3O5.ClH/c1-8-22(6)18(25)27-15-10-14(17(24)13-21-20(3,4)5)11-16(12-15)28-19(26)23(7)9-2;/h10-12,17,21,24H,8-9,13H2,1-7H3;1H MADIGIHNQLEZQB-UHFFFAOYSA-N 50235810 CHEMBL4087355 Cholinesterase 113 ChEMBL 10.1016/j.ejmech.2016.08.061 10.7270/Q2571F8X 27744187 Wu, J; Tian, Y; Wang, S; Pistolozzi, M; Jin, Y; Zhou, T; Roy, G; Xu, L; Tan, W South China University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50235810 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50235810&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137644124 384991552 CHEMBL4087355 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50743883 [Br-].COc1cc2CC(Cc3cc[n+](Cc4ccccc4Cl)cc3C(C)=O)C(=O)c2cc1OC InChI=1S/C26H25ClNO4.BrH/c1-16(29)22-15-28(14-18-6-4-5-7-23(18)27)9-8-17(22)10-20-11-19-12-24(31-2)25(32-3)13-21(19)26(20)30;/h4-9,12-13,15,20H,10-11,14H2,1-3H3;1H/q+1;/p-1 DMFFIHLWSWDUGK-UHFFFAOYSA-M 50238213 CHEMBL4066548 Cholinesterase 1915 ChEMBL 10.1021/acs.jmedchem.7b00702 10.7270/Q22V2JC5 28613859 Peauger, L; Azzouz, R; Gembus, V; Tîntas, ML; Sopková-de Oliveira Santos, J; Bohn, P; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50238213 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50238213&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137632831 385454119 CHEMBL4066548 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50743907 [Br-].COc1cc2CC(Cc3cc[n+](Cc4ccccc4C)cc3C(C)=O)C(=O)c2cc1OC InChI=1S/C27H28NO4.BrH/c1-17-7-5-6-8-20(17)15-28-10-9-19(24(16-28)18(2)29)11-22-12-21-13-25(31-3)26(32-4)14-23(21)27(22)30;/h5-10,13-14,16,22H,11-12,15H2,1-4H3;1H/q+1;/p-1 FRBSAUZZLIWNNT-UHFFFAOYSA-M 50238235 CHEMBL4081915 Cholinesterase 5930 ChEMBL 10.1021/acs.jmedchem.7b00702 10.7270/Q22V2JC5 28613859 Peauger, L; Azzouz, R; Gembus, V; Tîntas, ML; Sopková-de Oliveira Santos, J; Bohn, P; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50238235 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50238235&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118557975 385454138 CHEMBL4081915 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50743909 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 3.2 ChEMBL 10.1021/acs.jmedchem.7b00702 10.7270/Q22V2JC5 28613859 Peauger, L; Azzouz, R; Gembus, V; Tîntas, ML; Sopková-de Oliveira Santos, J; Bohn, P; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50743910 [Br-].COc1cc2CC(Cc3cc[n+](Cc4cccc(Cl)c4)cc3C(N)=O)C(=O)c2cc1OC InChI=1S/C25H23ClN2O4.BrH/c1-31-22-11-17-10-18(24(29)20(17)12-23(22)32-2)9-16-6-7-28(14-21(16)25(27)30)13-15-4-3-5-19(26)8-15;/h3-8,11-12,14,18H,9-10,13H2,1-2H3,(H-,27,30);1H FIWPFDRVIPYHQB-UHFFFAOYSA-N 50238228 CHEMBL4092048 Cholinesterase >10000 ChEMBL 10.1021/acs.jmedchem.7b00702 10.7270/Q22V2JC5 28613859 Peauger, L; Azzouz, R; Gembus, V; Tîntas, ML; Sopková-de Oliveira Santos, J; Bohn, P; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50238228 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50238228&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137653447 385454131 CHEMBL4092048 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50743911 [Br-].COc1cc2CC(Cc3cc[n+](Cc4ccccc4C)cc3C(N)=O)C(=O)c2cc1OC InChI=1S/C26H26N2O4.BrH/c1-16-6-4-5-7-18(16)14-28-9-8-17(22(15-28)26(27)30)10-20-11-19-12-23(31-2)24(32-3)13-21(19)25(20)29;/h4-9,12-13,15,20H,10-11,14H2,1-3H3,(H-,27,30);1H ALDUTPHPQQCBII-UHFFFAOYSA-N 50238215 CHEMBL4076930 Cholinesterase >10000 ChEMBL 10.1021/acs.jmedchem.7b00702 10.7270/Q22V2JC5 28613859 Peauger, L; Azzouz, R; Gembus, V; Tîntas, ML; Sopková-de Oliveira Santos, J; Bohn, P; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50238215 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50238215&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137651192 385454120 CHEMBL4076930 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50743912 [Br-].COC(=O)c1c[n+](Cc2ccccc2)ccc1CC1Cc2cc(OC)c(OC)cc2C1=O InChI=1S/C26H26NO5.BrH/c1-30-23-13-19-12-20(25(28)21(19)14-24(23)31-2)11-18-9-10-27(16-22(18)26(29)32-3)15-17-7-5-4-6-8-17;/h4-10,13-14,16,20H,11-12,15H2,1-3H3;1H/q+1;/p-1 AXUDBETUMFCILJ-UHFFFAOYSA-M 50238236 CHEMBL4068149 Cholinesterase 3055 ChEMBL 10.1021/acs.jmedchem.7b00702 10.7270/Q22V2JC5 28613859 Peauger, L; Azzouz, R; Gembus, V; Tîntas, ML; Sopková-de Oliveira Santos, J; Bohn, P; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50238236 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50238236&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137632143 385454139 CHEMBL4068149 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50743915 [Br-].CNC(=O)c1c[n+](Cc2ccccc2)ccc1CC1Cc2cc(OC)c(OC)cc2C1=O InChI=1S/C26H26N2O4.BrH/c1-27-26(30)22-16-28(15-17-7-5-4-6-8-17)10-9-18(22)11-20-12-19-13-23(31-2)24(32-3)14-21(19)25(20)29;/h4-10,13-14,16,20H,11-12,15H2,1-3H3;1H FRZAJYHESYBYAU-UHFFFAOYSA-N 50238218 CHEMBL4064413 Cholinesterase 4765 ChEMBL 10.1021/acs.jmedchem.7b00702 10.7270/Q22V2JC5 28613859 Peauger, L; Azzouz, R; Gembus, V; Tîntas, ML; Sopková-de Oliveira Santos, J; Bohn, P; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50238218 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50238218&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137637382 385454123 CHEMBL4064413 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50743917 [Br-].CC(=O)c1c[n+](Cc2ccccc2C)ccc1CC1Cc2cc(C)ccc2C1=O InChI=1S/C26H26NO2.BrH/c1-17-8-9-24-22(12-17)14-23(26(24)29)13-20-10-11-27(16-25(20)19(3)28)15-21-7-5-4-6-18(21)2;/h4-12,16,23H,13-15H2,1-3H3;1H/q+1;/p-1 BVPKDGIKEZTIBZ-UHFFFAOYSA-M 50238219 CHEMBL4072999 Cholinesterase 3815 ChEMBL 10.1021/acs.jmedchem.7b00702 10.7270/Q22V2JC5 28613859 Peauger, L; Azzouz, R; Gembus, V; Tîntas, ML; Sopková-de Oliveira Santos, J; Bohn, P; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50238219 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50238219&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 131735886 385454124 CHEMBL4072999 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50743918 [Br-].CC(=O)c1c[n+](Cc2ccccc2C)ccc1CC1Cc2cc(C)c(C)cc2C1=O InChI=1S/C27H28NO2.BrH/c1-17-7-5-6-8-22(17)15-28-10-9-21(26(16-28)20(4)29)13-24-14-23-11-18(2)19(3)12-25(23)27(24)30;/h5-12,16,24H,13-15H2,1-4H3;1H/q+1;/p-1 CFONVLSLTVFJDH-UHFFFAOYSA-M 50238220 CHEMBL4074062 Cholinesterase 262 ChEMBL 10.1021/acs.jmedchem.7b00702 10.7270/Q22V2JC5 28613859 Peauger, L; Azzouz, R; Gembus, V; Tîntas, ML; Sopková-de Oliveira Santos, J; Bohn, P; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50238220 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50238220&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118558040 385454125 CHEMBL4074062 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50743920 [Br-].COc1ccc2C(=O)C(Cc3cc[n+](Cc4ccccc4C)cc3C(C)=O)Cc2c1 InChI=1S/C26H26NO3.BrH/c1-17-6-4-5-7-20(17)15-27-11-10-19(25(16-27)18(2)28)12-22-13-21-14-23(30-3)8-9-24(21)26(22)29;/h4-11,14,16,22H,12-13,15H2,1-3H3;1H/q+1;/p-1 JNQWZIGZXZZYKQ-UHFFFAOYSA-M 50238222 CHEMBL4094591 Cholinesterase 2990 ChEMBL 10.1021/acs.jmedchem.7b00702 10.7270/Q22V2JC5 28613859 Peauger, L; Azzouz, R; Gembus, V; Tîntas, ML; Sopková-de Oliveira Santos, J; Bohn, P; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50238222 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50238222&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118557990 385454126 CHEMBL4094591 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50743923 [Br-].COc1cc2CC(Cc3cc[n+](Cc4cccc(C)c4)cc3C(C)=O)C(=O)c2cc1OC InChI=1S/C27H28NO4.BrH/c1-17-6-5-7-19(10-17)15-28-9-8-20(24(16-28)18(2)29)11-22-12-21-13-25(31-3)26(32-4)14-23(21)27(22)30;/h5-10,13-14,16,22H,11-12,15H2,1-4H3;1H/q+1;/p-1 CMZUENJDZHYXOB-UHFFFAOYSA-M 50238224 CHEMBL4094081 Cholinesterase 5990 ChEMBL 10.1021/acs.jmedchem.7b00702 10.7270/Q22V2JC5 28613859 Peauger, L; Azzouz, R; Gembus, V; Tîntas, ML; Sopková-de Oliveira Santos, J; Bohn, P; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50238224 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50238224&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137652826 385454128 CHEMBL4094081 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50743924 [Br-].COC(=O)c1c[n+](Cc2ccccc2C)ccc1CC1Cc2cc(OC)c(OC)cc2C1=O InChI=1S/C27H28NO5.BrH/c1-17-7-5-6-8-19(17)15-28-10-9-18(23(16-28)27(30)33-4)11-21-12-20-13-24(31-2)25(32-3)14-22(20)26(21)29;/h5-10,13-14,16,21H,11-12,15H2,1-4H3;1H/q+1;/p-1 SKRBTKGOMBZKFY-UHFFFAOYSA-M 50238216 CHEMBL4095535 Cholinesterase 1792 ChEMBL 10.1021/acs.jmedchem.7b00702 10.7270/Q22V2JC5 28613859 Peauger, L; Azzouz, R; Gembus, V; Tîntas, ML; Sopková-de Oliveira Santos, J; Bohn, P; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50238216 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50238216&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137654551 385454121 CHEMBL4095535 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50743925 [Br-].CC(=O)c1c[n+](Cc2ccccc2C)ccc1CC1Cc2cc(Cl)ccc2C1=O InChI=1S/C25H23ClNO2.BrH/c1-16-5-3-4-6-19(16)14-27-10-9-18(24(15-27)17(2)28)11-21-12-20-13-22(26)7-8-23(20)25(21)29;/h3-10,13,15,21H,11-12,14H2,1-2H3;1H/q+1;/p-1 IVQARBNRYZOHDC-UHFFFAOYSA-M 50238239 CHEMBL4099873 Cholinesterase 3630 ChEMBL 10.1021/acs.jmedchem.7b00702 10.7270/Q22V2JC5 28613859 Peauger, L; Azzouz, R; Gembus, V; Tîntas, ML; Sopková-de Oliveira Santos, J; Bohn, P; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50238239 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50238239&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118557800 385454142 CHEMBL4099873 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50743926 [Br-].CC(=O)c1c[n+](Cc2ccccc2C)ccc1CC1Cc2cc3OCOc3cc2C1=O InChI=1S/C26H24NO4.BrH/c1-16-5-3-4-6-19(16)13-27-8-7-18(23(14-27)17(2)28)9-21-10-20-11-24-25(31-15-30-24)12-22(20)26(21)29;/h3-8,11-12,14,21H,9-10,13,15H2,1-2H3;1H/q+1;/p-1 IHTWPGLOZITELZ-UHFFFAOYSA-M 50238240 CHEMBL4084371 Cholinesterase 1615 ChEMBL 10.1021/acs.jmedchem.7b00702 10.7270/Q22V2JC5 28613859 Peauger, L; Azzouz, R; Gembus, V; Tîntas, ML; Sopková-de Oliveira Santos, J; Bohn, P; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50238240 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50238240&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118558043 385454143 CHEMBL4084371 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50743929 [Br-].COc1cc2CC(Cc3cc[n+](Cc4cccc(Cl)c4)cc3C(C)=O)C(=O)c2cc1OC InChI=1S/C26H25ClNO4.BrH/c1-16(29)23-15-28(14-17-5-4-6-21(27)9-17)8-7-18(23)10-20-11-19-12-24(31-2)25(32-3)13-22(19)26(20)30;/h4-9,12-13,15,20H,10-11,14H2,1-3H3;1H/q+1;/p-1 IPIKMZLSILMHJW-UHFFFAOYSA-M 50238223 CHEMBL4102333 Cholinesterase 3340 ChEMBL 10.1021/acs.jmedchem.7b00702 10.7270/Q22V2JC5 28613859 Peauger, L; Azzouz, R; Gembus, V; Tîntas, ML; Sopková-de Oliveira Santos, J; Bohn, P; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50238223 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50238223&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118558025 385454127 CHEMBL4102333 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50767427 C(CCCNc1c2CCCCc2nc2ccccc12)CCCSc1c2CCCCc2nc2ccccc12 InChI=1S/C33H39N3S/c1(2-12-22-34-32-24-14-4-8-18-28(24)35-29-19-9-5-15-25(29)32)3-13-23-37-33-26-16-6-10-20-30(26)36-31-21-11-7-17-27(31)33/h4,6,8,10,14,16,18,20H,1-3,5,7,9,11-13,15,17,19,21-23H2,(H,34,35) QRIQNQYNWBQHLY-UHFFFAOYSA-N 8970 CHEMBL51197::N-[7-(1,2,3,4-tetrahydroacridin-9-ylsulfanyl)heptyl]-1,2,3,4-tetrahydroacridin-9-amine::Tacrine Dimer 4f::tacrine heterobivalent compound 3e Cholinesterase 35 ChEMBL 10.1016/j.ejmech.2017.03.062 10.7270/Q2HX1G33 28371641 Li, Q; Yang, H; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8970 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8970&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11113934 46509746 CHEMBL51197 ZINC13492738 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50767429 C(CCCSc1c2CCCCc2nc2ccccc12)CCCSc1c2CCCCc2nc2ccccc12 InChI=1S/C33H38N2S2/c1(2-12-22-36-32-24-14-4-8-18-28(24)34-29-19-9-5-15-25(29)32)3-13-23-37-33-26-16-6-10-20-30(26)35-31-21-11-7-17-27(31)33/h4,6,8,10,14,16,18,20H,1-3,5,7,9,11-13,15,17,19,21-23H2 IKDHJGMFECPDDI-UHFFFAOYSA-N 10520 9-{[7-(1,2,3,4-tetrahydroacridin-9-ylsulfanyl)heptyl]sulfanyl}-1,2,3,4-tetrahydroacridine::tacrine homobivalent compound 3d Cholinesterase 380 ChEMBL 10.1016/j.ejmech.2017.03.062 10.7270/Q2HX1G33 28371641 Li, Q; Yang, H; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10520 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10520&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 13545706 46511129 ZINC14947267 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50767407 CCN1CCc2c(C1)c1cc(F)ccc1n2CCC(=O)N1c2ccccc2Sc2ccccc12 InChI=1S/C28H26FN3OS/c1-2-30-15-13-23-21(18-30)20-17-19(29)11-12-22(20)31(23)16-14-28(33)32-24-7-3-5-9-26(24)34-27-10-6-4-8-25(27)32/h3-12,17H,2,13-16,18H2,1H3 QYPVYJBBRGPPKK-UHFFFAOYSA-N 50245736 CHEMBL4099400 Cholinesterase 390 ChEMBL 10.1016/j.ejmech.2017.03.062 10.7270/Q2HX1G33 28371641 Li, Q; Yang, H; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50245736 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50245736&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137660920 386403574 CHEMBL4099400 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50767408 Oc1cccc2C(=O)c3cc(cc(O)c3C(=O)c12)C(=O)NCCCCCCNc1c2CCCCCc2nc2ccccc12 InChI=1S/C35H35N3O5/c39-28-16-10-13-24-30(28)34(42)31-25(33(24)41)19-21(20-29(31)40)35(43)37-18-9-2-1-8-17-36-32-22-11-4-3-5-14-26(22)38-27-15-7-6-12-23(27)32/h6-7,10,12-13,15-16,19-20,39-40H,1-5,8-9,11,14,17-18H2,(H,36,38)(H,37,43) BBZZBIVGBCDTJH-UHFFFAOYSA-N 50245728 CHEMBL4063881 Cholinesterase 11 ChEMBL 10.1016/j.ejmech.2017.03.062 10.7270/Q2HX1G33 28371641 Li, Q; Yang, H; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50245728 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50245728&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137636031 386403570 CHEMBL4063881 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50767414 CC(C(=O)NCCCCCCCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccccc1 InChI=1S/C36H42FN3O/c1-26(28-21-22-29(32(37)25-28)27-15-7-6-8-16-27)36(41)39-24-14-5-3-2-4-13-23-38-35-30-17-9-11-19-33(30)40-34-20-12-10-18-31(34)35/h6-9,11,15-17,19,21-22,25-26H,2-5,10,12-14,18,20,23-24H2,1H3,(H,38,40)(H,39,41) BHBIPNYAHFZVSM-UHFFFAOYSA-N 50433322 CHEMBL2376473 Cholinesterase 2.1 ChEMBL 10.1016/j.ejmech.2017.03.062 10.7270/Q2HX1G33 28371641 Li, Q; Yang, H; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433322 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433322&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72725539 175445639 CHEMBL2376473 ZINC96269487 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50767418 Oc1ccccc1\C=C\c1cc(O)c(F)c(O)c1 InChI=1S/C14H11FO3/c15-14-12(17)7-9(8-13(14)18)5-6-10-3-1-2-4-11(10)16/h1-8,16-18H/b6-5+ RILTXHFRAXAVMU-AATRIKPKSA-N 50245708 CHEMBL4067633 Cholinesterase 10000 ChEMBL 10.1016/j.ejmech.2017.03.062 10.7270/Q2HX1G33 28371641 Li, Q; Yang, H; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50245708 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50245708&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72723621 386403563 CHEMBL4067633 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50767419 CC(=O)N(CCCNc1c2CCCCc2nc2ccccc12)CCNc1c2CCCCc2nc2ccccc12 InChI=1S/C33H39N5O/c1-23(39)38(22-20-35-33-26-13-4-8-17-30(26)37-31-18-9-5-14-27(31)33)21-10-19-34-32-24-11-2-6-15-28(24)36-29-16-7-3-12-25(29)32/h2,4,6,8,11,13,15,17H,3,5,7,9-10,12,14,16,18-22H2,1H3,(H,34,36)(H,35,37) SJUZLPXFDYIKCK-UHFFFAOYSA-N 50245716 CHEMBL4084610 Cholinesterase 2 ChEMBL 10.1016/j.ejmech.2017.03.062 10.7270/Q2HX1G33 28371641 Li, Q; Yang, H; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50245716 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50245716&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137647754 386403566 CHEMBL4084610 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50791545 O=C1CCc2ccc(OCCCCCN(CC#C)Cc3ccccc3)cc2N1 InChI=1S/C24H28N2O2/c1-2-15-26(19-20-9-5-3-6-10-20)16-7-4-8-17-28-22-13-11-21-12-14-24(27)25-23(21)18-22/h1,3,5-6,9-11,13,18H,4,7-8,12,14-17,19H2,(H,25,27) MUNZMFHAPSTYQA-UHFFFAOYSA-N 50252604 CHEMBL4084335 Cholinesterase 7000 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252604 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252604&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137646555 401957597 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50791606 O=C1CCc2ccc(OCCCCN(CC#C)Cc3ccccc3)cc2N1 InChI=1S/C23H26N2O2/c1-2-14-25(18-19-8-4-3-5-9-19)15-6-7-16-27-21-12-10-20-11-13-23(26)24-22(20)17-21/h1,3-5,8-10,12,17H,6-7,11,13-16,18H2,(H,24,26) WUVKEPSRWQCJFN-UHFFFAOYSA-N 50252574 CHEMBL4074152 Cholinesterase 19100 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252574 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252574&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137641088 401957595 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50791609 CC(C)N1CCN(CCCCOc2ccc3CCC(=O)Nc3c2)CC1 InChI=1S/C20H31N3O2/c1-16(2)23-12-10-22(11-13-23)9-3-4-14-25-18-7-5-17-6-8-20(24)21-19(17)15-18/h5,7,15-16H,3-4,6,8-14H2,1-2H3,(H,21,24) BCUWRSBWUJESED-UHFFFAOYSA-N 50252541 CHEMBL4069293 Cholinesterase 4500 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252541 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252541&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137634210 401957579 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50791625 O=C1CCc2ccc(OCCCN3CCN(CC3)c3ccccn3)cc2N1 InChI=1S/C21H26N4O2/c26-21-8-6-17-5-7-18(16-19(17)23-21)27-15-3-10-24-11-13-25(14-12-24)20-4-1-2-9-22-20/h1-2,4-5,7,9,16H,3,6,8,10-15H2,(H,23,26) CMDVDFOFZHNSAT-UHFFFAOYSA-N 50252572 CHEMBL4078101 Cholinesterase 14400 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252572 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252572&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 13108121 401957593 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50764423 CCOc1ccc(Cc2nc3cc(ccc3n2CCC(C)C)C(=O)N(CC)CC)cc1 InChI=1S/C26H35N3O2/c1-6-28(7-2)26(30)21-11-14-24-23(18-21)27-25(29(24)16-15-19(4)5)17-20-9-12-22(13-10-20)31-8-3/h9-14,18-19H,6-8,15-17H2,1-5H3 RLLSCGRLMPJHDQ-UHFFFAOYSA-N 50244276 2-(4-ethoxybenzyl)-N,N-diethyl-1-isopentyl-1H-benzo[d]imidazole-5-carboxamide::CHEMBL471980 Cholinesterase 9700 ChEMBL 10.1021/acs.jmedchem.7b01760 10.7270/Q2RJ4MWK 29400965 Dolles, D; Hoffmann, M; Gunesch, S; Marinelli, O; Möller, J; Santoni, G; Chatonnet, A; Lohse, MJ; Wittmann, HJ; Strasser, A; Nabissi, M; Maurice, T; Decker, M Julius Maximilian University of W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50244276 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50244276&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 22181304 104100336 CHEMBL471980 ZINC40891896 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50764426 CCOc1ccc(Nc2nc3cc(ccc3n2CCC(C)C)C(=O)N(CC)CC)cc1 InChI=1S/C25H34N4O2/c1-6-28(7-2)24(30)19-9-14-23-22(17-19)27-25(29(23)16-15-18(4)5)26-20-10-12-21(13-11-20)31-8-3/h9-14,17-18H,6-8,15-16H2,1-5H3,(H,26,27) OIFJPDXHVAIHHP-UHFFFAOYSA-N 50244285 CHEMBL4079520 Cholinesterase 700 ChEMBL 10.1021/acs.jmedchem.7b01760 10.7270/Q2RJ4MWK 29400965 Dolles, D; Hoffmann, M; Gunesch, S; Marinelli, O; Möller, J; Santoni, G; Chatonnet, A; Lohse, MJ; Wittmann, HJ; Strasser, A; Nabissi, M; Maurice, T; Decker, M Julius Maximilian University of W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50244285 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50244285&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10224082 386403110 CHEMBL4079520 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50764427 CCN(CC)C(=O)c1ccc2n(CCC(C)C)c(Nc3ccc(Oc4ccccc4)cc3)nc2c1 InChI=1S/C29H34N4O2/c1-5-32(6-2)28(34)22-12-17-27-26(20-22)31-29(33(27)19-18-21(3)4)30-23-13-15-25(16-14-23)35-24-10-8-7-9-11-24/h7-17,20-21H,5-6,18-19H2,1-4H3,(H,30,31) ILLUCZAFFISCTI-UHFFFAOYSA-N 50244286 CHEMBL4100917 Cholinesterase 3700 ChEMBL 10.1021/acs.jmedchem.7b01760 10.7270/Q2RJ4MWK 29400965 Dolles, D; Hoffmann, M; Gunesch, S; Marinelli, O; Möller, J; Santoni, G; Chatonnet, A; Lohse, MJ; Wittmann, HJ; Strasser, A; Nabissi, M; Maurice, T; Decker, M Julius Maximilian University of W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50244286 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50244286&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137658648 386403111 CHEMBL4100917 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50764428 CCOc1ccc(Cc2nc3cc(ccc3n2CCN2CCCCC2)C(=O)N(CC)CC)cc1 InChI=1S/C28H38N4O2/c1-4-31(5-2)28(33)23-12-15-26-25(21-23)29-27(20-22-10-13-24(14-11-22)34-6-3)32(26)19-18-30-16-8-7-9-17-30/h10-15,21H,4-9,16-20H2,1-3H3 JRJWAARCOBEVOL-UHFFFAOYSA-N 50244242 CHEMBL4082936 Cholinesterase 2300 ChEMBL 10.1021/acs.jmedchem.7b01760 10.7270/Q2RJ4MWK 29400965 Dolles, D; Hoffmann, M; Gunesch, S; Marinelli, O; Möller, J; Santoni, G; Chatonnet, A; Lohse, MJ; Wittmann, HJ; Strasser, A; Nabissi, M; Maurice, T; Decker, M Julius Maximilian University of W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50244242 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50244242&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 22181436 104100307 CHEMBL4082936 ZINC40895028 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50761211 COc1cccc(c1)C(=O)C(CCC1CCN(Cc2cccc(C)c2)CC1)C(C)=O InChI=1S/C26H33NO3/c1-19-6-4-7-22(16-19)18-27-14-12-21(13-15-27)10-11-25(20(2)28)26(29)23-8-5-9-24(17-23)30-3/h4-9,16-17,21,25H,10-15,18H2,1-3H3 ZRZYDOAAVXNOAX-UHFFFAOYSA-N 50242275 CHEMBL4064991 Cholinesterase 1850 ChEMBL 10.1016/j.bmc.2017.02.048 10.7270/Q2TM7DHM 28454848 Yan, J; Hu, J; Liu, A; He, L; Li, X; Wei, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50242275 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50242275&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137635557 386402432 CHEMBL4064991 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50761212 COCOc1ccc(cc1OC)C(=O)C(CCC1CCN(Cc2cccc(C)c2)CC1)C(C)=O InChI=1S/C28H37NO5/c1-20-6-5-7-23(16-20)18-29-14-12-22(13-15-29)8-10-25(21(2)30)28(31)24-9-11-26(34-19-32-3)27(17-24)33-4/h5-7,9,11,16-17,22,25H,8,10,12-15,18-19H2,1-4H3 PIBKIWWEVNRSMO-UHFFFAOYSA-N 50242277 CHEMBL4086452 Cholinesterase 3090 ChEMBL 10.1016/j.bmc.2017.02.048 10.7270/Q2TM7DHM 28454848 Yan, J; Hu, J; Liu, A; He, L; Li, X; Wei, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50242277 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50242277&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137643359 386402433 CHEMBL4086452 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50761213 COc1cc(ccc1O)C(=O)C(CCC1CCN(Cc2cccc(C)c2)CC1)C(C)=O InChI=1S/C26H33NO4/c1-18-5-4-6-21(15-18)17-27-13-11-20(12-14-27)7-9-23(19(2)28)26(30)22-8-10-24(29)25(16-22)31-3/h4-6,8,10,15-16,20,23,29H,7,9,11-14,17H2,1-3H3 APQOQSHPMANQOF-UHFFFAOYSA-N 50242281 CHEMBL4073583 Cholinesterase 3360 ChEMBL 10.1016/j.bmc.2017.02.048 10.7270/Q2TM7DHM 28454848 Yan, J; Hu, J; Liu, A; He, L; Li, X; Wei, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50242281 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50242281&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137640669 386402434 CHEMBL4073583 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50761214 COc1ccc(cc1O)C(=O)C(CCC1CCN(Cc2cccc(C)c2)CC1)C(C)=O InChI=1S/C26H33NO4/c1-18-5-4-6-21(15-18)17-27-13-11-20(12-14-27)7-9-23(19(2)28)26(30)22-8-10-25(31-3)24(29)16-22/h4-6,8,10,15-16,20,23,29H,7,9,11-14,17H2,1-3H3 SECLJIGCOQQKHR-UHFFFAOYSA-N 50242282 CHEMBL4083956 Cholinesterase 16600 ChEMBL 10.1016/j.bmc.2017.02.048 10.7270/Q2TM7DHM 28454848 Yan, J; Hu, J; Liu, A; He, L; Li, X; Wei, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50242282 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50242282&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137648207 386402435 CHEMBL4083956 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50761215 COc1ccc(cc1O)C(=O)CC(=O)CC1CCN(Cc2ccccc2)CC1 InChI=1S/C23H27NO4/c1-28-23-8-7-19(14-22(23)27)21(26)15-20(25)13-17-9-11-24(12-10-17)16-18-5-3-2-4-6-18/h2-8,14,17,27H,9-13,15-16H2,1H3 XBOLDYRDLNIPBU-UHFFFAOYSA-N 50242288 CHEMBL4083028 Cholinesterase 12400 ChEMBL 10.1016/j.bmc.2017.02.048 10.7270/Q2TM7DHM 28454848 Yan, J; Hu, J; Liu, A; He, L; Li, X; Wei, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50242288 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50242288&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 132569667 386402436 CHEMBL4083028 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50761216 COc1ccc(cc1O)C(=O)CC(=O)CC1CCN(Cc2cccc(C)c2)CC1 InChI=1S/C24H29NO4/c1-17-4-3-5-19(12-17)16-25-10-8-18(9-11-25)13-21(26)15-22(27)20-6-7-24(29-2)23(28)14-20/h3-7,12,14,18,28H,8-11,13,15-16H2,1-2H3 FNJZKCFCIULQJC-UHFFFAOYSA-N 50242289 CHEMBL4085122 Cholinesterase 9780 ChEMBL 10.1016/j.bmc.2017.02.048 10.7270/Q2TM7DHM 28454848 Yan, J; Hu, J; Liu, A; He, L; Li, X; Wei, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50242289 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50242289&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137648247 386402437 CHEMBL4085122 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50761217 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 16 ChEMBL 10.1016/j.bmc.2017.02.048 10.7270/Q2TM7DHM 28454848 Yan, J; Hu, J; Liu, A; He, L; Li, X; Wei, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50761218 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 3060 ChEMBL 10.1016/j.bmc.2017.02.048 10.7270/Q2TM7DHM 28454848 Yan, J; Hu, J; Liu, A; He, L; Li, X; Wei, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50761230 COc1ccc(cc1OC)C(=O)C(CC1CCN(Cc2ccccc2)CC1)C(C)=O InChI=1S/C25H31NO4/c1-18(27)22(25(28)21-9-10-23(29-2)24(16-21)30-3)15-19-11-13-26(14-12-19)17-20-7-5-4-6-8-20/h4-10,16,19,22H,11-15,17H2,1-3H3 ZIAWLNILNATLHN-UHFFFAOYSA-N 50242295 CHEMBL4091835 Cholinesterase 20800 ChEMBL 10.1016/j.bmc.2017.02.048 10.7270/Q2TM7DHM 28454848 Yan, J; Hu, J; Liu, A; He, L; Li, X; Wei, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50242295 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50242295&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137655334 386402443 CHEMBL4091835 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50761231 COc1cccc(c1)C(=O)C(CC1CCN(Cc2ccccc2)CC1)C(C)=O InChI=1S/C24H29NO3/c1-18(26)23(24(27)21-9-6-10-22(16-21)28-2)15-19-11-13-25(14-12-19)17-20-7-4-3-5-8-20/h3-10,16,19,23H,11-15,17H2,1-2H3 CHPNWZMYUOTTSE-UHFFFAOYSA-N 50242294 CHEMBL4095109 Cholinesterase 14400 ChEMBL 10.1016/j.bmc.2017.02.048 10.7270/Q2TM7DHM 28454848 Yan, J; Hu, J; Liu, A; He, L; Li, X; Wei, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50242294 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50242294&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137654782 386402442 CHEMBL4095109 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50761232 COc1ccc(cc1OC)C(=O)C(CCC1CCN(Cc2ccccc2)CC1)C(C)=O InChI=1S/C26H33NO4/c1-19(28)23(26(29)22-10-12-24(30-2)25(17-22)31-3)11-9-20-13-15-27(16-14-20)18-21-7-5-4-6-8-21/h4-8,10,12,17,20,23H,9,11,13-16,18H2,1-3H3 LKNNUHOFKGKYOP-UHFFFAOYSA-N 50242293 CHEMBL4102875 Cholinesterase 2820 ChEMBL 10.1016/j.bmc.2017.02.048 10.7270/Q2TM7DHM 28454848 Yan, J; Hu, J; Liu, A; He, L; Li, X; Wei, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50242293 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50242293&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137657025 386402441 CHEMBL4102875 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50761233 COc1ccc(cc1OC)C(=O)C(CCC1CCN(Cc2cccc(C)c2)CC1)C(C)=O InChI=1S/C27H35NO4/c1-19-6-5-7-22(16-19)18-28-14-12-21(13-15-28)8-10-24(20(2)29)27(30)23-9-11-25(31-3)26(17-23)32-4/h5-7,9,11,16-17,21,24H,8,10,12-15,18H2,1-4H3 ODNSYKQMOUOXII-UHFFFAOYSA-N 50242292 CHEMBL4078592 Cholinesterase 2000 ChEMBL 10.1016/j.bmc.2017.02.048 10.7270/Q2TM7DHM 28454848 Yan, J; Hu, J; Liu, A; He, L; Li, X; Wei, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50242292 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50242292&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137649382 386402440 CHEMBL4078592 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50761234 COc1cc(ccc1O)C(=O)C(CCC1CCN(Cc2ccccc2)CC1)C(C)=O InChI=1S/C25H31NO4/c1-18(27)22(25(29)21-9-11-23(28)24(16-21)30-2)10-8-19-12-14-26(15-13-19)17-20-6-4-3-5-7-20/h3-7,9,11,16,19,22,28H,8,10,12-15,17H2,1-2H3 ZPQHXJYZVGXXNK-UHFFFAOYSA-N 50242291 CHEMBL4094210 Cholinesterase 15600 ChEMBL 10.1016/j.bmc.2017.02.048 10.7270/Q2TM7DHM 28454848 Yan, J; Hu, J; Liu, A; He, L; Li, X; Wei, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50242291 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50242291&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137653779 386402439 CHEMBL4094210 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50761235 COc1ccc(cc1OC)C(=O)CC(=O)CC1CCN(Cc2ccccc2)CC1 InChI=1S/C24H29NO4/c1-28-23-9-8-20(15-24(23)29-2)22(27)16-21(26)14-18-10-12-25(13-11-18)17-19-6-4-3-5-7-19/h3-9,15,18H,10-14,16-17H2,1-2H3 WGILVPQBGLECSK-UHFFFAOYSA-N 50242290 CHEMBL4063499 Cholinesterase 2330 ChEMBL 10.1016/j.bmc.2017.02.048 10.7270/Q2TM7DHM 28454848 Yan, J; Hu, J; Liu, A; He, L; Li, X; Wei, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50242290 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50242290&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137634633 386402438 CHEMBL4063499 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50761237 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 15700 ChEMBL 10.1016/j.bmc.2017.02.048 10.7270/Q2TM7DHM 28454848 Yan, J; Hu, J; Liu, A; He, L; Li, X; Wei, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50761248 COc1ccc(cc1)C(=O)C(CCC1CCN(Cc2ccccc2)CC1)C(C)=O InChI=1S/C25H31NO3/c1-19(27)24(25(28)22-9-11-23(29-2)12-10-22)13-8-20-14-16-26(17-15-20)18-21-6-4-3-5-7-21/h3-7,9-12,20,24H,8,13-18H2,1-2H3 YDLQPOBMELLPLH-UHFFFAOYSA-N 50242296 CHEMBL4067696 Cholinesterase 1640 ChEMBL 10.1016/j.bmc.2017.02.048 10.7270/Q2TM7DHM 28454848 Yan, J; Hu, J; Liu, A; He, L; Li, X; Wei, H Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50242296 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50242296&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137633252 386402444 CHEMBL4067696 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50761351 CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]2[C@H](OC)[C@](C)(C13)[C@@]1(O)CC[C@@H]2C[C@@H]4C1(O)C(=O)O2 InChI=1S/C24H37NO6/c1-6-25-12-20(2)9-8-15(29-4)23-14-11-13-7-10-22(27,24(14,28)19(26)31-13)21(3,18(23)25)17(30-5)16(20)23/h13-18,27-28H,6-12H2,1-5H3/t13-,14-,15-,16+,17-,18?,20-,21+,22-,23-,24?/m0/s1 YAGFBEMQDGQRCE-PHBBHMBZSA-N 50242322 CHEMBL4066113 Cholinesterase 8600 ChEMBL 10.1016/j.bmc.2017.04.022 10.7270/Q2K64MG6 28457693 Ahmad, H; Ahmad, S; Shah, SAA; Latif, A; Ali, M; Khan, FA; Tahir, MN; Shaheen, F; Wadood, A; Ahmad, M University of Malakand http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50242322 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50242322&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137633182 386402467 CHEMBL4066113 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50761352 C[C@]12CN3[C@H]4CC56CC(=C)[C@H]7[C@H](O)[C@H]5C3[C@@]([C@@H]14)([C@H]6[C@@H]7O)[C@@H](O)CC2 InChI=1S/C20H27NO3/c1-8-5-19-6-9-15-18(2)4-3-10(22)20(15)16(19)14(24)11(8)13(23)12(19)17(20)21(9)7-18/h9-17,22-24H,1,3-7H2,2H3/t9-,10-,11-,12-,13-,14+,15+,16-,17?,18-,19?,20-/m0/s1 KHDVMYKEPXDJMM-LPWAIGNNSA-N 50242315 CHEMBL4093688 Cholinesterase 9300 ChEMBL 10.1016/j.bmc.2017.04.022 10.7270/Q2K64MG6 28457693 Ahmad, H; Ahmad, S; Shah, SAA; Latif, A; Ali, M; Khan, FA; Tahir, MN; Shaheen, F; Wadood, A; Ahmad, M University of Malakand http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50242315 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50242315&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137654944 386402462 CHEMBL4093688 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50761353 C[C@@]12CCC[C@@]3(CN4CCOC14)[C@@H]2CC[C@@]12CC[C@@H](C[C@@H]31)C(=C)[C@H]2O InChI=1S/C22H33NO2/c1-14-15-4-8-21(18(14)24)9-5-16-20(2)6-3-7-22(16,17(21)12-15)13-23-10-11-25-19(20)23/h15-19,24H,1,3-13H2,2H3/t15-,16+,17+,18+,19?,20-,21-,22+/m0/s1 NPIYQNRBTZBZPJ-KCTJBENESA-N 50242317 CHEMBL4085938 Cholinesterase 13100 ChEMBL 10.1016/j.bmc.2017.04.022 10.7270/Q2K64MG6 28457693 Ahmad, H; Ahmad, S; Shah, SAA; Latif, A; Ali, M; Khan, FA; Tahir, MN; Shaheen, F; Wadood, A; Ahmad, M University of Malakand http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50242317 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50242317&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137643825 386402464 CHEMBL4085938 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50761355 CCN1C[C@]2(C)CC[C@H](OC)[C@]34C1[C@H]([C@@H](O)[C@H]23)[C@@]1(O)CC[C@@H]2C[C@@H]4[C@@H]1C(=O)O2 InChI=1S/C22H33NO5/c1-4-23-10-20(2)7-6-13(27-3)22-12-9-11-5-8-21(26,14(12)19(25)28-11)15(18(22)23)16(24)17(20)22/h11-18,24,26H,4-10H2,1-3H3/t11-,12+,13-,14+,15-,16+,17+,18?,20-,21+,22-/m0/s1 YPSAOPXJHSESSR-AGBQGJAZSA-N 50242323 CHEMBL4070917 Cholinesterase 10400 ChEMBL 10.1016/j.bmc.2017.04.022 10.7270/Q2K64MG6 28457693 Ahmad, H; Ahmad, S; Shah, SAA; Latif, A; Ali, M; Khan, FA; Tahir, MN; Shaheen, F; Wadood, A; Ahmad, M University of Malakand http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50242323 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50242323&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73527 386402468 CHEMBL4070917 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50761356 C[C@]12CCC[C@]3(CN(CCO)C1)[C@@H]2CC(=O)[C@@]12CC[C@@H](C[C@@H]31)C(=C)[C@H]2O InChI=1S/C22H33NO3/c1-14-15-4-7-22(19(14)26)17(10-15)21-6-3-5-20(2,16(21)11-18(22)25)12-23(13-21)8-9-24/h15-17,19,24,26H,1,3-13H2,2H3/t15-,16+,17-,19+,20-,21-,22+/m0/s1 LDYSWDMNYLEUCU-CCXLZGIPSA-N 50242320 CHEMBL4065019 Cholinesterase 18100 ChEMBL 10.1016/j.bmc.2017.04.022 10.7270/Q2K64MG6 28457693 Ahmad, H; Ahmad, S; Shah, SAA; Latif, A; Ali, M; Khan, FA; Tahir, MN; Shaheen, F; Wadood, A; Ahmad, M University of Malakand http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50242320 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50242320&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12299861 386402466 CHEMBL4065019 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50761357 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 12000 ChEMBL 10.1016/j.bmc.2017.04.022 10.7270/Q2K64MG6 28457693 Ahmad, H; Ahmad, S; Shah, SAA; Latif, A; Ali, M; Khan, FA; Tahir, MN; Shaheen, F; Wadood, A; Ahmad, M University of Malakand http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50761360 C[C@@]12CCC[C@@]3(CN4CCO[C@H]14)[C@@H]2CC[C@@]12CC[C@@H](C[C@@H]31)C(=C)[C@H]2O InChI=1S/C22H33NO2/c1-14-15-4-8-21(18(14)24)9-5-16-20(2)6-3-7-22(16,17(21)12-15)13-23-10-11-25-19(20)23/h15-19,24H,1,3-13H2,2H3/t15-,16+,17+,18+,19+,20-,21-,22+/m0/s1 NPIYQNRBTZBZPJ-ZILADGCBSA-N 50242324 CHEMBL4072441 Cholinesterase 14700 ChEMBL 10.1016/j.bmc.2017.04.022 10.7270/Q2K64MG6 28457693 Ahmad, H; Ahmad, S; Shah, SAA; Latif, A; Ali, M; Khan, FA; Tahir, MN; Shaheen, F; Wadood, A; Ahmad, M University of Malakand http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50242324 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50242324&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137640024 386402469 CHEMBL4072441 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50761364 C[C@@]12CN3[C@@H]4C[C@@]56CC(=C)[C@H]7[C@H](O)[C@H]5C3[C@@](CC(=O)C1)([C@@H]24)[C@H]6[C@@H]7O InChI=1S/C20H25NO3/c1-8-3-19-6-10-15-18(2)4-9(22)5-20(15)16(19)14(24)11(8)13(23)12(19)17(20)21(10)7-18/h10-17,23-24H,1,3-7H2,2H3/t10-,11+,12+,13+,14-,15-,16+,17?,18+,19+,20+/m1/s1 WCGQPPIMPLNHFG-BSKMGVAZSA-N 50242318 CHEMBL4098012 Cholinesterase 15600 ChEMBL 10.1016/j.bmc.2017.04.022 10.7270/Q2K64MG6 28457693 Ahmad, H; Ahmad, S; Shah, SAA; Latif, A; Ali, M; Khan, FA; Tahir, MN; Shaheen, F; Wadood, A; Ahmad, M University of Malakand http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50242318 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50242318&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137660873 386402465 CHEMBL4098012 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50761378 C[C@@]12CN3C4[C@@H]5C[C@H]6C[C@@H]7[C@]4(CCC1)[C@@H]2[C@@]3(O)CC57[C@H](O)C6=C InChI=1S/C20H27NO2/c1-10-11-6-12-14-18-5-3-4-17(2)9-21(14)20(23,16(17)18)8-19(12,15(10)22)13(18)7-11/h11-16,22-23H,1,3-9H2,2H3/t11-,12-,13+,14?,15+,16+,17-,18-,19?,20-/m0/s1 PECUPNIWNQRXJY-WOBFQVEASA-N 50242316 CHEMBL4103864 Cholinesterase 16200 ChEMBL 10.1016/j.bmc.2017.04.022 10.7270/Q2K64MG6 28457693 Ahmad, H; Ahmad, S; Shah, SAA; Latif, A; Ali, M; Khan, FA; Tahir, MN; Shaheen, F; Wadood, A; Ahmad, M University of Malakand http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50242316 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50242316&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137658398 386402463 CHEMBL4103864 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50760407 CCO[P@@](=O)(SCC)c1ccccc1 InChI=1S/C10H15O2PS/c1-3-12-13(11,14-4-2)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3/t13-/m1/s1 WYIYLVMTBPAZLA-CYBMUJFWSA-N 50241978 CHEMBL4093928 Cholinesterase 150000 ChEMBL 10.1016/j.bmc.2017.03.058 10.7270/Q2H70J09 28404526 Mohammed, A; Sneathen, J; Frojen, SG; Kuo, L; Dupureur, CM University of Missouri St. Louis http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50241978 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50241978&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137654004 386402227 CHEMBL4093928 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50760422 CCO[P@](=O)(SCC)c1ccccc1 InChI=1S/C10H15O2PS/c1-3-12-13(11,14-4-2)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3/t13-/m0/s1 WYIYLVMTBPAZLA-ZDUSSCGKSA-N 50241979 CHEMBL4066365 Cholinesterase 7800 ChEMBL 10.1016/j.bmc.2017.03.058 10.7270/Q2H70J09 28404526 Mohammed, A; Sneathen, J; Frojen, SG; Kuo, L; Dupureur, CM University of Missouri St. Louis http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50241979 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50241979&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 132569675 386402228 CHEMBL4066365 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50760426 CCO[P@](=O)(SCC)c1ccccc1 InChI=1S/C10H15O2PS/c1-3-12-13(11,14-4-2)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3/t13-/m0/s1 WYIYLVMTBPAZLA-ZDUSSCGKSA-N 50241979 CHEMBL4066365 Cholinesterase 7000 ChEMBL 10.1016/j.bmc.2017.03.058 10.7270/Q2H70J09 28404526 Mohammed, A; Sneathen, J; Frojen, SG; Kuo, L; Dupureur, CM University of Missouri St. Louis http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50241979 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50241979&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 132569675 386402228 CHEMBL4066365 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50807417 COc1cc(\C=C\C(=O)OCC2CCN(Cc3ccccc3)CC2)ccc1O InChI=1S/C23H27NO4/c1-27-22-15-18(7-9-21(22)25)8-10-23(26)28-17-20-11-13-24(14-12-20)16-19-5-3-2-4-6-19/h2-10,15,20,25H,11-14,16-17H2,1H3/b10-8+ QJDRBHVMOOPIGE-CSKARUKUSA-N 50256407 CHEMBL4088197 Cholinesterase 24970 ChEMBL 10.1016/j.ejmech.2017.02.043 10.7270/Q2VX0JXD 28282613 Dias, KS; de Paula, CT; Dos Santos, T; Souza, IN; Boni, MS; Guimarães, MJ; da Silva, FM; Castro, NG; Neves, GA; Veloso, CC; Coelho, MM; de Melo, IS; Giusti, FC; Giusti-Paiva, A; da Silva, ML; Dardenne, LE; Guedes, IA; Pruccoli, L; Morroni, F; Tarozzi, A; Viegas, C Federal University of Alfenas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50256407 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50256407&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137643434 402360729 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50807418 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 4690 ChEMBL 10.1016/j.ejmech.2017.02.043 10.7270/Q2VX0JXD 28282613 Dias, KS; de Paula, CT; Dos Santos, T; Souza, IN; Boni, MS; Guimarães, MJ; da Silva, FM; Castro, NG; Neves, GA; Veloso, CC; Coelho, MM; de Melo, IS; Giusti, FC; Giusti-Paiva, A; da Silva, ML; Dardenne, LE; Guedes, IA; Pruccoli, L; Morroni, F; Tarozzi, A; Viegas, C Federal University of Alfenas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50807419 COc1cc(\C=C\C(=O)CC(=O)\C=C\c2ccc(O)c(OC)c2)ccc1O InChI=1S/C21H20O6/c1-26-20-11-14(5-9-18(20)24)3-7-16(22)13-17(23)8-4-15-6-10-19(25)21(12-15)27-2/h3-12,24-25H,13H2,1-2H3/b7-3+,8-4+ VFLDPWHFBUODDF-FCXRPNKRSA-N 50140172 CHEBI:3962::CHEMBL140::Curcumin::US9409845, Table 1, Compound 21: curcumin Cholinesterase >300000 ChEMBL 10.1016/j.ejmech.2017.02.043 10.7270/Q2VX0JXD 28282613 Dias, KS; de Paula, CT; Dos Santos, T; Souza, IN; Boni, MS; Guimarães, MJ; da Silva, FM; Castro, NG; Neves, GA; Veloso, CC; Coelho, MM; de Melo, IS; Giusti, FC; Giusti-Paiva, A; da Silva, ML; Dardenne, LE; Guedes, IA; Pruccoli, L; Morroni, F; Tarozzi, A; Viegas, C Federal University of Alfenas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50140172 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50140172&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search CC9 6HDR 969516 336952476 CHEMBL140 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50807591 CC(=O)C(=C/c1ccc(O)cc1)\C(=O)NCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C27H29N3O3/c1-18(31)23(17-19-11-13-20(32)14-12-19)27(33)29-16-6-15-28-26-21-7-2-4-9-24(21)30-25-10-5-3-8-22(25)26/h2,4,7,9,11-14,17,32H,3,5-6,8,10,15-16H2,1H3,(H,28,30)(H,29,33)/b23-17+ YJEXSHMLSCZAQQ-HAVVHWLPSA-N 50256459 CHEMBL4061201 Cholinesterase 1600 ChEMBL 10.1016/j.bmc.2017.02.049 10.7270/Q2GQ717D 28302511 Liu, Z; Fang, L; Zhang, H; Gou, S; Chen, L China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50256459 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50256459&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137637039 402360753 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50807593 COc1cc(CC(C(C)=O)C(=O)NCCCCCCNc2c3CCCCc3nc3ccccc23)ccc1O InChI=1S/C31H39N3O4/c1-21(35)25(19-22-15-16-28(36)29(20-22)38-2)31(37)33-18-10-4-3-9-17-32-30-23-11-5-7-13-26(23)34-27-14-8-6-12-24(27)30/h5,7,11,13,15-16,20,25,36H,3-4,6,8-10,12,14,17-19H2,1-2H3,(H,32,34)(H,33,37) IHYMWSIKQMECJM-UHFFFAOYSA-N 50256460 CHEMBL4083801 Cholinesterase 220 ChEMBL 10.1016/j.bmc.2017.02.049 10.7270/Q2GQ717D 28302511 Liu, Z; Fang, L; Zhang, H; Gou, S; Chen, L China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50256460 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50256460&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137645142 402360754 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50807594 CC(=O)C(Cc1ccc(O)cc1)C(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C30H37N3O3/c1-21(34)26(20-22-14-16-23(35)17-15-22)30(36)32-19-9-3-2-8-18-31-29-24-10-4-6-12-27(24)33-28-13-7-5-11-25(28)29/h4,6,10,12,14-17,26,35H,2-3,5,7-9,11,13,18-20H2,1H3,(H,31,33)(H,32,36) ZHKFKCKCRKGVNJ-UHFFFAOYSA-N 50256488 CHEMBL4078137 Cholinesterase 200 ChEMBL 10.1016/j.bmc.2017.02.049 10.7270/Q2GQ717D 28302511 Liu, Z; Fang, L; Zhang, H; Gou, S; Chen, L China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50256488 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50256488&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137650536 402360755 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50807595 COc1cc(CC(C(C)=O)C(=O)NCCCCNc2c3CCCCc3nc3ccccc23)ccc1O InChI=1S/C29H35N3O4/c1-19(33)23(17-20-13-14-26(34)27(18-20)36-2)29(35)31-16-8-7-15-30-28-21-9-3-5-11-24(21)32-25-12-6-4-10-22(25)28/h3,5,9,11,13-14,18,23,34H,4,6-8,10,12,15-17H2,1-2H3,(H,30,32)(H,31,35) RJEKIVOEJUTKQK-UHFFFAOYSA-N 50256489 CHEMBL4083153 Cholinesterase 3380 ChEMBL 10.1016/j.bmc.2017.02.049 10.7270/Q2GQ717D 28302511 Liu, Z; Fang, L; Zhang, H; Gou, S; Chen, L China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50256489 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50256489&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137645810 402360756 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50807601 COc1cc(CC(C(C)=O)C(=O)NCCCNc2c3CCCCc3nc3ccccc23)ccc1O InChI=1S/C28H33N3O4/c1-18(32)22(16-19-12-13-25(33)26(17-19)35-2)28(34)30-15-7-14-29-27-20-8-3-5-10-23(20)31-24-11-6-4-9-21(24)27/h3,5,8,10,12-13,17,22,33H,4,6-7,9,11,14-16H2,1-2H3,(H,29,31)(H,30,34) XELOYBKZBALWEO-UHFFFAOYSA-N 50256490 CHEMBL4063024 Cholinesterase 1310 ChEMBL 10.1016/j.bmc.2017.02.049 10.7270/Q2GQ717D 28302511 Liu, Z; Fang, L; Zhang, H; Gou, S; Chen, L China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50256490 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50256490&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137636673 402360757 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50807607 CC(=O)C(Cc1ccc(O)cc1)C(=O)NCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C27H31N3O3/c1-18(31)23(17-19-11-13-20(32)14-12-19)27(33)29-16-6-15-28-26-21-7-2-4-9-24(21)30-25-10-5-3-8-22(25)26/h2,4,7,9,11-14,23,32H,3,5-6,8,10,15-17H2,1H3,(H,28,30)(H,29,33) FWAGIKXJAJAPED-UHFFFAOYSA-N 50256491 CHEMBL4084958 Cholinesterase 830 ChEMBL 10.1016/j.bmc.2017.02.049 10.7270/Q2GQ717D 28302511 Liu, Z; Fang, L; Zhang, H; Gou, S; Chen, L China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50256491 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50256491&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137647993 402360758 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50807609 CC(=O)CC(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C23H31N3O2/c1-17(27)16-22(28)24-14-8-2-3-9-15-25-23-18-10-4-6-12-20(18)26-21-13-7-5-11-19(21)23/h4,6,10,12H,2-3,5,7-9,11,13-16H2,1H3,(H,24,28)(H,25,26) SUDBEUCSOCEEDT-UHFFFAOYSA-N 50256493 CHEMBL4085861 Cholinesterase 220 ChEMBL 10.1016/j.bmc.2017.02.049 10.7270/Q2GQ717D 28302511 Liu, Z; Fang, L; Zhang, H; Gou, S; Chen, L China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50256493 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50256493&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137644301 402360759 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50807612 CC(=O)CC(=O)NCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C20H25N3O2/c1-14(24)13-19(25)21-11-6-12-22-20-15-7-2-4-9-17(15)23-18-10-5-3-8-16(18)20/h2,4,7,9H,3,5-6,8,10-13H2,1H3,(H,21,25)(H,22,23) IKTIICXOCJAHAU-UHFFFAOYSA-N 50256494 CHEMBL4100399 Cholinesterase 60 ChEMBL 10.1016/j.bmc.2017.02.049 10.7270/Q2GQ717D 28302511 Liu, Z; Fang, L; Zhang, H; Gou, S; Chen, L China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50256494 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50256494&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137661682 402360760 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50807622 CC(=O)CC(=O)NCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C19H23N3O2/c1-13(23)12-18(24)20-10-11-21-19-14-6-2-4-8-16(14)22-17-9-5-3-7-15(17)19/h2,4,6,8H,3,5,7,9-12H2,1H3,(H,20,24)(H,21,22) OIGPCPVWVSFAGX-UHFFFAOYSA-N 50256495 CHEMBL4080492 Cholinesterase 310 ChEMBL 10.1016/j.bmc.2017.02.049 10.7270/Q2GQ717D 28302511 Liu, Z; Fang, L; Zhang, H; Gou, S; Chen, L China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50256495 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50256495&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137645461 402360761 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50807650 COc1cc(\C=C(/C(C)=O)C(=O)NCCCNc2c3CCCCc3nc3ccccc23)ccc1O InChI=1S/C28H31N3O4/c1-18(32)22(16-19-12-13-25(33)26(17-19)35-2)28(34)30-15-7-14-29-27-20-8-3-5-10-23(20)31-24-11-6-4-9-21(24)27/h3,5,8,10,12-13,16-17,33H,4,6-7,9,11,14-15H2,1-2H3,(H,29,31)(H,30,34)/b22-16+ GNFAHFJPJFEMRR-CJLVFECKSA-N 50256524 CHEMBL4075849 Cholinesterase 1870 ChEMBL 10.1016/j.bmc.2017.02.049 10.7270/Q2GQ717D 28302511 Liu, Z; Fang, L; Zhang, H; Gou, S; Chen, L China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50256524 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50256524&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137651627 402360765 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50807652 CC(=O)C(=C/c1ccc(O)cc1)\C(=O)NCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C28H31N3O3/c1-19(32)24(18-20-12-14-21(33)15-13-20)28(34)30-17-7-6-16-29-27-22-8-2-4-10-25(22)31-26-11-5-3-9-23(26)27/h2,4,8,10,12-15,18,33H,3,5-7,9,11,16-17H2,1H3,(H,29,31)(H,30,34)/b24-18+ VFALUAYQSAEKSX-HKOYGPOVSA-N 50256527 CHEMBL4074267 Cholinesterase 4770 ChEMBL 10.1016/j.bmc.2017.02.049 10.7270/Q2GQ717D 28302511 Liu, Z; Fang, L; Zhang, H; Gou, S; Chen, L China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50256527 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50256527&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137641297 402360768 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50807653 CC(=O)C(=C/c1ccc(O)cc1)\C(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C30H35N3O3/c1-21(34)26(20-22-14-16-23(35)17-15-22)30(36)32-19-9-3-2-8-18-31-29-24-10-4-6-12-27(24)33-28-13-7-5-11-25(28)29/h4,6,10,12,14-17,20,35H,2-3,5,7-9,11,13,18-19H2,1H3,(H,31,33)(H,32,36)/b26-20+ CNSMLMVCFYCHHY-LHLOQNFPSA-N 50256497 CHEMBL4082185 Cholinesterase 2240 ChEMBL 10.1016/j.bmc.2017.02.049 10.7270/Q2GQ717D 28302511 Liu, Z; Fang, L; Zhang, H; Gou, S; Chen, L China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50256497 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50256497&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137645773 402360763 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50807654 COc1cc(\C=C(/C(C)=O)C(=O)NCCCCCCNc2c3CCCCc3nc3ccccc23)ccc1O InChI=1S/C31H37N3O4/c1-21(35)25(19-22-15-16-28(36)29(20-22)38-2)31(37)33-18-10-4-3-9-17-32-30-23-11-5-7-13-26(23)34-27-14-8-6-12-24(27)30/h5,7,11,13,15-16,19-20,36H,3-4,6,8-10,12,14,17-18H2,1-2H3,(H,32,34)(H,33,37)/b25-19+ GRWFCJWYNDLDQB-NCELDCMTSA-N 50256496 CHEMBL4105187 Cholinesterase 1500 ChEMBL 10.1016/j.bmc.2017.02.049 10.7270/Q2GQ717D 28302511 Liu, Z; Fang, L; Zhang, H; Gou, S; Chen, L China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50256496 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50256496&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137658455 402360762 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50807655 CC(=O)C(Cc1ccc(O)cc1)C(=O)NCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C28H33N3O3/c1-19(32)24(18-20-12-14-21(33)15-13-20)28(34)30-17-7-6-16-29-27-22-8-2-4-10-25(22)31-26-11-5-3-9-23(26)27/h2,4,8,10,12-15,24,33H,3,5-7,9,11,16-18H2,1H3,(H,29,31)(H,30,34) SDPGKQHHCWZZON-UHFFFAOYSA-N 50256525 CHEMBL4093399 Cholinesterase 390 ChEMBL 10.1016/j.bmc.2017.02.049 10.7270/Q2GQ717D 28302511 Liu, Z; Fang, L; Zhang, H; Gou, S; Chen, L China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50256525 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50256525&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137653982 402360766 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50807657 CC(=O)CC(=O)NCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C21H27N3O2/c1-15(25)14-20(26)22-12-6-7-13-23-21-16-8-2-4-10-18(16)24-19-11-5-3-9-17(19)21/h2,4,8,10H,3,5-7,9,11-14H2,1H3,(H,22,26)(H,23,24) HUGLDRAQSWTPDW-UHFFFAOYSA-N 50256526 CHEMBL4074424 Cholinesterase 160 ChEMBL 10.1016/j.bmc.2017.02.049 10.7270/Q2GQ717D 28302511 Liu, Z; Fang, L; Zhang, H; Gou, S; Chen, L China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50256526 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50256526&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137641101 402360767 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50807666 COc1cc(\C=C(/C(C)=O)C(=O)NCCCCNc2c3CCCCc3nc3ccccc23)ccc1O InChI=1S/C29H33N3O4/c1-19(33)23(17-20-13-14-26(34)27(18-20)36-2)29(35)31-16-8-7-15-30-28-21-9-3-5-11-24(21)32-25-12-6-4-10-22(25)28/h3,5,9,11,13-14,17-18,34H,4,6-8,10,12,15-16H2,1-2H3,(H,30,32)(H,31,35)/b23-17+ OIAKAFSKWBYFMP-HAVVHWLPSA-N 50256498 CHEMBL4064355 Cholinesterase 2110 ChEMBL 10.1016/j.bmc.2017.02.049 10.7270/Q2GQ717D 28302511 Liu, Z; Fang, L; Zhang, H; Gou, S; Chen, L China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50256498 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50256498&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137636949 402360764 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50807667 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 50 ChEMBL 10.1016/j.bmc.2017.02.049 10.7270/Q2GQ717D 28302511 Liu, Z; Fang, L; Zhang, H; Gou, S; Chen, L China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50767388 Oc1ccc(\C=C\c2cc(O)cc(O)c2)cc1 InChI=1S/C14H12O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h1-9,15-17H/b2-1+ LUKBXSAWLPMMSZ-OWOJBTEDSA-N 23926 (E)-resveratrol::5-[(E)-2-(4-hydroxyphenyl)ethenyl]benzene-1,3-diol::CHEMBL165::Resveratol::Stilbene, 2f::cid_445154::resveratrol::trans-resveratrol Cholinesterase 400000 ChEMBL 10.1016/j.ejmech.2017.03.062 10.7270/Q2HX1G33 28371641 Li, Q; Yang, H; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=23926 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=23926&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search STL 6JEM,7WAQ,4QOH,4QOJ,5NZL,1U0W,3MNQ,7K1C,2L98,8ABT,4DPN,2YDX,5CR1,7Q9O,3CKL,1Z1F,1SG0,4PP6,1CGZ,5J54,7CCU,7KD8,4JAZ,1DVS,7CCW,3FTS,5U90,5BTR,4QER,2JIZ,7VB8,4HDA,4Q93 445154 53785926 27881 CHEMBL165 DB02709 C03582 ZINC00006787 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50790622 CCN(CC)CCCCCCOc1ccc2CCC(=O)Nc2c1 InChI=1S/C19H30N2O2/c1-3-21(4-2)13-7-5-6-8-14-23-17-11-9-16-10-12-19(22)20-18(16)15-17/h9,11,15H,3-8,10,12-14H2,1-2H3,(H,20,22) RKKHGUZSFXKPLQ-UHFFFAOYSA-N 50252564 CHEMBL4092092 Cholinesterase 29500 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252564 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252564&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137655576 401957588 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50790623 CC(C)N1CCN(CCCCCCOc2ccc3CCC(=O)Nc3c2)CC1 InChI=1S/C22H35N3O2/c1-18(2)25-14-12-24(13-15-25)11-5-3-4-6-16-27-20-9-7-19-8-10-22(26)23-21(19)17-20/h7,9,17-18H,3-6,8,10-16H2,1-2H3,(H,23,26) QQWBCCDHFNBKRY-UHFFFAOYSA-N 50252565 CHEMBL4064374 Cholinesterase 2000 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252565 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252565&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137636952 401957589 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50790624 O=C1CCc2ccc(OCCCCCCN3CCN(CC3)c3ccccn3)cc2N1 InChI=1S/C24H32N4O2/c29-24-11-9-20-8-10-21(19-22(20)26-24)30-18-6-2-1-5-13-27-14-16-28(17-15-27)23-7-3-4-12-25-23/h3-4,7-8,10,12,19H,1-2,5-6,9,11,13-18H2,(H,26,29) QXHNWIXSJYHTMM-UHFFFAOYSA-N 50252605 CHEMBL4072417 Cholinesterase 4100 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252605 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252605&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137640020 401957598 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50790625 O=C1CCc2ccc(OCCCCCCN3CCC(CC3)N3CCCC3)cc2N1 InChI=1S/C24H37N3O2/c28-24-10-8-20-7-9-22(19-23(20)25-24)29-18-6-2-1-3-13-26-16-11-21(12-17-26)27-14-4-5-15-27/h7,9,19,21H,1-6,8,10-18H2,(H,25,28) ZVLRSTBOUBXPMP-UHFFFAOYSA-N 50252566 CHEMBL4099350 Cholinesterase 32700 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252566 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252566&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137658804 401957590 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50790626 O=C1CCc2ccc(OCCCCCCN3CCc4ccccc4C3)cc2N1 InChI=1S/C24H30N2O2/c27-24-12-10-20-9-11-22(17-23(20)25-24)28-16-6-2-1-5-14-26-15-13-19-7-3-4-8-21(19)18-26/h3-4,7-9,11,17H,1-2,5-6,10,12-16,18H2,(H,25,27) BIIFFVLUGVJJJX-UHFFFAOYSA-N 50252568 CHEMBL4091608 Cholinesterase 1200 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252568 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252568&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137652717 401957592 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50790627 O=C1CCc2ccc(OCCCCCCN(CC#C)Cc3ccccc3)cc2N1 InChI=1S/C25H30N2O2/c1-2-16-27(20-21-10-6-5-7-11-21)17-8-3-4-9-18-29-23-14-12-22-13-15-25(28)26-24(22)19-23/h1,5-7,10-12,14,19H,3-4,8-9,13,15-18,20H2,(H,26,28) PSSHUTWSVJPBKP-UHFFFAOYSA-N 50252606 CHEMBL4101838 Cholinesterase 2400 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252606 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252606&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137661504 401957599 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50790628 O=C1CCc2ccc(OCCCCCCN3CCCC3)cc2N1 InChI=1S/C19H28N2O2/c22-19-10-8-16-7-9-17(15-18(16)20-19)23-14-6-2-1-3-11-21-12-4-5-13-21/h7,9,15H,1-6,8,10-14H2,(H,20,22) BSHSBTXLSUVNJQ-UHFFFAOYSA-N 50252570 CHEMBL4094097 Cholinesterase 870 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252570 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252570&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137653292 104105345 ZINC14711621 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50790629 O=C1CCc2ccc(OCCCCCCN3CCC(Cc4ccccc4)CC3)cc2N1 InChI=1S/C27H36N2O2/c30-27-13-11-24-10-12-25(21-26(24)28-27)31-19-7-2-1-6-16-29-17-14-23(15-18-29)20-22-8-4-3-5-9-22/h3-5,8-10,12,21,23H,1-2,6-7,11,13-20H2,(H,28,30) YUSRYUVUQZAREX-UHFFFAOYSA-N 50252571 CHEMBL4073457 Cholinesterase 2300 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252571 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252571&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 20438759 104105346 ZINC33832187 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50790630 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 4760 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50790897 O=C1CCc2ccc(OCCCN3CCCCC3)cc2N1 InChI=1S/C17H24N2O2/c20-17-8-6-14-5-7-15(13-16(14)18-17)21-12-4-11-19-9-2-1-3-10-19/h5,7,13H,1-4,6,8-12H2,(H,18,20) NAQINJPIEGPLKW-UHFFFAOYSA-N 50005699 CHEMBL3235456 Cholinesterase 39000 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50005699 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50005699&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 23454034 103919151 CHEMBL3235456 ZINC96178761 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50790950 CCN(CC)CCCOc1ccc2CCC(=O)Nc2c1 InChI=1S/C16H24N2O2/c1-3-18(4-2)10-5-11-20-14-8-6-13-7-9-16(19)17-15(13)12-14/h6,8,12H,3-5,7,9-11H2,1-2H3,(H,17,19) KQHWBVWFVZPMDB-UHFFFAOYSA-N 50252518 CHEMBL4062293 Cholinesterase 29700 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252518 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252518&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137637802 401957574 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50790969 CC(C)N1CCN(CCCOc2ccc3CCC(=O)Nc3c2)CC1 InChI=1S/C19H29N3O2/c1-15(2)22-11-9-21(10-12-22)8-3-13-24-17-6-4-16-5-7-19(23)20-18(16)14-17/h4,6,14-15H,3,5,7-13H2,1-2H3,(H,20,23) LNSJHGDEBCQKEU-UHFFFAOYSA-N 50252519 CHEMBL4084007 Cholinesterase 20000 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252519 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252519&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137646776 104105312 ZINC02008850 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50790971 O=C1CCc2ccc(OCCCN3CCC(CC3)N3CCCC3)cc2N1 InChI=1S/C21H31N3O2/c25-21-7-5-17-4-6-19(16-20(17)22-21)26-15-3-10-23-13-8-18(9-14-23)24-11-1-2-12-24/h4,6,16,18H,1-3,5,7-15H2,(H,22,25) KKRQTLZLQIANNI-UHFFFAOYSA-N 50252520 CHEMBL4096153 Cholinesterase 39600 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252520 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252520&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137655066 104105313 ZINC14711632 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50790995 O=C1CCc2ccc(OCCCN3CCN(Cc4ccccc4)CC3)cc2N1 InChI=1S/C23H29N3O2/c27-23-10-8-20-7-9-21(17-22(20)24-23)28-16-4-11-25-12-14-26(15-13-25)18-19-5-2-1-3-6-19/h1-3,5-7,9,17H,4,8,10-16,18H2,(H,24,27) RRBYJBJQLCHSIT-UHFFFAOYSA-N 50252526 CHEMBL4059592 Cholinesterase 19400 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252526 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252526&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12899541 401957575 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50790997 O=C1CCc2ccc(OCCCN3CCc4ccccc4C3)cc2N1 InChI=1S/C21H24N2O2/c24-21-9-7-17-6-8-19(14-20(17)22-21)25-13-3-11-23-12-10-16-4-1-2-5-18(16)15-23/h1-2,4-6,8,14H,3,7,9-13,15H2,(H,22,24) VUVLHXICIKCCTI-UHFFFAOYSA-N 50252538 CHEMBL4087905 Cholinesterase 5500 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252538 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252538&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46829776 401957576 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50791029 O=C1CCc2ccc(OCCCCN3CCCCC3)cc2N1 InChI=1S/C18H26N2O2/c21-18-9-7-15-6-8-16(14-17(15)19-18)22-13-5-4-12-20-10-2-1-3-11-20/h6,8,14H,1-5,7,9-13H2,(H,19,21) CHNHVYIPLUZXRO-UHFFFAOYSA-N 50252539 CHEMBL4095608 Cholinesterase 15700 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252539 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252539&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 117945944 401957577 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50791042 CCN(CC)CCCCOc1ccc2CCC(=O)Nc2c1 InChI=1S/C17H26N2O2/c1-3-19(4-2)11-5-6-12-21-15-9-7-14-8-10-17(20)18-16(14)13-15/h7,9,13H,3-6,8,10-12H2,1-2H3,(H,18,20) BXMCAFKPJYADCI-UHFFFAOYSA-N 50252540 CHEMBL4090338 Cholinesterase 7700 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252540 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252540&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137644000 401957578 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50791188 O=C1CCc2ccc(OCCCCN3CCN(CC3)c3ccccn3)cc2N1 InChI=1S/C22H28N4O2/c27-22-9-7-18-6-8-19(17-20(18)24-22)28-16-4-3-11-25-12-14-26(15-13-25)21-5-1-2-10-23-21/h1-2,5-6,8,10,17H,3-4,7,9,11-16H2,(H,24,27) UNMHAMCGLXBCKS-UHFFFAOYSA-N 50252607 CHEMBL4098050 Cholinesterase 8400 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252607 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252607&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137658745 401957600 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50791283 O=C1CCc2ccc(OCCCCN3CCN(Cc4ccccc4)CC3)cc2N1 InChI=1S/C24H31N3O2/c28-24-11-9-21-8-10-22(18-23(21)25-24)29-17-5-4-12-26-13-15-27(16-14-26)19-20-6-2-1-3-7-20/h1-3,6-8,10,18H,4-5,9,11-17,19H2,(H,25,28) BCJVWMLNNVCCKZ-UHFFFAOYSA-N 50252552 CHEMBL4080020 Cholinesterase 10700 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252552 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252552&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137649886 401957580 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50791334 O=C1CCc2ccc(OCCCCN3CCc4ccccc4C3)cc2N1 InChI=1S/C22H26N2O2/c25-22-10-8-18-7-9-20(15-21(18)23-22)26-14-4-3-12-24-13-11-17-5-1-2-6-19(17)16-24/h1-2,5-7,9,15H,3-4,8,10-14,16H2,(H,23,25) WKRADRDLWGKBQG-UHFFFAOYSA-N 50252553 CHEMBL4094660 Cholinesterase 3800 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252553 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252553&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46829772 401957581 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50791497 O=C1CCc2ccc(OCCCCCN3CCCCC3)cc2N1 InChI=1S/C19H28N2O2/c22-19-10-8-16-7-9-17(15-18(16)20-19)23-14-6-2-5-13-21-11-3-1-4-12-21/h7,9,15H,1-6,8,10-14H2,(H,20,22) CKHSPSSFBYYIBO-UHFFFAOYSA-N 50252554 CHEMBL4103245 Cholinesterase 32800 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252554 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252554&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137657973 401957582 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50791507 CCN(CC)CCCCCOc1ccc2CCC(=O)Nc2c1 InChI=1S/C18H28N2O2/c1-3-20(4-2)12-6-5-7-13-22-16-10-8-15-9-11-18(21)19-17(15)14-16/h8,10,14H,3-7,9,11-13H2,1-2H3,(H,19,21) GHWLFYWVRPYWPI-UHFFFAOYSA-N 50252555 CHEMBL4078982 Cholinesterase 21900 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252555 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252555&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137650801 401957583 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50791508 CC(C)N1CCN(CCCCCOc2ccc3CCC(=O)Nc3c2)CC1 InChI=1S/C21H33N3O2/c1-17(2)24-13-11-23(12-14-24)10-4-3-5-15-26-19-8-6-18-7-9-21(25)22-20(18)16-19/h6,8,16-17H,3-5,7,9-15H2,1-2H3,(H,22,25) JQVTULFDKBHKEJ-UHFFFAOYSA-N 50252556 CHEMBL4065398 Cholinesterase 3200 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252556 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252556&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137633537 401957584 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50791509 O=C1CCc2ccc(OCCCCCN3CCN(Cc4ccccc4)CC3)cc2N1 InChI=1S/C25H33N3O2/c29-25-12-10-22-9-11-23(19-24(22)26-25)30-18-6-2-5-13-27-14-16-28(17-15-27)20-21-7-3-1-4-8-21/h1,3-4,7-9,11,19H,2,5-6,10,12-18,20H2,(H,26,29) IYGLBUNIEKVQSZ-UHFFFAOYSA-N 50252557 CHEMBL4074011 Cholinesterase 12700 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252557 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252557&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137641345 401957585 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50791510 O=C1CCc2ccc(OCCCCCN3CCc4ccccc4C3)cc2N1 InChI=1S/C23H28N2O2/c26-23-11-9-19-8-10-21(16-22(19)24-23)27-15-5-1-4-13-25-14-12-18-6-2-3-7-20(18)17-25/h2-3,6-8,10,16H,1,4-5,9,11-15,17H2,(H,24,26) MANGBYSAGCIUHY-UHFFFAOYSA-N 50252558 CHEMBL4094559 Cholinesterase 900 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252558 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252558&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137653313 401957586 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50791511 O=C1CCc2ccc(OCCCCCCN3CCCCC3)cc2N1 InChI=1S/C20H30N2O2/c23-20-11-9-17-8-10-18(16-19(17)21-20)24-15-7-2-1-4-12-22-13-5-3-6-14-22/h8,10,16H,1-7,9,11-15H2,(H,21,23) OPRPOGCTZWDVTJ-UHFFFAOYSA-N 50252563 CHEMBL4102298 Cholinesterase 14100 ChEMBL 10.1016/j.bmc.2017.03.070 10.7270/Q2F76G04 28487125 Sang, Z; Pan, W; Wang, K; Ma, Q; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252563 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252563&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137659176 401957587 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50787803 [Br-].COc1cc2C\C(=C/c3cc[n+](Cc4ccc(F)cc4)cc3)C(=O)c2cc1OC InChI=1S/C24H21FNO3/c1-28-22-13-18-12-19(24(27)21(18)14-23(22)29-2)11-16-7-9-26(10-8-16)15-17-3-5-20(25)6-4-17/h3-11,13-14H,12,15H2,1-2H3/q+1/b19-11+ FRLDRKDNJCBXKL-YBFXNURJSA-N 50251342 CHEMBL4073287 Cholinesterase 5400 ChEMBL 10.1016/j.ejmech.2017.02.045 10.7270/Q2FB55C0 28388521 Lan, JS; Zhang, T; Liu, Y; Yang, J; Xie, SS; Liu, J; Miao, ZY; Ding, Y Shanghai University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50251342 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50251342&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137640423 401962742 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50787849 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 4500 ChEMBL 10.1016/j.ejmech.2017.02.045 10.7270/Q2FB55C0 28388521 Lan, JS; Zhang, T; Liu, Y; Yang, J; Xie, SS; Liu, J; Miao, ZY; Ding, Y Shanghai University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50788495 CCCCOP(=O)(OCCCC)Oc1ccccc1 InChI=1S/C14H23O4P/c1-3-5-12-16-19(15,17-13-6-4-2)18-14-10-8-7-9-11-14/h7-11H,3-6,12-13H2,1-2H3 YICSVBJRVMLQNS-UHFFFAOYSA-N 50251511 CHEMBL4094240 Cholinesterase 45000 ChEMBL 10.1016/j.bmc.2017.04.002 10.7270/Q2NV9MQD 28416102 Nakayama, K; Schwans, JP; Sorin, EJ; Tran, T; Gonzalez, J; Arteaga, E; McCoy, S; Alvarado, W California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50251511 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50251511&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 17312 401962826 C03254 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50788497 CCCCCOP(=O)(OCCCCC)Oc1ccccc1 InChI=1S/C16H27O4P/c1-3-5-10-14-18-21(17,19-15-11-6-4-2)20-16-12-8-7-9-13-16/h7-9,12-13H,3-6,10-11,14-15H2,1-2H3 XGERJGRFYKEESL-UHFFFAOYSA-N 50251512 CHEMBL4060321 Cholinesterase 6000 ChEMBL 10.1016/j.bmc.2017.04.002 10.7270/Q2NV9MQD 28416102 Nakayama, K; Schwans, JP; Sorin, EJ; Tran, T; Gonzalez, J; Arteaga, E; McCoy, S; Alvarado, W California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50251512 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50251512&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 16062459 401962827 C03254 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50788498 CCCCOP(=O)(OCCCC)Oc1cccc(C)c1 InChI=1S/C15H25O4P/c1-4-6-11-17-20(16,18-12-7-5-2)19-15-10-8-9-14(3)13-15/h8-10,13H,4-7,11-12H2,1-3H3 KRHJRRGRZABDAR-UHFFFAOYSA-N 50251523 CHEMBL4076133 Cholinesterase 16000 ChEMBL 10.1016/j.bmc.2017.04.002 10.7270/Q2NV9MQD 28416102 Nakayama, K; Schwans, JP; Sorin, EJ; Tran, T; Gonzalez, J; Arteaga, E; McCoy, S; Alvarado, W California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50251523 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50251523&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 526157 401962828 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50788499 CCCCOP(=O)(OCCCC)Oc1ccc(C)cc1 InChI=1S/C15H25O4P/c1-4-6-12-17-20(16,18-13-7-5-2)19-15-10-8-14(3)9-11-15/h8-11H,4-7,12-13H2,1-3H3 AXVQGNPTHCNQLJ-UHFFFAOYSA-N 50251524 CHEMBL4070069 Cholinesterase 8000 ChEMBL 10.1016/j.bmc.2017.04.002 10.7270/Q2NV9MQD 28416102 Nakayama, K; Schwans, JP; Sorin, EJ; Tran, T; Gonzalez, J; Arteaga, E; McCoy, S; Alvarado, W California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50251524 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50251524&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 526162 401962829 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50788500 CCCCOP(=O)(OCCCC)Oc1ccc(C)c(C)c1 InChI=1S/C16H27O4P/c1-5-7-11-18-21(17,19-12-8-6-2)20-16-10-9-14(3)15(4)13-16/h9-10,13H,5-8,11-12H2,1-4H3 AGMVTHCUTWYVFA-UHFFFAOYSA-N 50251525 CHEMBL4103125 Cholinesterase 9000 ChEMBL 10.1016/j.bmc.2017.04.002 10.7270/Q2NV9MQD 28416102 Nakayama, K; Schwans, JP; Sorin, EJ; Tran, T; Gonzalez, J; Arteaga, E; McCoy, S; Alvarado, W California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50251525 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50251525&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137656883 401962830 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50788501 CCCCOP(=O)(OCCCC)Oc1cc(C)c(C)c(C)c1 InChI=1S/C17H29O4P/c1-6-8-10-19-22(18,20-11-9-7-2)21-17-12-14(3)16(5)15(4)13-17/h12-13H,6-11H2,1-5H3 SIPNNCPULHSYDS-UHFFFAOYSA-N 50251526 CHEMBL4060636 Cholinesterase 11000 ChEMBL 10.1016/j.bmc.2017.04.002 10.7270/Q2NV9MQD 28416102 Nakayama, K; Schwans, JP; Sorin, EJ; Tran, T; Gonzalez, J; Arteaga, E; McCoy, S; Alvarado, W California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50251526 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50251526&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137635207 401962831 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50788504 CCCCOP(=O)(OCCCC)Oc1cccc2ccccc12 InChI=1S/C18H25O4P/c1-3-5-14-20-23(19,21-15-6-4-2)22-18-13-9-11-16-10-7-8-12-17(16)18/h7-13H,3-6,14-15H2,1-2H3 PLDKUKDLHVUHPY-UHFFFAOYSA-N 50251527 CHEMBL4084914 Cholinesterase 22000 ChEMBL 10.1016/j.bmc.2017.04.002 10.7270/Q2NV9MQD 28416102 Nakayama, K; Schwans, JP; Sorin, EJ; Tran, T; Gonzalez, J; Arteaga, E; McCoy, S; Alvarado, W California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50251527 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50251527&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 99177 401962832 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50788506 CCCCOP(=O)(OCCCC)OCc1ccccc1 InChI=1S/C15H25O4P/c1-3-5-12-17-20(16,18-13-6-4-2)19-14-15-10-8-7-9-11-15/h7-11H,3-6,12-14H2,1-2H3 CYWAMKAHXBXNOW-UHFFFAOYSA-N 50251528 CHEMBL4089303 Cholinesterase 2000 ChEMBL 10.1016/j.bmc.2017.04.002 10.7270/Q2NV9MQD 28416102 Nakayama, K; Schwans, JP; Sorin, EJ; Tran, T; Gonzalez, J; Arteaga, E; McCoy, S; Alvarado, W California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50251528 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50251528&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 21712021 401962833 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50788507 CCCCOP(=O)(OCCCC)OCc1ccccc1C InChI=1S/C16H27O4P/c1-4-6-12-18-21(17,19-13-7-5-2)20-14-16-11-9-8-10-15(16)3/h8-11H,4-7,12-14H2,1-3H3 PYKYWUUPKCDCAJ-UHFFFAOYSA-N 50251529 CHEMBL4067296 Cholinesterase 72000 ChEMBL 10.1016/j.bmc.2017.04.002 10.7270/Q2NV9MQD 28416102 Nakayama, K; Schwans, JP; Sorin, EJ; Tran, T; Gonzalez, J; Arteaga, E; McCoy, S; Alvarado, W California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50251529 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50251529&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137632672 401962834 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50788509 CCCCOP(=O)(OCCCC)OCc1cccc(C)c1 InChI=1S/C16H27O4P/c1-4-6-11-18-21(17,19-12-7-5-2)20-14-16-10-8-9-15(3)13-16/h8-10,13H,4-7,11-12,14H2,1-3H3 FNTYUIHYKIXGJQ-UHFFFAOYSA-N 50251530 CHEMBL4073516 Cholinesterase 24000 ChEMBL 10.1016/j.bmc.2017.04.002 10.7270/Q2NV9MQD 28416102 Nakayama, K; Schwans, JP; Sorin, EJ; Tran, T; Gonzalez, J; Arteaga, E; McCoy, S; Alvarado, W California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50251530 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50251530&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137640782 401962835 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50788510 CCCCOP(=O)(OCCCC)OCCc1ccccc1 InChI=1S/C16H27O4P/c1-3-5-13-18-21(17,19-14-6-4-2)20-15-12-16-10-8-7-9-11-16/h7-11H,3-6,12-15H2,1-2H3 OHAPIVDMNFISJZ-UHFFFAOYSA-N 50251531 CHEMBL4080456 Cholinesterase 53000 ChEMBL 10.1016/j.bmc.2017.04.002 10.7270/Q2NV9MQD 28416102 Nakayama, K; Schwans, JP; Sorin, EJ; Tran, T; Gonzalez, J; Arteaga, E; McCoy, S; Alvarado, W California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50251531 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50251531&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137647830 401962836 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50788511 CCOP(=O)(OCC)Oc1cc(C)cc(C)c1 InChI=1S/C12H19O4P/c1-5-14-17(13,15-6-2)16-12-8-10(3)7-11(4)9-12/h7-9H,5-6H2,1-4H3 OIMKOBBYUKINOC-UHFFFAOYSA-N 50251544 CHEMBL4105019 Cholinesterase 583000 ChEMBL 10.1016/j.bmc.2017.04.002 10.7270/Q2NV9MQD 28416102 Nakayama, K; Schwans, JP; Sorin, EJ; Tran, T; Gonzalez, J; Arteaga, E; McCoy, S; Alvarado, W California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50251544 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50251544&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 85834136 401962837 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50788513 CCOP(=O)(OCC)Oc1ccccc1 InChI=1S/C10H15O4P/c1-3-12-15(11,13-4-2)14-10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3 DHTQKXHLXVUBCF-UHFFFAOYSA-N 50127647 CHEMBL296745::Phosphoric acid diethyl ester phenyl ester Cholinesterase 1590000 ChEMBL 10.1016/j.bmc.2017.04.002 10.7270/Q2NV9MQD 28416102 Nakayama, K; Schwans, JP; Sorin, EJ; Tran, T; Gonzalez, J; Arteaga, E; McCoy, S; Alvarado, W California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50127647 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50127647&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 17280 104019523 CHEMBL296745 C03254 ZINC01532338 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50788514 CCCCOP(=O)(OCCCC)Oc1cc(C)cc(C)c1 InChI=1S/C16H27O4P/c1-5-7-9-18-21(17,19-10-8-6-2)20-16-12-14(3)11-15(4)13-16/h11-13H,5-10H2,1-4H3 YEVQJDYNBOEUDP-UHFFFAOYSA-N 50251556 CHEMBL4082512 Cholinesterase 1000 ChEMBL 10.1016/j.bmc.2017.04.002 10.7270/Q2NV9MQD 28416102 Nakayama, K; Schwans, JP; Sorin, EJ; Tran, T; Gonzalez, J; Arteaga, E; McCoy, S; Alvarado, W California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50251556 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50251556&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 132569688 401962838 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50788515 CCCCOP(=O)(OCCCC)Oc1ccc2ccccc2c1 InChI=1S/C18H25O4P/c1-3-5-13-20-23(19,21-14-6-4-2)22-18-12-11-16-9-7-8-10-17(16)15-18/h7-12,15H,3-6,13-14H2,1-2H3 MTQZVOBXNGHZKX-UHFFFAOYSA-N 50251557 CHEMBL4062422 Cholinesterase 1900 ChEMBL 10.1016/j.bmc.2017.04.002 10.7270/Q2NV9MQD 28416102 Nakayama, K; Schwans, JP; Sorin, EJ; Tran, T; Gonzalez, J; Arteaga, E; McCoy, S; Alvarado, W California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50251557 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50251557&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 303471 401962839 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50788516 CCCCOP(=O)(OCCCC)OCc1ccc(C)cc1 InChI=1S/C16H27O4P/c1-4-6-12-18-21(17,19-13-7-5-2)20-14-16-10-8-15(3)9-11-16/h8-11H,4-7,12-14H2,1-3H3 XLGFPRISKWVTHJ-UHFFFAOYSA-N 50251558 CHEMBL4097681 Cholinesterase 14000 ChEMBL 10.1016/j.bmc.2017.04.002 10.7270/Q2NV9MQD 28416102 Nakayama, K; Schwans, JP; Sorin, EJ; Tran, T; Gonzalez, J; Arteaga, E; McCoy, S; Alvarado, W California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50251558 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50251558&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137661335 401962840 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50788518 CCOP(=O)(OCC)Oc1ccc2ccccc2c1 InChI=1S/C14H17O4P/c1-3-16-19(15,17-4-2)18-14-10-9-12-7-5-6-8-13(12)11-14/h5-11H,3-4H2,1-2H3 SIHQLNSQZGAHQX-UHFFFAOYSA-N 50251559 CHEMBL4083188 Cholinesterase 147000 ChEMBL 10.1016/j.bmc.2017.04.002 10.7270/Q2NV9MQD 28416102 Nakayama, K; Schwans, JP; Sorin, EJ; Tran, T; Gonzalez, J; Arteaga, E; McCoy, S; Alvarado, W California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50251559 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50251559&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3014937 401962841 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50788520 CCCOP(=O)(OCCC)Oc1ccccc1 InChI=1S/C12H19O4P/c1-3-10-14-17(13,15-11-4-2)16-12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3 VUTSVIHQBJIUOS-UHFFFAOYSA-N 50251560 CHEMBL4065237 Cholinesterase 45000 ChEMBL 10.1016/j.bmc.2017.04.002 10.7270/Q2NV9MQD 28416102 Nakayama, K; Schwans, JP; Sorin, EJ; Tran, T; Gonzalez, J; Arteaga, E; McCoy, S; Alvarado, W California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50251560 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50251560&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 181576 401962842 C03254 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50788521 CCCCOP(=O)(OCCCC)Oc1ccccc1C InChI=1S/C15H25O4P/c1-4-6-12-17-20(16,18-13-7-5-2)19-15-11-9-8-10-14(15)3/h8-11H,4-7,12-13H2,1-3H3 WNJNVWLGBGINMK-UHFFFAOYSA-N 50251576 CHEMBL4074962 Cholinesterase 50000 ChEMBL 10.1016/j.bmc.2017.04.002 10.7270/Q2NV9MQD 28416102 Nakayama, K; Schwans, JP; Sorin, EJ; Tran, T; Gonzalez, J; Arteaga, E; McCoy, S; Alvarado, W California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50251576 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50251576&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 25064759 401962843 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50859323 CCN(CCN1C(=O)c2ccccc2C1=O)Cc1ccccc1 InChI=1S/C19H20N2O2/c1-2-20(14-15-8-4-3-5-9-15)12-13-21-18(22)16-10-6-7-11-17(16)19(21)23/h3-11H,2,12-14H2,1H3 GQPABTQFSACTGH-UHFFFAOYSA-N 50262855 CHEMBL4077879 Cholinesterase 21900 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262855 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262855&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 24001527 404341299 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50859327 O=C1N(CCCCCCN(CC#C)Cc2ccccc2)C(=O)c2ccccc12 InChI=1S/C24H26N2O2/c1-2-16-25(19-20-12-6-5-7-13-20)17-10-3-4-11-18-26-23(27)21-14-8-9-15-22(21)24(26)28/h1,5-9,12-15H,3-4,10-11,16-19H2 JWNNVZINYHGLQY-UHFFFAOYSA-N 50262854 CHEMBL4081393 Cholinesterase 7600 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262854 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262854&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137645972 404341298 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50859335 O=C1N(CCCCCN(CC#C)Cc2ccccc2)C(=O)c2ccccc12 InChI=1S/C23H24N2O2/c1-2-15-24(18-19-11-5-3-6-12-19)16-9-4-10-17-25-22(26)20-13-7-8-14-21(20)23(25)27/h1,3,5-8,11-14H,4,9-10,15-18H2 XDFOXZATXBTBSQ-UHFFFAOYSA-N 50262895 CHEMBL4076402 Cholinesterase 13900 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262895 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262895&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137650217 404341304 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50859351 CCN(CCCCN1C(=O)c2ccccc2C1=O)Cc1ccccc1 InChI=1S/C21H24N2O2/c1-2-22(16-17-10-4-3-5-11-17)14-8-9-15-23-20(24)18-12-6-7-13-19(18)21(23)25/h3-7,10-13H,2,8-9,14-16H2,1H3 VKGYDOYSYVLFIR-UHFFFAOYSA-N 50262858 CHEMBL4091683 Cholinesterase 9800 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262858 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262858&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 35793912 404341302 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50859380 COc1ccccc1CN(C)CCCCN1C(=O)c2ccccc2C1=O InChI=1S/C21H24N2O3/c1-22(15-16-9-3-6-12-19(16)26-2)13-7-8-14-23-20(24)17-10-4-5-11-18(17)21(23)25/h3-6,9-12H,7-8,13-15H2,1-2H3 QXXKSCJHTHUCPD-UHFFFAOYSA-N 50262882 CHEMBL4096975 Cholinesterase 7900 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262882 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262882&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 18151760 404341303 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50859396 COc1ccccc1CN(C)CCN1C(=O)c2ccccc2C1=O InChI=1S/C19H20N2O3/c1-20(13-14-7-3-6-10-17(14)24-2)11-12-21-18(22)15-8-4-5-9-16(15)19(21)23/h3-10H,11-13H2,1-2H3 ABOGSLJHOFIYPP-UHFFFAOYSA-N 50262856 CHEMBL4086653 Cholinesterase 11900 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262856 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262856&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 18087653 404341300 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50859783 CC(=O)c1ccc(OCCCN2CCN(Cc3ccccc3)CC2)cc1O InChI=1S/C22H28N2O3/c1-18(25)21-9-8-20(16-22(21)26)27-15-5-10-23-11-13-24(14-12-23)17-19-6-3-2-4-7-19/h2-4,6-9,16,26H,5,10-15,17H2,1H3 DMVXLCOFFLHXJS-UHFFFAOYSA-N 50262954 CHEMBL4093622 Cholinesterase 31400 ChEMBL 10.1016/j.bmcl.2017.09.057 10.7270/Q2XS5XTR 29033233 Sang, Z; Wang, K; Wang, H; Wang, H; Ma, Q; Han, X; Ye, M; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262954 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262954&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137656084 404341324 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50859784 CC(=O)c1ccc(OCCCCCN2CCCC2)cc1O InChI=1S/C17H25NO3/c1-14(19)16-8-7-15(13-17(16)20)21-12-6-2-3-9-18-10-4-5-11-18/h7-8,13,20H,2-6,9-12H2,1H3 HNTQVZIEPURAGJ-UHFFFAOYSA-N 50262903 CHEMBL4069471 Cholinesterase 37200 ChEMBL 10.1016/j.bmcl.2017.09.057 10.7270/Q2XS5XTR 29033233 Sang, Z; Wang, K; Wang, H; Wang, H; Ma, Q; Han, X; Ye, M; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262903 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262903&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 86043213 404341312 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50859786 CC(=O)c1ccc(OCCCCCN2CCN(CC2)c2ncccn2)cc1O InChI=1S/C21H28N4O3/c1-17(26)19-7-6-18(16-20(19)27)28-15-4-2-3-10-24-11-13-25(14-12-24)21-22-8-5-9-23-21/h5-9,16,27H,2-4,10-15H2,1H3 DBSHXBSQLAKRKN-UHFFFAOYSA-N 50262906 CHEMBL4082669 Cholinesterase 137000 ChEMBL 10.1016/j.bmcl.2017.09.057 10.7270/Q2XS5XTR 29033233 Sang, Z; Wang, K; Wang, H; Wang, H; Ma, Q; Han, X; Ye, M; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262906 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262906&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137647691 404341315 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50859787 CC(=O)c1ccc(OCCCCCCN2CCCCC2)cc1O InChI=1S/C19H29NO3/c1-16(21)18-10-9-17(15-19(18)22)23-14-8-3-2-5-11-20-12-6-4-7-13-20/h9-10,15,22H,2-8,11-14H2,1H3 CWFHDTRSAGZWAZ-UHFFFAOYSA-N 50262907 CHEMBL4099142 Cholinesterase 45700 ChEMBL 10.1016/j.bmcl.2017.09.057 10.7270/Q2XS5XTR 29033233 Sang, Z; Wang, K; Wang, H; Wang, H; Ma, Q; Han, X; Ye, M; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262907 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262907&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137661395 404341316 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50859788 CC(=O)c1ccc(OCCCCCCN2CCCC2)cc1O InChI=1S/C18H27NO3/c1-15(20)17-9-8-16(14-18(17)21)22-13-7-3-2-4-10-19-11-5-6-12-19/h8-9,14,21H,2-7,10-13H2,1H3 ARUJUUKZCRIUCC-UHFFFAOYSA-N 50262908 CHEMBL4072178 Cholinesterase 46500 ChEMBL 10.1016/j.bmcl.2017.09.057 10.7270/Q2XS5XTR 29033233 Sang, Z; Wang, K; Wang, H; Wang, H; Ma, Q; Han, X; Ye, M; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262908 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262908&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137639477 404341317 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50859789 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 4760 ChEMBL 10.1016/j.bmcl.2017.09.057 10.7270/Q2XS5XTR 29033233 Sang, Z; Wang, K; Wang, H; Wang, H; Ma, Q; Han, X; Ye, M; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50860259 CC(=O)c1ccc(OCCCCCN2CCN(Cc3ccccc3)CC2)cc1O InChI=1S/C24H32N2O3/c1-20(27)23-11-10-22(18-24(23)28)29-17-7-3-6-12-25-13-15-26(16-14-25)19-21-8-4-2-5-9-21/h2,4-5,8-11,18,28H,3,6-7,12-17,19H2,1H3 KANJVYYGBUDVHT-UHFFFAOYSA-N 50262904 CHEMBL4090497 Cholinesterase 46100 ChEMBL 10.1016/j.bmcl.2017.09.057 10.7270/Q2XS5XTR 29033233 Sang, Z; Wang, K; Wang, H; Wang, H; Ma, Q; Han, X; Ye, M; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262904 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262904&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137644241 404341313 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50860261 CC(=O)c1ccc(OCCCCCCN2CCN(Cc3ccccc3)CC2)cc1O InChI=1S/C25H34N2O3/c1-21(28)24-12-11-23(19-25(24)29)30-18-8-3-2-7-13-26-14-16-27(17-15-26)20-22-9-5-4-6-10-22/h4-6,9-12,19,29H,2-3,7-8,13-18,20H2,1H3 SDUDFQIXRKFKKE-UHFFFAOYSA-N 50262909 CHEMBL4065727 Cholinesterase 75400 ChEMBL 10.1016/j.bmcl.2017.09.057 10.7270/Q2XS5XTR 29033233 Sang, Z; Wang, K; Wang, H; Wang, H; Ma, Q; Han, X; Ye, M; Yu, L; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262909 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262909&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137633355 404341318 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50854605 F[B-](F)(F)F.CCN(CC)c1ccc(cc1)-c1c2ccccc2[n+](C)c2ccccc12 InChI=1S/C24H25N2/c1-4-26(5-2)19-16-14-18(15-17-19)24-20-10-6-8-12-22(20)25(3)23-13-9-7-11-21(23)24/h6-17H,4-5H2,1-3H3/q+1 OWUVUIASZIGUEV-UHFFFAOYSA-N 50262651 CHEMBL4080726 Cholinesterase 940 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262651 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262651&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137648072 404341229 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50888897 O=C(CN1CCN(CC1)c1ccccc1)NC1=C(C#N)C(c2ccccc2)c2c(O1)c1ccccc1oc2=O InChI=1S/C31H26N4O4/c32-19-24-27(21-9-3-1-4-10-21)28-29(23-13-7-8-14-25(23)38-31(28)37)39-30(24)33-26(36)20-34-15-17-35(18-16-34)22-11-5-2-6-12-22/h1-14,27H,15-18,20H2,(H,33,36) PYZNFTSWDGPRIA-UHFFFAOYSA-N 50268049 CHEMBL4060097 Cholinesterase 52300 ChEMBL 10.1016/j.bmc.2017.05.043 10.7270/Q25Q4ZK4 28587871 Sameem, B; Saeedi, M; Mahdavi, M; Nadri, H; Moghadam, FH; Edraki, N; Khan, MI; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268049 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268049&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137634487 404858748 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50888898 Cc1ccc(C2C(C#N)=C(NC(=O)CN3CCN(CC3)c3ccccc3)Oc3c2c(=O)oc2ccccc32)c(C)c1 InChI=1S/C33H30N4O4/c1-21-12-13-24(22(2)18-21)29-26(19-34)32(41-31-25-10-6-7-11-27(25)40-33(39)30(29)31)35-28(38)20-36-14-16-37(17-15-36)23-8-4-3-5-9-23/h3-13,18,29H,14-17,20H2,1-2H3,(H,35,38) OMERDGJQDUMWSQ-UHFFFAOYSA-N 50268058 CHEMBL4080474 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2017.05.043 10.7270/Q25Q4ZK4 28587871 Sameem, B; Saeedi, M; Mahdavi, M; Nadri, H; Moghadam, FH; Edraki, N; Khan, MI; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268058 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268058&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137648757 404858749 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50888899 COc1ccc(cc1)C1C(C#N)=C(NC(=O)CN2CCN(CC2)c2ccccc2)Oc2c1c(=O)oc1ccccc21 InChI=1S/C32H28N4O5/c1-39-23-13-11-21(12-14-23)28-25(19-33)31(41-30-24-9-5-6-10-26(24)40-32(38)29(28)30)34-27(37)20-35-15-17-36(18-16-35)22-7-3-2-4-8-22/h2-14,28H,15-18,20H2,1H3,(H,34,37) FNSAEVBFZGDWQS-UHFFFAOYSA-N 50268048 CHEMBL4098491 Cholinesterase 45700 ChEMBL 10.1016/j.bmc.2017.05.043 10.7270/Q25Q4ZK4 28587871 Sameem, B; Saeedi, M; Mahdavi, M; Nadri, H; Moghadam, FH; Edraki, N; Khan, MI; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268048 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268048&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 132576264 404858747 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50888900 COc1ccc(C2C(C#N)=C(NC(=O)CN3CCN(CC3)c3ccccc3)Oc3c2c(=O)oc2ccccc32)c(OC)c1 InChI=1S/C33H30N4O6/c1-40-22-12-13-23(27(18-22)41-2)29-25(19-34)32(43-31-24-10-6-7-11-26(24)42-33(39)30(29)31)35-28(38)20-36-14-16-37(17-15-36)21-8-4-3-5-9-21/h3-13,18,29H,14-17,20H2,1-2H3,(H,35,38) QOYSJRGYFROFDE-UHFFFAOYSA-N 50268059 CHEMBL4103820 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2017.05.043 10.7270/Q25Q4ZK4 28587871 Sameem, B; Saeedi, M; Mahdavi, M; Nadri, H; Moghadam, FH; Edraki, N; Khan, MI; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268059 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268059&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137657475 404858750 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50888901 COc1ccc(cc1OC)C1C(C#N)=C(NC(=O)CN2CCN(CC2)c2ccccc2)Oc2c1c(=O)oc1ccccc21 InChI=1S/C33H30N4O6/c1-40-26-13-12-21(18-27(26)41-2)29-24(19-34)32(43-31-23-10-6-7-11-25(23)42-33(39)30(29)31)35-28(38)20-36-14-16-37(17-15-36)22-8-4-3-5-9-22/h3-13,18,29H,14-17,20H2,1-2H3,(H,35,38) GWGPHBWDBKASGL-UHFFFAOYSA-N 50268060 CHEMBL4077242 Cholinesterase 58200 ChEMBL 10.1016/j.bmc.2017.05.043 10.7270/Q25Q4ZK4 28587871 Sameem, B; Saeedi, M; Mahdavi, M; Nadri, H; Moghadam, FH; Edraki, N; Khan, MI; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268060 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268060&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 132576262 404858751 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50888903 Clc1ccc(cc1)C1C(C#N)=C(NC(=O)CN2CCN(CC2)c2ccccc2)Oc2c1c(=O)oc1ccccc21 InChI=1S/C31H25ClN4O4/c32-21-12-10-20(11-13-21)27-24(18-33)30(40-29-23-8-4-5-9-25(23)39-31(38)28(27)29)34-26(37)19-35-14-16-36(17-15-35)22-6-2-1-3-7-22/h1-13,27H,14-17,19H2,(H,34,37) WPTNPVCIRQAMFJ-UHFFFAOYSA-N 50268061 CHEMBL4068753 Cholinesterase 89200 ChEMBL 10.1016/j.bmc.2017.05.043 10.7270/Q25Q4ZK4 28587871 Sameem, B; Saeedi, M; Mahdavi, M; Nadri, H; Moghadam, FH; Edraki, N; Khan, MI; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268061 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268061&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 132576263 404858752 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50888904 O=C(CN1CCOCC1)NC1=C(C#N)C(c2ccccc2)c2c(O1)c1ccccc1oc2=O InChI=1S/C25H21N3O5/c26-14-18-21(16-6-2-1-3-7-16)22-23(17-8-4-5-9-19(17)32-25(22)30)33-24(18)27-20(29)15-28-10-12-31-13-11-28/h1-9,21H,10-13,15H2,(H,27,29) GJHWKNMFMMYTTI-UHFFFAOYSA-N 50268039 CHEMBL4072501 Cholinesterase 88400 ChEMBL 10.1016/j.bmc.2017.05.043 10.7270/Q25Q4ZK4 28587871 Sameem, B; Saeedi, M; Mahdavi, M; Nadri, H; Moghadam, FH; Edraki, N; Khan, MI; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268039 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268039&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137640033 404858739 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50888905 COc1ccc(cc1)C1C(C#N)=C(NC(=O)CN2CCOCC2)Oc2c1c(=O)oc1ccccc21 InChI=1S/C26H23N3O6/c1-32-17-8-6-16(7-9-17)22-19(14-27)25(28-21(30)15-29-10-12-33-13-11-29)35-24-18-4-2-3-5-20(18)34-26(31)23(22)24/h2-9,22H,10-13,15H2,1H3,(H,28,30) MRAYRMSFMXCRAT-UHFFFAOYSA-N 50268040 CHEMBL4104739 Cholinesterase 63800 ChEMBL 10.1016/j.bmc.2017.05.043 10.7270/Q25Q4ZK4 28587871 Sameem, B; Saeedi, M; Mahdavi, M; Nadri, H; Moghadam, FH; Edraki, N; Khan, MI; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268040 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268040&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 132576265 404858740 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50888906 COc1ccc(C2C(C#N)=C(NC(=O)CN3CCOCC3)Oc3c2c(=O)oc2ccccc32)c(OC)c1 InChI=1S/C27H25N3O7/c1-33-16-7-8-17(21(13-16)34-2)23-19(14-28)26(29-22(31)15-30-9-11-35-12-10-30)37-25-18-5-3-4-6-20(18)36-27(32)24(23)25/h3-8,13,23H,9-12,15H2,1-2H3,(H,29,31) QFSMQUYPCTZUKZ-UHFFFAOYSA-N 50268041 CHEMBL4086849 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2017.05.043 10.7270/Q25Q4ZK4 28587871 Sameem, B; Saeedi, M; Mahdavi, M; Nadri, H; Moghadam, FH; Edraki, N; Khan, MI; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268041 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268041&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137645051 404858741 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50888907 COc1ccc(cc1OC)C1C(C#N)=C(NC(=O)CN2CCOCC2)Oc2c1c(=O)oc1ccccc21 InChI=1S/C27H25N3O7/c1-33-20-8-7-16(13-21(20)34-2)23-18(14-28)26(29-22(31)15-30-9-11-35-12-10-30)37-25-17-5-3-4-6-19(17)36-27(32)24(23)25/h3-8,13,23H,9-12,15H2,1-2H3,(H,29,31) MINUFWNLVILRDS-UHFFFAOYSA-N 50268043 CHEMBL4067112 Cholinesterase 34200 ChEMBL 10.1016/j.bmc.2017.05.043 10.7270/Q25Q4ZK4 28587871 Sameem, B; Saeedi, M; Mahdavi, M; Nadri, H; Moghadam, FH; Edraki, N; Khan, MI; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268043 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268043&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 132576266 404858742 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50888908 Fc1ccc(cc1)C1C(C#N)=C(NC(=O)CN2CCOCC2)Oc2c1c(=O)oc1ccccc21 InChI=1S/C25H20FN3O5/c26-16-7-5-15(6-8-16)21-18(13-27)24(28-20(30)14-29-9-11-32-12-10-29)34-23-17-3-1-2-4-19(17)33-25(31)22(21)23/h1-8,21H,9-12,14H2,(H,28,30) QNPZOGDLOBRPCA-UHFFFAOYSA-N 50268044 CHEMBL4094574 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2017.05.043 10.7270/Q25Q4ZK4 28587871 Sameem, B; Saeedi, M; Mahdavi, M; Nadri, H; Moghadam, FH; Edraki, N; Khan, MI; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268044 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268044&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137654294 404858743 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50888909 Clc1ccc(cc1)C1C(C#N)=C(NC(=O)CN2CCOCC2)Oc2c1c(=O)oc1ccccc21 InChI=1S/C25H20ClN3O5/c26-16-7-5-15(6-8-16)21-18(13-27)24(28-20(30)14-29-9-11-32-12-10-29)34-23-17-3-1-2-4-19(17)33-25(31)22(21)23/h1-8,21H,9-12,14H2,(H,28,30) HVNCCCDHMTYUJZ-UHFFFAOYSA-N 50268045 CHEMBL4078051 Cholinesterase 91500 ChEMBL 10.1016/j.bmc.2017.05.043 10.7270/Q25Q4ZK4 28587871 Sameem, B; Saeedi, M; Mahdavi, M; Nadri, H; Moghadam, FH; Edraki, N; Khan, MI; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268045 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268045&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137650765 404858744 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50888918 [O-][N+](=O)c1ccc(cc1)C1C(C#N)=C(NC(=O)CN2CCOCC2)Oc2c1c(=O)oc1ccccc21 InChI=1S/C25H20N4O7/c26-13-18-21(15-5-7-16(8-6-15)29(32)33)22-23(17-3-1-2-4-19(17)35-25(22)31)36-24(18)27-20(30)14-28-9-11-34-12-10-28/h1-8,21H,9-12,14H2,(H,27,30) RPTOUDSBENUUTF-UHFFFAOYSA-N 50268046 CHEMBL4102317 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2017.05.043 10.7270/Q25Q4ZK4 28587871 Sameem, B; Saeedi, M; Mahdavi, M; Nadri, H; Moghadam, FH; Edraki, N; Khan, MI; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268046 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268046&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137660118 404858745 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50888919 O=C(CN1CCOCC1)NC1=C(C#N)C(c2cccs2)c2c(O1)c1ccccc1oc2=O InChI=1S/C23H19N3O5S/c24-12-15-19(17-6-3-11-32-17)20-21(14-4-1-2-5-16(14)30-23(20)28)31-22(15)25-18(27)13-26-7-9-29-10-8-26/h1-6,11,19H,7-10,13H2,(H,25,27) WWGFILOKASAIFP-UHFFFAOYSA-N 50268047 CHEMBL4076497 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2017.05.043 10.7270/Q25Q4ZK4 28587871 Sameem, B; Saeedi, M; Mahdavi, M; Nadri, H; Moghadam, FH; Edraki, N; Khan, MI; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50268047 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50268047&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137650920 404858746 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50888920 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 8730 ChEMBL 10.1016/j.bmc.2017.05.043 10.7270/Q25Q4ZK4 28587871 Sameem, B; Saeedi, M; Mahdavi, M; Nadri, H; Moghadam, FH; Edraki, N; Khan, MI; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50888806 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OC InChI=1S/C20H18NO4/c1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2/h3-4,7-10H,5-6,11H2,1-2H3/q+1 YBHILYKTIRIUTE-UHFFFAOYSA-N 50203126 3,4-dimethoxy-6,7-dihydro-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinolin-5-ylium::9,10-Dimethoxy-5,6-dihydro-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ylium::9,10-Dimethoxy-5,6-dihydro-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ylium chloride::9,10-dimethoxy-5,6-dihydro-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ylium; chloride::BERBERINE::Berberinechloride::CHEMBL12089::berberine dimer::cid_12456 Cholinesterase 9400 ChEMBL 10.1016/j.bmc.2017.05.033 10.7270/Q2K076RW 28576634 Seong, SH; Ali, MY; Kim, HR; Jung, HA; Choi, JS Pukyong National University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50203126 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50203126&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search BER 7A3Y,1JUM,6JWD,3R6R,3VW2,4DBK,3BTI,7MSV,7X8M,3NP6,3D6Y,7X32,5Y0V,2QVD,7C34,7N7D,7N7E 12456 104082463 16118 CHEMBL12089 DB04115 C00757 ZINC03779067 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50888815 CC(C)=CCC\C(=C\CC\C(C)=C\CC\C(C)=C\CC1=CC(=O)C=C(C)C1=O)C(O)=O InChI=1S/C27H36O4/c1-19(2)9-6-13-23(27(30)31)14-8-12-20(3)10-7-11-21(4)15-16-24-18-25(28)17-22(5)26(24)29/h9-10,14-15,17-18H,6-8,11-13,16H2,1-5H3,(H,30,31)/b20-10+,21-15+,23-14- IKUIJYZNRMQNBM-FWXQPYBBSA-N 50267967 CHEMBL4064412 Cholinesterase 10500 ChEMBL 10.1016/j.bmc.2017.05.033 10.7270/Q2K076RW 28576634 Seong, SH; Ali, MY; Kim, HR; Jung, HA; Choi, JS Pukyong National University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50267967 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50267967&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 9802458 404858701 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50888816 CC(C)=CCC\C(=C\CC\C(C)=C\CCC1(C)Oc2c(C)cc(O)cc2C=C1)C(O)=O InChI=1S/C27H36O4/c1-19(2)9-6-12-22(26(29)30)13-7-10-20(3)11-8-15-27(5)16-14-23-18-24(28)17-21(4)25(23)31-27/h9,11,13-14,16-18,28H,6-8,10,12,15H2,1-5H3,(H,29,30)/b20-11+,22-13- QKXAGRZCXAYBQX-WDZAAMDOSA-N 50267968 CHEMBL4085945 Cholinesterase 9400 ChEMBL 10.1016/j.bmc.2017.05.033 10.7270/Q2K076RW 28576634 Seong, SH; Ali, MY; Kim, HR; Jung, HA; Choi, JS Pukyong National University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50267968 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50267968&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10455044 404858702 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50888817 CC(C)=CCC\C(=C\CC\C(C)=C\CC\C(C)=C\Cc1cc(O)cc(C)c1O)C(O)=O InChI=1S/C27H38O4/c1-19(2)9-6-13-23(27(30)31)14-8-12-20(3)10-7-11-21(4)15-16-24-18-25(28)17-22(5)26(24)29/h9-10,14-15,17-18,28-29H,6-8,11-13,16H2,1-5H3,(H,30,31)/b20-10+,21-15+,23-14- ASCPFLQSHKBTRD-FWXQPYBBSA-N 50267969 Sargahydroquinoic Acid Cholinesterase 15200 ChEMBL 10.1016/j.bmc.2017.05.033 10.7270/Q2K076RW 28576634 Seong, SH; Ali, MY; Kim, HR; Jung, HA; Choi, JS Pukyong National University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50267969 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50267969&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10202734 404858703 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50888821 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 29 ChEMBL 10.1016/j.bmc.2017.05.045 10.7270/Q2F76G21 28578994 Shchegol'kov, EV; Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Rudakova, EV; Kovaleva, NV; Burgart, YV; Saloutin, VI; Chupakhin, ON; Bachurin, SO; Richardson, RJ Urals Branch of Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50853017 CN1c2ccccc2C(c2ccccc2)c2ccccc12 InChI=1S/C20H17N/c1-21-18-13-7-5-11-16(18)20(15-9-3-2-4-10-15)17-12-6-8-14-19(17)21/h2-14,20H,1H3 IMVRUPICRVHSAZ-UHFFFAOYSA-N 50262641 CHEMBL4105026 Cholinesterase 62100 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262641 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262641&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 6426032 404341220 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50853041 CN1c2ccccc2C(c2ccc(C)cc2)c2ccccc12 InChI=1S/C21H19N/c1-15-11-13-16(14-12-15)21-17-7-3-5-9-19(17)22(2)20-10-6-4-8-18(20)21/h3-14,21H,1-2H3 SBPKHSAWRYYBHO-UHFFFAOYSA-N 50262642 CHEMBL4080800 Cholinesterase >20000 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262642 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262642&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71088584 404341221 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50853286 CN1c2ccccc2C(c2ccc(NC(=O)C(F)(F)F)cc2)c2ccccc12 InChI=1S/C22H17F3N2O/c1-27-18-8-4-2-6-16(18)20(17-7-3-5-9-19(17)27)14-10-12-15(13-11-14)26-21(28)22(23,24)25/h2-13,20H,1H3,(H,26,28) QDKKUFDAVYHWRB-UHFFFAOYSA-N 50262644 CHEMBL4103528 Cholinesterase >20000 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262644 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262644&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137656757 404341222 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50853570 CN1c2ccccc2C(c2ccc(NC(C)=O)cc2)c2ccccc12 InChI=1S/C22H20N2O/c1-15(25)23-17-13-11-16(12-14-17)22-18-7-3-5-9-20(18)24(2)21-10-6-4-8-19(21)22/h3-14,22H,1-2H3,(H,23,25) QNPLCZYEKVNAJE-UHFFFAOYSA-N 50262645 CHEMBL4087149 Cholinesterase >20000 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262645 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262645&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137642931 404341223 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50853576 COc1ccc(cc1)C1c2ccccc2N(C)c2ccccc12 InChI=1S/C21H19NO/c1-22-19-9-5-3-7-17(19)21(18-8-4-6-10-20(18)22)15-11-13-16(23-2)14-12-15/h3-14,21H,1-2H3 QNQDKAUOHMKICR-UHFFFAOYSA-N 50262646 CHEMBL4094837 Cholinesterase >20000 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262646 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262646&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11722402 404341224 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50853581 CN1c2ccccc2C(c2ccccc12)c1cc(cc(c1O)C(C)(C)C)C(C)(C)C InChI=1S/C28H33NO/c1-27(2,3)18-16-21(26(30)22(17-18)28(4,5)6)25-19-12-8-10-14-23(19)29(7)24-15-11-9-13-20(24)25/h8-17,25,30H,1-7H3 MRWMVUOHYHDANS-UHFFFAOYSA-N 50262647 CHEMBL4077493 Cholinesterase >20000 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262647 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262647&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137648880 404341225 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50853596 CN1c2ccccc2C(c2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)c2ccccc12 InChI=1S/C28H33NO/c1-27(2,3)21-16-18(17-22(26(21)30)28(4,5)6)25-19-12-8-10-14-23(19)29(7)24-15-11-9-13-20(24)25/h8-17,25,30H,1-7H3 NCNTVCZPSNSHHQ-UHFFFAOYSA-N 50262648 CHEMBL4102576 Cholinesterase >20000 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262648 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262648&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137658354 404341226 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50853602 F[B-](F)(F)F.C[n+]1c2ccccc2c(-c2ccccc2)c2ccccc12 InChI=1S/C20H16N/c1-21-18-13-7-5-11-16(18)20(15-9-3-2-4-10-15)17-12-6-8-14-19(17)21/h2-14H,1H3/q+1 OPOTWUHKVSPPBY-UHFFFAOYSA-N 50262649 CHEMBL4090498 Cholinesterase 51900 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262649 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262649&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137644242 404341227 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50853608 F[B-](F)(F)F.Cc1ccc(cc1)-c1c2ccccc2[n+](C)c2ccccc12 InChI=1S/C21H18N/c1-15-11-13-16(14-12-15)21-17-7-3-5-9-19(17)22(2)20-10-6-4-8-18(20)21/h3-14H,1-2H3/q+1 RWQVIQMXRRUCCE-UHFFFAOYSA-N 50262650 CHEMBL4069472 Cholinesterase 40700 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262650 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262650&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137632181 404341228 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50853619 F[B-](F)(F)F.CCN(CC)c1ccc(cc1)-c1c2ccccc2[n+](C)c2ccccc12 InChI=1S/C24H25N2/c1-4-26(5-2)19-16-14-18(15-17-19)24-20-10-6-8-12-22(20)25(3)23-13-9-7-11-21(23)24/h6-17H,4-5H2,1-3H3/q+1 OWUVUIASZIGUEV-UHFFFAOYSA-N 50262651 CHEMBL4080726 Cholinesterase 3350 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262651 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262651&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137648072 404341229 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50853630 F[B-](F)(F)F.C[n+]1c2ccccc2c(-c2ccc(NC(=O)C(F)(F)F)cc2)c2ccccc12 InChI=1S/C22H15F3N2O/c1-27-18-8-4-2-6-16(18)20(17-7-3-5-9-19(17)27)14-10-12-15(13-11-14)26-21(28)22(23,24)25/h2-13H,1H3/p+1 AQTDZXALVBVVNC-UHFFFAOYSA-O 50262652 CHEMBL4097249 Cholinesterase >20000 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262652 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262652&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137661080 404341230 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50853731 F[B-](F)(F)F.CC(=O)Nc1ccc(cc1)-c1c2ccccc2[n+](C)c2ccccc12 InChI=1S/C22H18N2O/c1-15(25)23-17-13-11-16(12-14-17)22-18-7-3-5-9-20(18)24(2)21-10-6-4-8-19(21)22/h3-14H,1-2H3/p+1 YIDICKUIIZOUSI-UHFFFAOYSA-O 50262654 CHEMBL4070057 Cholinesterase 35100 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262654 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262654&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137639386 404341231 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50853971 F[B-](F)(F)F.COc1ccc(cc1)-c1c2ccccc2[n+](C)c2ccccc12 InChI=1S/C21H18NO/c1-22-19-9-5-3-7-17(19)21(18-8-4-6-10-20(18)22)15-11-13-16(23-2)14-12-15/h3-14H,1-2H3/q+1 KARJHRGDHQUFBR-UHFFFAOYSA-N 50262655 CHEMBL4096311 Cholinesterase 58500 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262655 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262655&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137655308 404341232 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50854003 F[B-](F)(F)F.Cc1cc(cc(C)c1O)-c1c2ccccc2[n+](C)c2ccccc12 InChI=1S/C22H19NO/c1-14-12-16(13-15(2)22(14)24)21-17-8-4-6-10-19(17)23(3)20-11-7-5-9-18(20)21/h4-13H,1-3H3/p+1 NGGGILOQXONNJE-UHFFFAOYSA-O 50262657 CHEMBL4088594 Cholinesterase 61800 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262657 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262657&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137641841 404341234 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50854007 F[B-](F)(F)F.C[n+]1c2ccccc2c(-c2c(O)ccc3ccccc23)c2ccccc12 InChI=1S/C24H17NO/c1-25-20-12-6-4-10-18(20)23(19-11-5-7-13-21(19)25)24-17-9-3-2-8-16(17)14-15-22(24)26/h2-15H,1H3/p+1 LDKLXUQDCYQFAU-UHFFFAOYSA-O 50262658 CHEMBL4091935 Cholinesterase 50800 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262658 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262658&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137655797 404341235 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50854013 F[B-](F)(F)F.C[n+]1c2ccccc2c(-c2cccs2)c2ccccc12 InChI=1S/C18H14NS/c1-19-15-9-4-2-7-13(15)18(17-11-6-12-20-17)14-8-3-5-10-16(14)19/h2-12H,1H3/q+1 XTVPLWCXUPTVOE-UHFFFAOYSA-N 50262659 CHEMBL4070092 Cholinesterase 58300 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262659 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262659&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137640392 404341236 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50854606 CN1c2ccccc2C(c2ccccc12)n1cnc(n1)[N+]([O-])=O InChI=1S/C16H13N5O2/c1-19-13-8-4-2-6-11(13)15(12-7-3-5-9-14(12)19)20-10-17-16(18-20)21(22)23/h2-10,15H,1H3 BXCCXTDSMCMRCX-UHFFFAOYSA-N 50262662 CHEMBL4075624 Cholinesterase 1170 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262662 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262662&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137649250 404341239 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50854615 CN1c2ccccc2C(c2ccccc12)n1c2ccccc2c2ccccc12 InChI=1S/C26H20N2/c1-27-22-14-6-4-12-20(22)26(21-13-5-7-15-23(21)27)28-24-16-8-2-10-18(24)19-11-3-9-17-25(19)28/h2-17,26H,1H3 RRXQZNGWSYEMOQ-UHFFFAOYSA-N 50262638 CHEMBL4074993 Cholinesterase 13000 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262638 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262638&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137652028 404341218 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50854616 F[B-](F)(F)F.C[n+]1c2ccccc2c(N)c2ccccc12 InChI=1S/C14H12N2/c1-16-12-8-4-2-6-10(12)14(15)11-7-3-5-9-13(11)16/h2-9,15H,1H3/p+1 SQFZLHHJWJODCA-UHFFFAOYSA-O 50262640 CHEMBL4063635 Cholinesterase 4830 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262640 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262640&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137635324 404341219 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50854617 F[B-](F)(F)F.CCCCNc1c2ccccc2[n+](C)c2ccccc12 InChI=1S/C18H20N2/c1-3-4-13-19-18-14-9-5-7-11-16(14)20(2)17-12-8-6-10-15(17)18/h5-12H,3-4,13H2,1-2H3/p+1 PFIPALFVGFKXBT-UHFFFAOYSA-O 50262636 CHEMBL4083288 Cholinesterase 15700 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262636 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262636&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137647944 404341216 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50856205 CN1c2ccccc2C(c2ccccc12)n1cncn1 InChI=1S/C16H14N4/c1-19-14-8-4-2-6-12(14)16(20-11-17-10-18-20)13-7-3-5-9-15(13)19/h2-11,16H,1H3 HAFYMZVHLNXUIY-UHFFFAOYSA-N 50262661 CHEMBL4075825 Cholinesterase 160 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262661 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262661&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137650681 404341238 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50856206 CN1c2ccccc2C(c2ccccc12)n1nnc2ccccc12 InChI=1S/C20H16N4/c1-23-17-11-5-2-8-14(17)20(15-9-3-6-12-18(15)23)24-19-13-7-4-10-16(19)21-22-24/h2-13,20H,1H3 FMPYUZLCKYTCDZ-UHFFFAOYSA-N 50262637 CHEMBL4088659 Cholinesterase 490 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262637 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262637&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3537759 404341217 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50856212 F[B-](F)(F)F.C[n+]1c2ccccc2c(-c2cc(cc(c2O)C(C)(C)C)C(C)(C)C)c2ccccc12 InChI=1S/C28H31NO/c1-27(2,3)18-16-21(26(30)22(17-18)28(4,5)6)25-19-12-8-10-14-23(19)29(7)24-15-11-9-13-20(24)25/h8-17H,1-7H3/p+1 ROKAIEKBNXEGKC-UHFFFAOYSA-O 50262656 CHEMBL4067342 Cholinesterase 1460 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262656 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262656&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137631375 404341233 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50856213 CN1c2ccccc2C(N2CCOCC2)c2ccccc12 InChI=1S/C18H20N2O/c1-19-16-8-4-2-6-14(16)18(20-10-12-21-13-11-20)15-7-3-5-9-17(15)19/h2-9,18H,10-13H2,1H3 LYLYGAKMNMVFHZ-UHFFFAOYSA-N 50262687 CHEMBL4077169 Cholinesterase 410 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262687 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262687&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137649760 404341242 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50856221 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 29 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50856222 CN1c2ccccc2C(c2ccc(N)cc2)c2ccccc12 InChI=1S/C20H18N2/c1-22-18-8-4-2-6-16(18)20(14-10-12-15(21)13-11-14)17-7-3-5-9-19(17)22/h2-13,20H,21H2,1H3 HRFREJJYMLQHQG-UHFFFAOYSA-N 50262689 CHEMBL4079266 Cholinesterase 66500 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262689 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262689&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12228254 404341244 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50856223 CN1c2ccccc2C(c2ccc(F)cc2)c2ccccc12 InChI=1S/C20H16FN/c1-22-18-8-4-2-6-16(18)20(14-10-12-15(21)13-11-14)17-7-3-5-9-19(17)22/h2-13,20H,1H3 YVMXRJYSWRYGNP-UHFFFAOYSA-N 50262690 CHEMBL4065729 Cholinesterase >20000 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262690 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262690&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137633553 404341245 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50856224 CN1c2ccccc2C(c2cccs2)c2ccccc12 InChI=1S/C18H15NS/c1-19-15-9-4-2-7-13(15)18(17-11-6-12-20-17)14-8-3-5-10-16(14)19/h2-12,18H,1H3 DCIWOUKJJWDQJN-UHFFFAOYSA-N 50262691 CHEMBL4084629 Cholinesterase >20000 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262691 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262691&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137645190 404341246 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50856226 F[B-](F)(F)F.C[n+]1c2ccccc2c(-c2ccc(F)cc2)c2ccccc12 InChI=1S/C20H15FN/c1-22-18-8-4-2-6-16(18)20(14-10-12-15(21)13-11-14)17-7-3-5-9-19(17)22/h2-13H,1H3/q+1 MWHZLLGCEMKFTD-UHFFFAOYSA-N 50262686 CHEMBL4078265 Cholinesterase >20000 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262686 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262686&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137651930 404341241 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50856227 F[B-](F)(F)F.Cc1cc(cc(C)c1C)-c1c2ccccc2[n+](C)c2ccccc12 InChI=1S/C23H22N/c1-15-13-18(14-16(2)17(15)3)23-19-9-5-7-11-21(19)24(4)22-12-8-6-10-20(22)23/h5-14H,1-4H3/q+1 AZHUBFUGJZMQBS-UHFFFAOYSA-N 50262688 CHEMBL4071110 Cholinesterase >20000 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262688 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262688&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137640096 404341243 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50856360 F[B-](F)(F)F.C[n+]1c2ccccc2c(-c2ccc(N)cc2)c2ccccc12 InChI=1S/C20H16N2/c1-22-18-8-4-2-6-16(18)20(14-10-12-15(21)13-11-14)17-7-3-5-9-19(17)22/h2-13,21H,1H3/p+1 YFDBYNORSYBXHW-UHFFFAOYSA-O 50262666 CHEMBL4104952 Cholinesterase 19000 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262666 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262666&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137657249 404341240 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50856361 CN1c2ccccc2C(N2CCSCC2)c2ccccc12 InChI=1S/C18H20N2S/c1-19-16-8-4-2-6-14(16)18(20-10-12-21-13-11-20)15-7-3-5-9-17(15)19/h2-9,18H,10-13H2,1H3 GYHIIYHXQOHZPU-UHFFFAOYSA-N 50262660 CHEMBL4065259 Cholinesterase 350 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262660 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262660&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137631650 404341237 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50857075 CN(CCN1C(=O)c2ccccc2C1=O)Cc1ccccc1 InChI=1S/C18H18N2O2/c1-19(13-14-7-3-2-4-8-14)11-12-20-17(21)15-9-5-6-10-16(15)18(20)22/h2-10H,11-13H2,1H3 UUNTYTISUDJKHC-UHFFFAOYSA-N 50262810 CHEMBL4066289 Cholinesterase 22500 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262810 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262810&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 20404853 404341284 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50857082 CCN(CCN1C(=O)c2ccccc2C1=O)Cc1ccccc1OC InChI=1S/C20H22N2O3/c1-3-21(14-15-8-4-7-11-18(15)25-2)12-13-22-19(23)16-9-5-6-10-17(16)20(22)24/h4-11H,3,12-14H2,1-2H3 MFXSMZQWVUTKNQ-UHFFFAOYSA-N 50262811 CHEMBL4066677 Cholinesterase 18300 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262811 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262811&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137633956 404341285 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50857083 CCN(CCCN1C(=O)c2ccccc2C1=O)Cc1ccccc1 InChI=1S/C20H22N2O2/c1-2-21(15-16-9-4-3-5-10-16)13-8-14-22-19(23)17-11-6-7-12-18(17)20(22)24/h3-7,9-12H,2,8,13-15H2,1H3 XXSXUFUJLDNHEC-UHFFFAOYSA-N 50262812 CHEMBL4104552 Cholinesterase 9300 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262812 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262812&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 23857375 404341286 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50857084 CN(CCCN1C(=O)c2ccccc2C1=O)Cc1ccccc1 InChI=1S/C19H20N2O2/c1-20(14-15-8-3-2-4-9-15)12-7-13-21-18(22)16-10-5-6-11-17(16)19(21)23/h2-6,8-11H,7,12-14H2,1H3 AHNQNSXUUYLQKR-UHFFFAOYSA-N 50262813 CHEMBL4094393 Cholinesterase 22900 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262813 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262813&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 23857007 404341287 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50857085 CCN(CCCN1C(=O)c2ccccc2C1=O)Cc1ccccc1OC InChI=1S/C21H24N2O3/c1-3-22(15-16-9-4-7-12-19(16)26-2)13-8-14-23-20(24)17-10-5-6-11-18(17)21(23)25/h4-7,9-12H,3,8,13-15H2,1-2H3 SFMBSJPYTWPKHS-UHFFFAOYSA-N 50262814 CHEMBL4066908 Cholinesterase 11300 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262814 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262814&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137633782 404341288 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50857086 O=C1N(CCCN(CC#C)Cc2ccccc2)C(=O)c2ccccc12 InChI=1S/C21H20N2O2/c1-2-13-22(16-17-9-4-3-5-10-17)14-8-15-23-20(24)18-11-6-7-12-19(18)21(23)25/h1,3-7,9-12H,8,13-16H2 SCUZHSPGCIXUKX-UHFFFAOYSA-N 50262845 CHEMBL4075667 Cholinesterase 2500 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262845 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262845&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137650881 404341289 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50857089 COc1ccccc1CN(CCCN1C(=O)c2ccccc2C1=O)CC#C InChI=1S/C22H22N2O3/c1-3-13-23(16-17-9-4-7-12-20(17)27-2)14-8-15-24-21(25)18-10-5-6-11-19(18)22(24)26/h1,4-7,9-12H,8,13-16H2,2H3 NKQRLCDALRZSDY-UHFFFAOYSA-N 50262846 CHEMBL4064598 Cholinesterase 5800 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262846 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262846&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137634675 404341290 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50857090 CC(C)N1CCN(CCCN2C(=O)c3ccccc3C2=O)CC1 InChI=1S/C18H25N3O2/c1-14(2)20-12-10-19(11-13-20)8-5-9-21-17(22)15-6-3-4-7-16(15)18(21)23/h3-4,6-7,14H,5,8-13H2,1-2H3 QFRXYVHBUZCNBB-UHFFFAOYSA-N 50262847 CHEMBL4086843 Cholinesterase 34900 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262847 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262847&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 20252235 404341291 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50857093 CN(CCCCN1C(=O)c2ccccc2C1=O)Cc1ccccc1 InChI=1S/C20H22N2O2/c1-21(15-16-9-3-2-4-10-16)13-7-8-14-22-19(23)17-11-5-6-12-18(17)20(22)24/h2-6,9-12H,7-8,13-15H2,1H3 OKFVAOMPCAHXHX-UHFFFAOYSA-N 50193452 CHEMBL3547159 Cholinesterase 14500 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50193452 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50193452&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14985618 375076267 CHEMBL3547159 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50857094 CCN(CCCCN1C(=O)c2ccccc2C1=O)Cc1ccccc1OC InChI=1S/C22H26N2O3/c1-3-23(16-17-10-4-7-13-20(17)27-2)14-8-9-15-24-21(25)18-11-5-6-12-19(18)22(24)26/h4-7,10-13H,3,8-9,14-16H2,1-2H3 ALODLRYLTVWWDS-UHFFFAOYSA-N 50262848 CHEMBL4069776 Cholinesterase 31000 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262848 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262848&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137639047 404341292 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50857095 O=C1N(CCCCN(CC#C)Cc2ccccc2)C(=O)c2ccccc12 InChI=1S/C22H22N2O2/c1-2-14-23(17-18-10-4-3-5-11-18)15-8-9-16-24-21(25)19-12-6-7-13-20(19)22(24)26/h1,3-7,10-13H,8-9,14-17H2 KEHGZSHXRQPECM-UHFFFAOYSA-N 50262849 CHEMBL4061108 Cholinesterase 12700 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262849 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262849&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137637036 404341293 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50857096 COc1ccccc1CN(CCCCN1C(=O)c2ccccc2C1=O)CC#C InChI=1S/C23H24N2O3/c1-3-14-24(17-18-10-4-7-13-21(18)28-2)15-8-9-16-25-22(26)19-11-5-6-12-20(19)23(25)27/h1,4-7,10-13H,8-9,14-17H2,2H3 QJIZLEFWPKILNV-UHFFFAOYSA-N 50262850 CHEMBL4089274 Cholinesterase 8300 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262850 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262850&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137645001 404341294 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50857097 CC(C)N1CCN(CCCCN2C(=O)c3ccccc3C2=O)CC1 InChI=1S/C19H27N3O2/c1-15(2)21-13-11-20(12-14-21)9-5-6-10-22-18(23)16-7-3-4-8-17(16)19(22)24/h3-4,7-8,15H,5-6,9-14H2,1-2H3 WPATZGLBVSBHBW-UHFFFAOYSA-N 50262851 CHEMBL4085625 Cholinesterase 23400 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262851 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262851&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137646140 404341295 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50857098 COc1ccccc1CN(CCCCCN1C(=O)c2ccccc2C1=O)CC#C InChI=1S/C24H26N2O3/c1-3-15-25(18-19-11-5-8-14-22(19)29-2)16-9-4-10-17-26-23(27)20-12-6-7-13-21(20)24(26)28/h1,5-8,11-14H,4,9-10,15-18H2,2H3 ONLWPFYSGUGFBW-UHFFFAOYSA-N 50262852 CHEMBL4104698 Cholinesterase 26300 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262852 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262852&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137657652 404341296 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50857099 CC(C)N1CCN(CCCCCN2C(=O)c3ccccc3C2=O)CC1 InChI=1S/C20H29N3O2/c1-16(2)22-14-12-21(13-15-22)10-6-3-7-11-23-19(24)17-8-4-5-9-18(17)20(23)25/h4-5,8-9,16H,3,6-7,10-15H2,1-2H3 QQULVMVNYNDHOX-UHFFFAOYSA-N 50262853 CHEMBL4080466 Cholinesterase 34500 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262853 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262853&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137648289 404341297 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50857100 CCN(CCCCCCN1C(=O)c2ccccc2C1=O)Cc1ccccc1 InChI=1S/C23H28N2O2/c1-2-24(18-19-12-6-5-7-13-19)16-10-3-4-11-17-25-22(26)20-14-8-9-15-21(20)23(25)27/h5-9,12-15H,2-4,10-11,16-18H2,1H3 NPQZWFHXMBANFC-UHFFFAOYSA-N 50262773 CHEMBL4096963 Cholinesterase 11000 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262773 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262773&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137660365 404341278 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50857101 CCN(CCCCCCN1C(=O)c2ccccc2C1=O)Cc1ccccc1OC InChI=1S/C24H30N2O3/c1-3-25(18-19-12-6-9-15-22(19)29-2)16-10-4-5-11-17-26-23(27)20-13-7-8-14-21(20)24(26)28/h6-9,12-15H,3-5,10-11,16-18H2,1-2H3 BUFPKICHFJPEEE-UHFFFAOYSA-N 50262786 CHEMBL4089264 Cholinesterase 7300 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262786 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262786&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137644997 404341281 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50857102 COc1ccccc1CN(C)CCCCCCN1C(=O)c2ccccc2C1=O InChI=1S/C23H28N2O3/c1-24(17-18-11-5-8-14-21(18)28-2)15-9-3-4-10-16-25-22(26)19-12-6-7-13-20(19)23(25)27/h5-8,11-14H,3-4,9-10,15-17H2,1-2H3 LCQLNLWLIHDCNV-UHFFFAOYSA-N 50262774 CHEMBL4061100 Cholinesterase 30600 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262774 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262774&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137636817 404341279 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50857209 COc1ccccc1CN(CCCCCCN1C(=O)c2ccccc2C1=O)CC#C InChI=1S/C25H28N2O3/c1-3-16-26(19-20-12-6-9-15-23(20)30-2)17-10-4-5-11-18-27-24(28)21-13-7-8-14-22(21)25(27)29/h1,6-9,12-15H,4-5,10-11,16-19H2,2H3 GMPXJPMQFKKXPY-UHFFFAOYSA-N 50262808 CHEMBL4099414 Cholinesterase 13400 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262808 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262808&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137661642 404341282 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50858321 CC(C)N1CCN(CCCCCCN2C(=O)c3ccccc3C2=O)CC1 InChI=1S/C21H31N3O2/c1-17(2)23-15-13-22(14-16-23)11-7-3-4-8-12-24-20(25)18-9-5-6-10-19(18)21(24)26/h5-6,9-10,17H,3-4,7-8,11-16H2,1-2H3 WTZULMKHLHWUOS-UHFFFAOYSA-N 50262809 CHEMBL4070797 Cholinesterase 19400 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262809 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262809&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137638049 404341283 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50858322 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 4760 ChEMBL 10.1016/j.bmcl.2017.09.055 10.7270/Q22J6F9F 29033232 Sang, Z; Wang, K; Wang, H; Yu, L; Wang, H; Ma, Q; Ye, M; Han, X; Liu, W Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50825508 O=c1ccc2ccc(OCc3ccccc3)cc2o1 InChI=1S/C16H12O3/c17-16-9-7-13-6-8-14(10-15(13)19-16)18-11-12-4-2-1-3-5-12/h1-10H,11H2 QDLFCBKKECTJSK-UHFFFAOYSA-N 50378564 CHEMBL145781 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2016.09.041 10.7270/Q2BP057T 27744252 Joubert, J; Foka, GB; Repsold, BP; Oliver, DW; Kapp, E; Malan, SF University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50378564 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50378564&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 910172 160857647 CHEMBL145781 ZINC00493069 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50825625 Cc1c(Cl)c(=O)oc2cc(OCc3ccccc3)ccc12 InChI=1S/C17H13ClO3/c1-11-14-8-7-13(9-15(14)21-17(19)16(11)18)20-10-12-5-3-2-4-6-12/h2-9H,10H2,1H3 FLISBXSFDOEMCC-UHFFFAOYSA-N 50259629 CHEMBL4094745 Cholinesterase 960 ChEMBL 10.1016/j.ejmech.2016.09.041 10.7270/Q2BP057T 27744252 Joubert, J; Foka, GB; Repsold, BP; Oliver, DW; Kapp, E; Malan, SF University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259629 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259629&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 23996002 404339610 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50825626 Cc1c(C#N)c(=O)oc2cc(OCc3ccccc3)ccc12 InChI=1S/C18H13NO3/c1-12-15-8-7-14(21-11-13-5-3-2-4-6-13)9-17(15)22-18(20)16(12)10-19/h2-9H,11H2,1H3 ZHMXKSBYYQERTH-UHFFFAOYSA-N 50259593 CHEMBL4095676 Cholinesterase 21800 ChEMBL 10.1016/j.ejmech.2016.09.041 10.7270/Q2BP057T 27744252 Joubert, J; Foka, GB; Repsold, BP; Oliver, DW; Kapp, E; Malan, SF University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259593 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259593&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 22011729 404339594 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50825627 Cc1cc(=O)oc2cc(OCc3ccc(Br)cc3)ccc12 InChI=1S/C17H13BrO3/c1-11-8-17(19)21-16-9-14(6-7-15(11)16)20-10-12-2-4-13(18)5-3-12/h2-9H,10H2,1H3 FVWAAOMTWGZPCD-UHFFFAOYSA-N 50259595 CHEMBL4097867 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2016.09.041 10.7270/Q2BP057T 27744252 Joubert, J; Foka, GB; Repsold, BP; Oliver, DW; Kapp, E; Malan, SF University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259595 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259595&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 886539 404339596 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50825628 Cc1c(Cl)c(=O)oc2cc(OCc3ccc(Br)cc3)ccc12 InChI=1S/C17H12BrClO3/c1-10-14-7-6-13(8-15(14)22-17(20)16(10)19)21-9-11-2-4-12(18)5-3-11/h2-8H,9H2,1H3 CFDZXXWQQBIBLA-UHFFFAOYSA-N 50259630 CHEMBL4079843 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2016.09.041 10.7270/Q2BP057T 27744252 Joubert, J; Foka, GB; Repsold, BP; Oliver, DW; Kapp, E; Malan, SF University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259630 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259630&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134816193 404339611 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50825629 Cc1c(C#N)c(=O)oc2cc(OCc3ccc(Br)cc3)ccc12 InChI=1S/C18H12BrNO3/c1-11-15-7-6-14(8-17(15)23-18(21)16(11)9-20)22-10-12-2-4-13(19)5-3-12/h2-8H,10H2,1H3 BIGMVPGNLCXHRW-UHFFFAOYSA-N 50259597 CHEMBL4105601 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2016.09.041 10.7270/Q2BP057T 27744252 Joubert, J; Foka, GB; Repsold, BP; Oliver, DW; Kapp, E; Malan, SF University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259597 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259597&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134816641 404339597 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50825630 Cc1c(C#N)c(=O)oc2cc(OCc3ccc(F)cc3)ccc12 InChI=1S/C18H12FNO3/c1-11-15-7-6-14(8-17(15)23-18(21)16(11)9-20)22-10-12-2-4-13(19)5-3-12/h2-8H,10H2,1H3 ZRFZWVIKCJMDRW-UHFFFAOYSA-N 50259631 CHEMBL4082300 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2016.09.041 10.7270/Q2BP057T 27744252 Joubert, J; Foka, GB; Repsold, BP; Oliver, DW; Kapp, E; Malan, SF University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259631 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259631&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137647190 404339612 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50825631 Cc1c(C#N)c(=O)oc2cc(OCc3ccc(Cl)cc3)ccc12 InChI=1S/C18H12ClNO3/c1-11-15-7-6-14(8-17(15)23-18(21)16(11)9-20)22-10-12-2-4-13(19)5-3-12/h2-8H,10H2,1H3 NPFLYKNCEWYOLO-UHFFFAOYSA-N 50259604 CHEMBL4060398 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2016.09.041 10.7270/Q2BP057T 27744252 Joubert, J; Foka, GB; Repsold, BP; Oliver, DW; Kapp, E; Malan, SF University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259604 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259604&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137636117 404339599 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50825632 Cc1c(C#N)c(=O)oc2cc(OCc3ccccc3Br)ccc12 InChI=1S/C18H12BrNO3/c1-11-14-7-6-13(8-17(14)23-18(21)15(11)9-20)22-10-12-4-2-3-5-16(12)19/h2-8H,10H2,1H3 UPYDTRMWIMLIRN-UHFFFAOYSA-N 50259605 CHEMBL4090150 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2016.09.041 10.7270/Q2BP057T 27744252 Joubert, J; Foka, GB; Repsold, BP; Oliver, DW; Kapp, E; Malan, SF University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259605 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259605&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137643291 404339600 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50825633 O=c1ccc2ccc(OCCN3CCC(Cc4ccccc4)CC3)cc2o1 InChI=1S/C23H25NO3/c25-23-9-7-20-6-8-21(17-22(20)27-23)26-15-14-24-12-10-19(11-13-24)16-18-4-2-1-3-5-18/h1-9,17,19H,10-16H2 XCOBFKVCBHODFF-UHFFFAOYSA-N 50259622 CHEMBL4078343 Cholinesterase 20300 ChEMBL 10.1016/j.ejmech.2016.09.041 10.7270/Q2BP057T 27744252 Joubert, J; Foka, GB; Repsold, BP; Oliver, DW; Kapp, E; Malan, SF University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259622 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259622&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134816595 404339603 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50825634 Cc1cc(=O)oc2cc(OCCN3CCC(Cc4ccccc4)CC3)ccc12 InChI=1S/C24H27NO3/c1-18-15-24(26)28-23-17-21(7-8-22(18)23)27-14-13-25-11-9-20(10-12-25)16-19-5-3-2-4-6-19/h2-8,15,17,20H,9-14,16H2,1H3 NPWWCJQCZNQRMS-UHFFFAOYSA-N 50259623 CHEMBL4096387 Cholinesterase 5190 ChEMBL 10.1016/j.ejmech.2016.09.041 10.7270/Q2BP057T 27744252 Joubert, J; Foka, GB; Repsold, BP; Oliver, DW; Kapp, E; Malan, SF University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259623 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259623&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134816331 404339604 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50825635 Cc1c(C#N)c(=O)oc2cc(OCCN3CCC(Cc4ccccc4)CC3)ccc12 InChI=1S/C25H26N2O3/c1-18-22-8-7-21(16-24(22)30-25(28)23(18)17-26)29-14-13-27-11-9-20(10-12-27)15-19-5-3-2-4-6-19/h2-8,16,20H,9-15H2,1H3 DGCLWMRVKTWYAS-UHFFFAOYSA-N 50259624 CHEMBL4088674 Cholinesterase 5900 ChEMBL 10.1016/j.ejmech.2016.09.041 10.7270/Q2BP057T 27744252 Joubert, J; Foka, GB; Repsold, BP; Oliver, DW; Kapp, E; Malan, SF University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259624 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259624&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134816271 404339605 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50825636 FC(F)(F)c1cc(=O)oc2cc(OCCN3CCC(Cc4ccccc4)CC3)ccc12 InChI=1S/C24H24F3NO3/c25-24(26,27)21-16-23(29)31-22-15-19(6-7-20(21)22)30-13-12-28-10-8-18(9-11-28)14-17-4-2-1-3-5-17/h1-7,15-16,18H,8-14H2 UPGSIJLGNUKGMV-UHFFFAOYSA-N 50259625 CHEMBL4093982 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2016.09.041 10.7270/Q2BP057T 27744252 Joubert, J; Foka, GB; Repsold, BP; Oliver, DW; Kapp, E; Malan, SF University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259625 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259625&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137656100 404339606 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50825637 Brc1ccc(CN2CCN(CCOc3ccc4ccc(=O)oc4c3)CC2)cc1 InChI=1S/C22H23BrN2O3/c23-19-5-1-17(2-6-19)16-25-11-9-24(10-12-25)13-14-27-20-7-3-18-4-8-22(26)28-21(18)15-20/h1-8,15H,9-14,16H2 ZZINRNYYMBDOTN-UHFFFAOYSA-N 50259634 CHEMBL4066437 Cholinesterase 50100 ChEMBL 10.1016/j.ejmech.2016.09.041 10.7270/Q2BP057T 27744252 Joubert, J; Foka, GB; Repsold, BP; Oliver, DW; Kapp, E; Malan, SF University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259634 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259634&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134816270 404339615 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50825638 Cc1c(Cl)c(=O)oc2cc(OCCN3CCN(Cc4ccc(Br)cc4)CC3)ccc12 InChI=1S/C23H24BrClN2O3/c1-16-20-7-6-19(14-21(20)30-23(28)22(16)25)29-13-12-26-8-10-27(11-9-26)15-17-2-4-18(24)5-3-17/h2-7,14H,8-13,15H2,1H3 ZBVSYQIELBIGLQ-UHFFFAOYSA-N 50259627 CHEMBL4104128 Cholinesterase 3120 ChEMBL 10.1016/j.ejmech.2016.09.041 10.7270/Q2BP057T 27744252 Joubert, J; Foka, GB; Repsold, BP; Oliver, DW; Kapp, E; Malan, SF University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259627 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259627&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134816640 404339608 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50825639 Cc1c(C#N)c(=O)oc2cc(OCCN3CCN(Cc4ccc(Br)cc4)CC3)ccc12 InChI=1S/C24H24BrN3O3/c1-17-21-7-6-20(14-23(21)31-24(29)22(17)15-26)30-13-12-27-8-10-28(11-9-27)16-18-2-4-19(25)5-3-18/h2-7,14H,8-13,16H2,1H3 UEOQGXDNVOABCE-UHFFFAOYSA-N 50259628 CHEMBL4089608 Cholinesterase 13300 ChEMBL 10.1016/j.ejmech.2016.09.041 10.7270/Q2BP057T 27744252 Joubert, J; Foka, GB; Repsold, BP; Oliver, DW; Kapp, E; Malan, SF University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259628 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259628&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134816692 404339609 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50825640 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 2870 ChEMBL 10.1016/j.ejmech.2016.09.041 10.7270/Q2BP057T 27744252 Joubert, J; Foka, GB; Repsold, BP; Oliver, DW; Kapp, E; Malan, SF University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50825641 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 17 ChEMBL 10.1016/j.ejmech.2016.09.041 10.7270/Q2BP057T 27744252 Joubert, J; Foka, GB; Repsold, BP; Oliver, DW; Kapp, E; Malan, SF University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50825650 Brc1ccc(COc2ccc3ccc(=O)oc3c2)cc1 InChI=1S/C16H11BrO3/c17-13-5-1-11(2-6-13)10-19-14-7-3-12-4-8-16(18)20-15(12)9-14/h1-9H,10H2 XBQHFKZKJXERFF-UHFFFAOYSA-N 50259594 CHEMBL4068321 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2016.09.041 10.7270/Q2BP057T 27744252 Joubert, J; Foka, GB; Repsold, BP; Oliver, DW; Kapp, E; Malan, SF University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259594 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259594&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 2629406 404339595 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50825651 FC(F)(F)c1cc(=O)oc2cc(OCc3ccc(Br)cc3)ccc12 InChI=1S/C17H10BrF3O3/c18-11-3-1-10(2-4-11)9-23-12-5-6-13-14(17(19,20)21)8-16(22)24-15(13)7-12/h1-8H,9H2 OYQVJRKBTAURET-UHFFFAOYSA-N 50259603 CHEMBL4087723 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2016.09.041 10.7270/Q2BP057T 27744252 Joubert, J; Foka, GB; Repsold, BP; Oliver, DW; Kapp, E; Malan, SF University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259603 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259603&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1332620 404339598 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50825652 Cc1c(C#N)c(=O)oc2cc(OCc3ccc(Br)cc3Br)ccc12 InChI=1S/C18H11Br2NO3/c1-10-14-5-4-13(7-17(14)24-18(22)15(10)8-21)23-9-11-2-3-12(19)6-16(11)20/h2-7H,9H2,1H3 PSULIFZEDNVGKW-UHFFFAOYSA-N 50259606 CHEMBL4069084 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2016.09.041 10.7270/Q2BP057T 27744252 Joubert, J; Foka, GB; Repsold, BP; Oliver, DW; Kapp, E; Malan, SF University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259606 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259606&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137633844 404339601 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50825653 Cc1c(Cl)c(=O)oc2cc(OCCN3CCC(Cc4ccccc4)CC3)ccc12 InChI=1S/C24H26ClNO3/c1-17-21-8-7-20(16-22(21)29-24(27)23(17)25)28-14-13-26-11-9-19(10-12-26)15-18-5-3-2-4-6-18/h2-8,16,19H,9-15H2,1H3 YIBRRLAMNLXGFL-UHFFFAOYSA-N 50259633 CHEMBL4067432 Cholinesterase 1270 ChEMBL 10.1016/j.ejmech.2016.09.041 10.7270/Q2BP057T 27744252 Joubert, J; Foka, GB; Repsold, BP; Oliver, DW; Kapp, E; Malan, SF University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259633 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259633&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134816693 404339614 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50825654 Cc1cc(=O)oc2cc(OCCN3CCN(Cc4ccc(Br)cc4)CC3)ccc12 InChI=1S/C23H25BrN2O3/c1-17-14-23(27)29-22-15-20(6-7-21(17)22)28-13-12-25-8-10-26(11-9-25)16-18-2-4-19(24)5-3-18/h2-7,14-15H,8-13,16H2,1H3 QUQIBOOPHFOKQS-UHFFFAOYSA-N 50259626 CHEMBL4086218 Cholinesterase 9700 ChEMBL 10.1016/j.ejmech.2016.09.041 10.7270/Q2BP057T 27744252 Joubert, J; Foka, GB; Repsold, BP; Oliver, DW; Kapp, E; Malan, SF University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259626 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259626&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134816691 404339607 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50825655 FC(F)(F)c1cc(=O)oc2cc(OCCN3CCN(Cc4ccc(Br)cc4)CC3)ccc12 InChI=1S/C23H22BrF3N2O3/c24-17-3-1-16(2-4-17)15-29-9-7-28(8-10-29)11-12-31-18-5-6-19-20(23(25,26)27)14-22(30)32-21(19)13-18/h1-6,13-14H,7-12,15H2 PPBFHRUODSNVDJ-UHFFFAOYSA-N 50259640 CHEMBL4061479 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2016.09.041 10.7270/Q2BP057T 27744252 Joubert, J; Foka, GB; Repsold, BP; Oliver, DW; Kapp, E; Malan, SF University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259640 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259640&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134816695 404339616 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50825715 Cc1cc(=O)oc2cc(OCc3ccccc3)ccc12 InChI=1S/C17H14O3/c1-12-9-17(18)20-16-10-14(7-8-15(12)16)19-11-13-5-3-2-4-6-13/h2-10H,11H2,1H3 RTORNQDWFDEDPT-UHFFFAOYSA-N 76662 4-methyl-7-phenylmethoxy-1-benzopyran-2-one::4-methyl-7-phenylmethoxy-chromen-2-one::4-methyl-7-phenylmethoxychromen-2-one::7-Benzyloxy-4-methyl-chromen-2-one::7-benzoxy-4-methyl-coumarin::MLS001212241::SMR000514539::cid_728520 Cholinesterase 9600 ChEMBL 10.1016/j.ejmech.2016.09.041 10.7270/Q2BP057T 27744252 Joubert, J; Foka, GB; Repsold, BP; Oliver, DW; Kapp, E; Malan, SF University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=76662 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=76662&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 728520 252653839 ZINC00139047 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50826701 C(Nc1c2CCCCc2nc2ccccc12)c1cn(Cc2ccccc2)nn1 InChI=1S/C23H23N5/c1-2-8-17(9-3-1)15-28-16-18(26-27-28)14-24-23-19-10-4-6-12-21(19)25-22-13-7-5-11-20(22)23/h1-4,6,8-10,12,16H,5,7,11,13-15H2,(H,24,25) FWWCYJLEODHGNW-UHFFFAOYSA-N 50259794 CHEMBL4096091 Cholinesterase 180 ChEMBL 10.1016/j.ejmech.2016.11.008 10.7270/Q25X2CCQ 27863370 Najafi, Z; Mahdavi, M; Saeedi, M; Karimpour-Razkenari, E; Asatouri, R; Vafadarnejad, F; Moghadam, FH; Khanavi, M; Sharifzadeh, M; Akbarzadeh, T Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259794 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259794&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137654837 404339746 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50826714 Clc1ccc2c(NCc3cn(Cc4ccccc4)nn3)c3CCCCc3nc2c1 InChI=1S/C23H22ClN5/c24-17-10-11-20-22(12-17)26-21-9-5-4-8-19(21)23(20)25-13-18-15-29(28-27-18)14-16-6-2-1-3-7-16/h1-3,6-7,10-12,15H,4-5,8-9,13-14H2,(H,25,26) RNRMCYXQNSQXAY-UHFFFAOYSA-N 50259779 CHEMBL4067102 Cholinesterase 197 ChEMBL 10.1016/j.ejmech.2016.11.008 10.7270/Q25X2CCQ 27863370 Najafi, Z; Mahdavi, M; Saeedi, M; Karimpour-Razkenari, E; Asatouri, R; Vafadarnejad, F; Moghadam, FH; Khanavi, M; Sharifzadeh, M; Akbarzadeh, T Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259779 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259779&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137632094 404339735 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50826715 Clc1ccc(Cn2cc(CNc3c4CCCCc4nc4ccccc34)nn2)cc1 InChI=1S/C23H22ClN5/c24-17-11-9-16(10-12-17)14-29-15-18(27-28-29)13-25-23-19-5-1-3-7-21(19)26-22-8-4-2-6-20(22)23/h1,3,5,7,9-12,15H,2,4,6,8,13-14H2,(H,25,26) OZXIGLKISXJFGY-UHFFFAOYSA-N 50259783 CHEMBL4104730 Cholinesterase 151 ChEMBL 10.1016/j.ejmech.2016.11.008 10.7270/Q25X2CCQ 27863370 Najafi, Z; Mahdavi, M; Saeedi, M; Karimpour-Razkenari, E; Asatouri, R; Vafadarnejad, F; Moghadam, FH; Khanavi, M; Sharifzadeh, M; Akbarzadeh, T Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259783 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259783&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137658306 404339737 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50826716 Clc1ccc(Cn2cc(CNc3c4CCCCc4nc4cc(Cl)ccc34)nn2)cc1 InChI=1S/C23H21Cl2N5/c24-16-7-5-15(6-8-16)13-30-14-18(28-29-30)12-26-23-19-3-1-2-4-21(19)27-22-11-17(25)9-10-20(22)23/h5-11,14H,1-4,12-13H2,(H,26,27) DLGKQUKYEHKDHV-UHFFFAOYSA-N 50259795 CHEMBL4080503 Cholinesterase >5000 ChEMBL 10.1016/j.ejmech.2016.11.008 10.7270/Q25X2CCQ 27863370 Najafi, Z; Mahdavi, M; Saeedi, M; Karimpour-Razkenari, E; Asatouri, R; Vafadarnejad, F; Moghadam, FH; Khanavi, M; Sharifzadeh, M; Akbarzadeh, T Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259795 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259795&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137645933 404339747 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50826717 Cc1ccc(Cn2cc(CNc3c4CCCCc4nc4ccccc34)nn2)cc1 InChI=1S/C24H25N5/c1-17-10-12-18(13-11-17)15-29-16-19(27-28-29)14-25-24-20-6-2-4-8-22(20)26-23-9-5-3-7-21(23)24/h2,4,6,8,10-13,16H,3,5,7,9,14-15H2,1H3,(H,25,26) LRTXOYQPPVNEBJ-UHFFFAOYSA-N 50259785 CHEMBL4069806 Cholinesterase 72 ChEMBL 10.1016/j.ejmech.2016.11.008 10.7270/Q25X2CCQ 27863370 Najafi, Z; Mahdavi, M; Saeedi, M; Karimpour-Razkenari, E; Asatouri, R; Vafadarnejad, F; Moghadam, FH; Khanavi, M; Sharifzadeh, M; Akbarzadeh, T Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259785 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259785&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137639971 404339739 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50826718 Cc1ccc(Cn2cc(CNc3c4CCCCc4nc4cc(Cl)ccc34)nn2)cc1 InChI=1S/C24H24ClN5/c1-16-6-8-17(9-7-16)14-30-15-19(28-29-30)13-26-24-20-4-2-3-5-22(20)27-23-12-18(25)10-11-21(23)24/h6-12,15H,2-5,13-14H2,1H3,(H,26,27) JROWLWDSDQKCPO-UHFFFAOYSA-N 50259788 CHEMBL4071948 Cholinesterase 65 ChEMBL 10.1016/j.ejmech.2016.11.008 10.7270/Q25X2CCQ 27863370 Najafi, Z; Mahdavi, M; Saeedi, M; Karimpour-Razkenari, E; Asatouri, R; Vafadarnejad, F; Moghadam, FH; Khanavi, M; Sharifzadeh, M; Akbarzadeh, T Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259788 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259788&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137639586 404339740 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50826719 Cc1ccc(Cn2cc(CNc3c4CCCCc4nc4ccc(Cl)cc34)nn2)cc1 InChI=1S/C24H24ClN5/c1-16-6-8-17(9-7-16)14-30-15-19(28-29-30)13-26-24-20-4-2-3-5-22(20)27-23-11-10-18(25)12-21(23)24/h6-12,15H,2-5,13-14H2,1H3,(H,26,27) VTUKZALKSPQQBB-UHFFFAOYSA-N 50259796 CHEMBL4098929 Cholinesterase 747 ChEMBL 10.1016/j.ejmech.2016.11.008 10.7270/Q25X2CCQ 27863370 Najafi, Z; Mahdavi, M; Saeedi, M; Karimpour-Razkenari, E; Asatouri, R; Vafadarnejad, F; Moghadam, FH; Khanavi, M; Sharifzadeh, M; Akbarzadeh, T Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259796 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259796&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137659506 404339748 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50826720 COc1ccc(Cn2cc(CNc3c4CCCCc4nc4cc(Cl)ccc34)nn2)cc1 InChI=1S/C24H24ClN5O/c1-31-19-9-6-16(7-10-19)14-30-15-18(28-29-30)13-26-24-20-4-2-3-5-22(20)27-23-12-17(25)8-11-21(23)24/h6-12,15H,2-5,13-14H2,1H3,(H,26,27) MIMGVJCCDQKNTC-UHFFFAOYSA-N 50259789 CHEMBL4091190 Cholinesterase 115 ChEMBL 10.1016/j.ejmech.2016.11.008 10.7270/Q25X2CCQ 27863370 Najafi, Z; Mahdavi, M; Saeedi, M; Karimpour-Razkenari, E; Asatouri, R; Vafadarnejad, F; Moghadam, FH; Khanavi, M; Sharifzadeh, M; Akbarzadeh, T Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259789 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259789&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137642400 404339741 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50826721 COc1ccc(Cn2cc(CNc3c4CCCCc4nc4ccc(Cl)cc34)nn2)cc1 InChI=1S/C24H24ClN5O/c1-31-19-9-6-16(7-10-19)14-30-15-18(28-29-30)13-26-24-20-4-2-3-5-22(20)27-23-11-8-17(25)12-21(23)24/h6-12,15H,2-5,13-14H2,1H3,(H,26,27) BTBKEVURFVTCBP-UHFFFAOYSA-N 50259790 CHEMBL4101395 Cholinesterase 1853 ChEMBL 10.1016/j.ejmech.2016.11.008 10.7270/Q25X2CCQ 27863370 Najafi, Z; Mahdavi, M; Saeedi, M; Karimpour-Razkenari, E; Asatouri, R; Vafadarnejad, F; Moghadam, FH; Khanavi, M; Sharifzadeh, M; Akbarzadeh, T Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259790 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259790&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137660320 404339742 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50826722 Fc1ccc(Cn2cc(CNc3c4CCCCc4nc4cc(Cl)ccc34)nn2)cc1 InChI=1S/C23H21ClFN5/c24-16-7-10-20-22(11-16)27-21-4-2-1-3-19(21)23(20)26-12-18-14-30(29-28-18)13-15-5-8-17(25)9-6-15/h5-11,14H,1-4,12-13H2,(H,26,27) JHBIBQRKQQQMCC-UHFFFAOYSA-N 50259792 CHEMBL4093669 Cholinesterase 216 ChEMBL 10.1016/j.ejmech.2016.11.008 10.7270/Q25X2CCQ 27863370 Najafi, Z; Mahdavi, M; Saeedi, M; Karimpour-Razkenari, E; Asatouri, R; Vafadarnejad, F; Moghadam, FH; Khanavi, M; Sharifzadeh, M; Akbarzadeh, T Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259792 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259792&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137654255 404339744 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50826723 Fc1ccc(Cn2cc(CNc3c4CCCCc4nc4ccc(Cl)cc34)nn2)cc1 InChI=1S/C23H21ClFN5/c24-16-7-10-22-20(11-16)23(19-3-1-2-4-21(19)27-22)26-12-18-14-30(29-28-18)13-15-5-8-17(25)9-6-15/h5-11,14H,1-4,12-13H2,(H,26,27) BHHZBKOZJIYTDH-UHFFFAOYSA-N 50259793 CHEMBL4072968 Cholinesterase 721 ChEMBL 10.1016/j.ejmech.2016.11.008 10.7270/Q25X2CCQ 27863370 Najafi, Z; Mahdavi, M; Saeedi, M; Karimpour-Razkenari, E; Asatouri, R; Vafadarnejad, F; Moghadam, FH; Khanavi, M; Sharifzadeh, M; Akbarzadeh, T Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259793 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259793&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137638707 404339745 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50826724 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 11682 2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::Rivastigmine.tartrate::US9586925, Rivastigmine Cholinesterase 7720 ChEMBL 10.1016/j.ejmech.2016.11.008 10.7270/Q25X2CCQ 27863370 Najafi, Z; Mahdavi, M; Saeedi, M; Karimpour-Razkenari, E; Asatouri, R; Vafadarnejad, F; Moghadam, FH; Khanavi, M; Sharifzadeh, M; Akbarzadeh, T Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=11682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=11682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46512204 DB00989 C11766 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50826726 COc1ccc(Cn2cc(CNc3c4CCCCc4nc4ccccc34)nn2)cc1 InChI=1S/C24H25N5O/c1-30-19-12-10-17(11-13-19)15-29-16-18(27-28-29)14-25-24-20-6-2-4-8-22(20)26-23-9-5-3-7-21(23)24/h2,4,6,8,10-13,16H,3,5,7,9,14-15H2,1H3,(H,25,26) PORMFFYKJHDMRT-UHFFFAOYSA-N 50245727 CHEMBL4063321 Cholinesterase 121 ChEMBL 10.1016/j.ejmech.2016.11.008 10.7270/Q25X2CCQ 27863370 Najafi, Z; Mahdavi, M; Saeedi, M; Karimpour-Razkenari, E; Asatouri, R; Vafadarnejad, F; Moghadam, FH; Khanavi, M; Sharifzadeh, M; Akbarzadeh, T Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50245727 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50245727&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137637856 386403569 CHEMBL4063321 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50826731 Clc1ccc2nc3CCCCc3c(NCc3cn(Cc4ccccc4)nn3)c2c1 InChI=1S/C23H22ClN5/c24-17-10-11-22-20(12-17)23(19-8-4-5-9-21(19)26-22)25-13-18-15-29(28-27-18)14-16-6-2-1-3-7-16/h1-3,6-7,10-12,15H,4-5,8-9,13-14H2,(H,25,26) AAZBXMSXAHFYME-UHFFFAOYSA-N 50259780 CHEMBL4088365 Cholinesterase >5000 ChEMBL 10.1016/j.ejmech.2016.11.008 10.7270/Q25X2CCQ 27863370 Najafi, Z; Mahdavi, M; Saeedi, M; Karimpour-Razkenari, E; Asatouri, R; Vafadarnejad, F; Moghadam, FH; Khanavi, M; Sharifzadeh, M; Akbarzadeh, T Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259780 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259780&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137643446 404339736 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50826732 Clc1ccc(Cn2cc(CNc3c4CCCCc4nc4ccc(Cl)cc34)nn2)cc1 InChI=1S/C23H21Cl2N5/c24-16-7-5-15(6-8-16)13-30-14-18(28-29-30)12-26-23-19-3-1-2-4-21(19)27-22-10-9-17(25)11-20(22)23/h5-11,14H,1-4,12-13H2,(H,26,27) ZIYZLXKEHOWZLP-UHFFFAOYSA-N 50259784 CHEMBL4097004 Cholinesterase 3936 ChEMBL 10.1016/j.ejmech.2016.11.008 10.7270/Q25X2CCQ 27863370 Najafi, Z; Mahdavi, M; Saeedi, M; Karimpour-Razkenari, E; Asatouri, R; Vafadarnejad, F; Moghadam, FH; Khanavi, M; Sharifzadeh, M; Akbarzadeh, T Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259784 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259784&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137661986 404339738 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50826752 Fc1ccc(Cn2cc(CNc3c4CCCCc4nc4ccccc34)nn2)cc1 InChI=1S/C23H22FN5/c24-17-11-9-16(10-12-17)14-29-15-18(27-28-29)13-25-23-19-5-1-3-7-21(19)26-22-8-4-2-6-20(22)23/h1,3,5,7,9-12,15H,2,4,6,8,13-14H2,(H,25,26) UREICIGVEMYZKU-UHFFFAOYSA-N 50259791 CHEMBL4083406 Cholinesterase 59 ChEMBL 10.1016/j.ejmech.2016.11.008 10.7270/Q25X2CCQ 27863370 Najafi, Z; Mahdavi, M; Saeedi, M; Karimpour-Razkenari, E; Asatouri, R; Vafadarnejad, F; Moghadam, FH; Khanavi, M; Sharifzadeh, M; Akbarzadeh, T Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50259791 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50259791&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137646288 404339743 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50826755 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 10.0 ChEMBL 10.1016/j.ejmech.2016.11.008 10.7270/Q25X2CCQ 27863370 Najafi, Z; Mahdavi, M; Saeedi, M; Karimpour-Razkenari, E; Asatouri, R; Vafadarnejad, F; Moghadam, FH; Khanavi, M; Sharifzadeh, M; Akbarzadeh, T Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50969792 COC(=O)C1Cc2c([nH]c3ccccc23)C(N1C(=O)CN(C)CCN(C)CC(=O)N1C(Cc2c([nH]c3ccccc23)C1c1ccccc1)C(=O)OC)c1ccccc1 InChI=1S/C46H48N6O6/c1-49(27-39(53)51-37(45(55)57-3)25-33-31-19-11-13-21-35(31)47-41(33)43(51)29-15-7-5-8-16-29)23-24-50(2)28-40(54)52-38(46(56)58-4)26-34-32-20-12-14-22-36(32)48-42(34)44(52)30-17-9-6-10-18-30/h5-22,37-38,43-44,47-48H,23-28H2,1-4H3 BFLIFZOFPJPIOZ-UHFFFAOYSA-N 50276267 CHEMBL4125969 Cholinesterase 14600 ChEMBL 10.1016/j.bmc.2018.06.018 10.7270/Q2PG1V7H 29960728 Zhao, Y; Ye, F; Xu, J; Liao, Q; Chen, L; Zhang, W; Sun, H; Liu, W; Feng, F; Qu, W China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276267 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276267&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145960587 405257466 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50969793 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 3200 ChEMBL 10.1016/j.bmc.2018.06.018 10.7270/Q2PG1V7H 29960728 Zhao, Y; Ye, F; Xu, J; Liao, Q; Chen, L; Zhang, W; Sun, H; Liu, W; Feng, F; Qu, W China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50969795 COC(=O)C1Cc2c([nH]c3ccccc23)C(C)N1C(=O)CCN(C)CCN(C)CCC(=O)N1C(C)c2[nH]c3ccccc3c2CC1C(=O)OC InChI=1S/C38H48N6O6/c1-23-35-27(25-11-7-9-13-29(25)39-35)21-31(37(47)49-5)43(23)33(45)15-17-41(3)19-20-42(4)18-16-34(46)44-24(2)36-28(22-32(44)38(48)50-6)26-12-8-10-14-30(26)40-36/h7-14,23-24,31-32,39-40H,15-22H2,1-6H3 FGQYLXRRYRNBQS-UHFFFAOYSA-N 50276268 CHEMBL4129415 Cholinesterase 1700 ChEMBL 10.1016/j.bmc.2018.06.018 10.7270/Q2PG1V7H 29960728 Zhao, Y; Ye, F; Xu, J; Liao, Q; Chen, L; Zhang, W; Sun, H; Liu, W; Feng, F; Qu, W China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276268 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276268&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145962026 405257467 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50969799 COC(=O)c1cc2c3ccccc3n(CCCN3CCN(CCCn4c5ccccc5c5cc(nc(C)c45)C(=O)OC)CC3)c2c(C)n1 InChI=1S/C38H42N6O4/c1-25-35-29(23-31(39-25)37(45)47-3)27-11-5-7-13-33(27)43(35)17-9-15-41-19-21-42(22-20-41)16-10-18-44-34-14-8-6-12-28(34)30-24-32(38(46)48-4)40-26(2)36(30)44/h5-8,11-14,23-24H,9-10,15-22H2,1-4H3 QEQWIYQXQNEFJU-UHFFFAOYSA-N 50276269 CHEMBL4128308 Cholinesterase 700 ChEMBL 10.1016/j.bmc.2018.06.018 10.7270/Q2PG1V7H 29960728 Zhao, Y; Ye, F; Xu, J; Liao, Q; Chen, L; Zhang, W; Sun, H; Liu, W; Feng, F; Qu, W China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276269 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276269&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145962601 405257468 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50969800 COC(=O)c1cc2c3ccccc3n(CCCN(C)CCN(C)CCCn3c4ccccc4c4cc(nc(-c5ccccc5)c34)C(=O)OC)c2c(n1)-c1ccccc1 InChI=1S/C48H48N6O4/c1-51(25-15-27-53-41-23-13-11-21-35(41)37-31-39(47(55)57-3)49-43(45(37)53)33-17-7-5-8-18-33)29-30-52(2)26-16-28-54-42-24-14-12-22-36(42)38-32-40(48(56)58-4)50-44(46(38)54)34-19-9-6-10-20-34/h5-14,17-24,31-32H,15-16,25-30H2,1-4H3 SBNXRBMJEYTMKH-UHFFFAOYSA-N 50276272 CHEMBL4126133 Cholinesterase 800 ChEMBL 10.1016/j.bmc.2018.06.018 10.7270/Q2PG1V7H 29960728 Zhao, Y; Ye, F; Xu, J; Liao, Q; Chen, L; Zhang, W; Sun, H; Liu, W; Feng, F; Qu, W China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276272 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276272&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145962961 405257471 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50969803 COC(=O)C1Cc2c(CN1C(=O)CCN(C)CCN(C)CCC(=O)N1Cc3[nH]c4ccccc4c3CC1C(=O)OC)[nH]c1ccccc21 InChI=1S/C36H44N6O6/c1-39(15-13-33(43)41-21-29-25(19-31(41)35(45)47-3)23-9-5-7-11-27(23)37-29)17-18-40(2)16-14-34(44)42-22-30-26(20-32(42)36(46)48-4)24-10-6-8-12-28(24)38-30/h5-12,31-32,37-38H,13-22H2,1-4H3 LUZLTEGSYFJOHF-UHFFFAOYSA-N 50276271 CHEMBL4125879 Cholinesterase 27000 ChEMBL 10.1016/j.bmc.2018.06.018 10.7270/Q2PG1V7H 29960728 Zhao, Y; Ye, F; Xu, J; Liao, Q; Chen, L; Zhang, W; Sun, H; Liu, W; Feng, F; Qu, W China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276271 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276271&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145960583 405257470 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50969804 COC(=O)c1cc2c3ccccc3n(CCCCN(C)CCN(C)CCCCn3c4ccccc4c4cc(nc(-c5ccccc5)c34)C(=O)OC)c2c(n1)-c1ccccc1 InChI=1S/C50H52N6O4/c1-53(27-15-17-29-55-43-25-13-11-23-37(43)39-33-41(49(57)59-3)51-45(47(39)55)35-19-7-5-8-20-35)31-32-54(2)28-16-18-30-56-44-26-14-12-24-38(44)40-34-42(50(58)60-4)52-46(48(40)56)36-21-9-6-10-22-36/h5-14,19-26,33-34H,15-18,27-32H2,1-4H3 OQDMNOSLOYHPMJ-UHFFFAOYSA-N 50276273 CHEMBL4129578 Cholinesterase 1800 ChEMBL 10.1016/j.bmc.2018.06.018 10.7270/Q2PG1V7H 29960728 Zhao, Y; Ye, F; Xu, J; Liao, Q; Chen, L; Zhang, W; Sun, H; Liu, W; Feng, F; Qu, W China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276273 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276273&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145961159 405257472 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50969805 COC(=O)c1cc2c3ccccc3n(CCCN(C)CCN(C)CCCn3c4ccccc4c4cc(nc(C)c34)C(=O)OC)c2c(C)n1 InChI=1S/C38H44N6O4/c1-25-35-29(23-31(39-25)37(45)47-5)27-13-7-9-15-33(27)43(35)19-11-17-41(3)21-22-42(4)18-12-20-44-34-16-10-8-14-28(34)30-24-32(38(46)48-6)40-26(2)36(30)44/h7-10,13-16,23-24H,11-12,17-22H2,1-6H3 KQMPMVXBGPGHNG-UHFFFAOYSA-N 50276274 CHEMBL4125697 Cholinesterase 15400 ChEMBL 10.1016/j.bmc.2018.06.018 10.7270/Q2PG1V7H 29960728 Zhao, Y; Ye, F; Xu, J; Liao, Q; Chen, L; Zhang, W; Sun, H; Liu, W; Feng, F; Qu, W China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276274 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276274&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145960807 405257473 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50969807 COC(=O)C1Cc2c([nH]c3ccccc23)C(C)N1C(=O)CCCN1CCN(CCCC(=O)N2C(C)c3[nH]c4ccccc4c3CC2C(=O)OC)CC1 InChI=1S/C40H50N6O6/c1-25-37-29(27-11-5-7-13-31(27)41-37)23-33(39(49)51-3)45(25)35(47)15-9-17-43-19-21-44(22-20-43)18-10-16-36(48)46-26(2)38-30(24-34(46)40(50)52-4)28-12-6-8-14-32(28)42-38/h5-8,11-14,25-26,33-34,41-42H,9-10,15-24H2,1-4H3 MGUJLWRILJXTBK-UHFFFAOYSA-N 50276276 CHEMBL4128035 Cholinesterase 2800 ChEMBL 10.1016/j.bmc.2018.06.018 10.7270/Q2PG1V7H 29960728 Zhao, Y; Ye, F; Xu, J; Liao, Q; Chen, L; Zhang, W; Sun, H; Liu, W; Feng, F; Qu, W China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276276 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276276&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145962589 405257475 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50969808 COC(=O)C1Cc2c([nH]c3ccccc23)C(C)N1C(=O)CCN1CCN(CCC(=O)N2C(C)c3[nH]c4ccccc4c3CC2C(=O)OC)CC1 InChI=1S/C38H46N6O6/c1-23-35-27(25-9-5-7-11-29(25)39-35)21-31(37(47)49-3)43(23)33(45)13-15-41-17-19-42(20-18-41)16-14-34(46)44-24(2)36-28(22-32(44)38(48)50-4)26-10-6-8-12-30(26)40-36/h5-12,23-24,31-32,39-40H,13-22H2,1-4H3 QIGJYXCURVXELC-UHFFFAOYSA-N 50276277 CHEMBL4126804 Cholinesterase 6000 ChEMBL 10.1016/j.bmc.2018.06.018 10.7270/Q2PG1V7H 29960728 Zhao, Y; Ye, F; Xu, J; Liao, Q; Chen, L; Zhang, W; Sun, H; Liu, W; Feng, F; Qu, W China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276277 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276277&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145963595 405257476 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50969809 COC(=O)C1Cc2c([nH]c3ccccc23)C(C)N1C(=O)CN(C)CCN(C)CC(=O)N1C(C)c2[nH]c3ccccc3c2CC1C(=O)OC InChI=1S/C36H44N6O6/c1-21-33-25(23-11-7-9-13-27(23)37-33)17-29(35(45)47-5)41(21)31(43)19-39(3)15-16-40(4)20-32(44)42-22(2)34-26(18-30(42)36(46)48-6)24-12-8-10-14-28(24)38-34/h7-14,21-22,29-30,37-38H,15-20H2,1-6H3 UNZGOCLPBDIPOV-UHFFFAOYSA-N 50276278 CHEMBL4128185 Cholinesterase 9000 ChEMBL 10.1016/j.bmc.2018.06.018 10.7270/Q2PG1V7H 29960728 Zhao, Y; Ye, F; Xu, J; Liao, Q; Chen, L; Zhang, W; Sun, H; Liu, W; Feng, F; Qu, W China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276278 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276278&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145961530 405257477 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50969810 COC(=O)C1Cc2c([nH]c3ccccc23)C(C)N1C(=O)CN1CCN(CC(=O)N2C(C)c3[nH]c4ccccc4c3CC2C(=O)OC)CC1 InChI=1S/C36H42N6O6/c1-21-33-25(23-9-5-7-11-27(23)37-33)17-29(35(45)47-3)41(21)31(43)19-39-13-15-40(16-14-39)20-32(44)42-22(2)34-26(18-30(42)36(46)48-4)24-10-6-8-12-28(24)38-34/h5-12,21-22,29-30,37-38H,13-20H2,1-4H3 NKXJDVDHSOMUBD-UHFFFAOYSA-N 50276281 CHEMBL4127262 Cholinesterase 20900 ChEMBL 10.1016/j.bmc.2018.06.018 10.7270/Q2PG1V7H 29960728 Zhao, Y; Ye, F; Xu, J; Liao, Q; Chen, L; Zhang, W; Sun, H; Liu, W; Feng, F; Qu, W China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276281 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276281&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145960641 405257478 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50969990 COC(=O)c1cc2c3ccccc3n(CCCCN3CCN(CCCCn4c5ccccc5c5cc(nc(C)c45)C(=O)OC)CC3)c2c(C)n1 InChI=1S/C40H46N6O4/c1-27-37-31(25-33(41-27)39(47)49-3)29-13-5-7-15-35(29)45(37)19-11-9-17-43-21-23-44(24-22-43)18-10-12-20-46-36-16-8-6-14-30(36)32-26-34(40(48)50-4)42-28(2)38(32)46/h5-8,13-16,25-26H,9-12,17-24H2,1-4H3 AAPDOVQJEVVHMC-UHFFFAOYSA-N 50276282 CHEMBL4127073 Cholinesterase 9700 ChEMBL 10.1016/j.bmc.2018.06.018 10.7270/Q2PG1V7H 29960728 Zhao, Y; Ye, F; Xu, J; Liao, Q; Chen, L; Zhang, W; Sun, H; Liu, W; Feng, F; Qu, W China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276282 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276282&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145960414 405257479 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50969991 COC(=O)c1cc2c3ccccc3n(CCCCN(C)CCN(C)CCCCn3c4ccccc4c4cc(nc(C)c34)C(=O)OC)c2c(C)n1 InChI=1S/C40H48N6O4/c1-27-37-31(25-33(41-27)39(47)49-5)29-15-7-9-17-35(29)45(37)21-13-11-19-43(3)23-24-44(4)20-12-14-22-46-36-18-10-8-16-30(36)32-26-34(40(48)50-6)42-28(2)38(32)46/h7-10,15-18,25-26H,11-14,19-24H2,1-6H3 FSZBJQRUTMNNMO-UHFFFAOYSA-N 50276270 CHEMBL4128861 Cholinesterase 1500 ChEMBL 10.1016/j.bmc.2018.06.018 10.7270/Q2PG1V7H 29960728 Zhao, Y; Ye, F; Xu, J; Liao, Q; Chen, L; Zhang, W; Sun, H; Liu, W; Feng, F; Qu, W China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276270 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276270&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145961338 405257469 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50969992 COC(=O)C1Cc2c([nH]c3ccccc23)C(N1C(=O)CCN1CCN(CCC(=O)N2C(Cc3c([nH]c4ccccc34)C2c2ccccc2)C(=O)OC)CC1)c1ccccc1 InChI=1S/C48H50N6O6/c1-59-47(57)39-29-35-33-17-9-11-19-37(33)49-43(35)45(31-13-5-3-6-14-31)53(39)41(55)21-23-51-25-27-52(28-26-51)24-22-42(56)54-40(48(58)60-2)30-36-34-18-10-12-20-38(34)50-44(36)46(54)32-15-7-4-8-16-32/h3-20,39-40,45-46,49-50H,21-30H2,1-2H3 MAZWHDKPBDXJEM-UHFFFAOYSA-N 50276275 CHEMBL4129285 Cholinesterase 5700 ChEMBL 10.1016/j.bmc.2018.06.018 10.7270/Q2PG1V7H 29960728 Zhao, Y; Ye, F; Xu, J; Liao, Q; Chen, L; Zhang, W; Sun, H; Liu, W; Feng, F; Qu, W China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276275 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276275&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145960733 405257474 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50903503 C[C@@H]1[C@@H]2NC[C@@H](C)C[C@H]2OC11CC[C@H]2[C@@H]3CC(=O)[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC2=C1C InChI=1S/C27H41NO3/c1-14-9-24-25(28-13-14)16(3)27(31-24)8-6-18-19(15(27)2)11-21-20(18)12-23(30)22-10-17(29)5-7-26(21,22)4/h14,16-18,20-22,24-25,28-29H,5-13H2,1-4H3/t14-,16+,17-,18+,20-,21-,22+,24+,25-,26+,27?/m0/s1 KYELXPJVGNZIGC-VMTDGGMESA-N 50270714 CHEMBL4129497 Cholinesterase 153090 ChEMBL 10.1016/j.ejmech.2017.06.007 10.7270/Q20K2C34 28605675 Liu, YM; Feng, YD; Lu, X; Nie, JB; Li, W; Wang, LN; Tian, LJ; Liu, QH Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50270714 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50270714&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14749106 405255573 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50903504 C[C@H]1CC[C@@H]2[C@@H](C)[C@@H]3CC[C@@H]4[C@@H](C[C@H]5[C@H]4C[C@@H](O)[C@H]4C[C@@H](O)CC[C@]54C)[C@@H]3CN2C1 InChI=1S/C27H45NO2/c1-15-4-7-25-16(2)18-5-6-19-20(22(18)14-28(25)13-15)11-23-21(19)12-26(30)24-10-17(29)8-9-27(23,24)3/h15-26,29-30H,4-14H2,1-3H3/t15-,16-,17-,18-,19+,20+,21-,22+,23-,24+,25+,26+,27+/m0/s1 NEMWYOKGHGSVSC-SECATLSXSA-N 50270715 CHEMBL4126200 Cholinesterase 2080 ChEMBL 10.1016/j.ejmech.2017.06.007 10.7270/Q20K2C34 28605675 Liu, YM; Feng, YD; Lu, X; Nie, JB; Li, W; Wang, LN; Tian, LJ; Liu, QH Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50270715 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50270715&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 21636310 405255574 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50903505 C[C@H]1CC[C@@H]2[C@@H](C)[C@@H]3CC[C@H]4[C@@H]5C[C@@H](O)[C@H]6C[C@H](CC[C@]6(C)[C@H]5C[C@H]4[C@@H]3CN2C1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O InChI=1S/C33H55NO7/c1-16-4-7-26-17(2)19-5-6-20-21(23(19)14-34(26)13-16)11-24-22(20)12-27(36)25-10-18(8-9-33(24,25)3)40-32-31(39)30(38)29(37)28(15-35)41-32/h16-32,35-39H,4-15H2,1-3H3/t16-,17-,18-,19-,20+,21+,22-,23+,24-,25+,26+,27+,28+,29+,30-,31+,32+,33+/m0/s1 RRZZOQYXEGRKNH-PZLLVVPKSA-N 50270721 CHEMBL4125795 Cholinesterase 3890 ChEMBL 10.1016/j.ejmech.2017.06.007 10.7270/Q20K2C34 28605675 Liu, YM; Feng, YD; Lu, X; Nie, JB; Li, W; Wang, LN; Tian, LJ; Liu, QH Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50270721 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50270721&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145961017 405255575 C03400 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50903506 C[C@H]1CC[C@@H]2[C@@H](C)[C@@H]3CC[C@H]4[C@@H]5C[C@H](O)[C@H]6C[C@H](CC[C@]6(C)[C@H]5C[C@H]4[C@@H]3CN2C1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O InChI=1S/C33H55NO7/c1-16-4-7-26-17(2)19-5-6-20-21(23(19)14-34(26)13-16)11-24-22(20)12-27(36)25-10-18(8-9-33(24,25)3)40-32-31(39)30(38)29(37)28(15-35)41-32/h16-32,35-39H,4-15H2,1-3H3/t16-,17-,18-,19-,20+,21+,22-,23+,24-,25+,26+,27-,28+,29+,30-,31+,32+,33+/m0/s1 RRZZOQYXEGRKNH-FMBUNNEVSA-N 50270723 CHEMBL4127029 Cholinesterase 13500 ChEMBL 10.1016/j.ejmech.2017.06.007 10.7270/Q20K2C34 28605675 Liu, YM; Feng, YD; Lu, X; Nie, JB; Li, W; Wang, LN; Tian, LJ; Liu, QH Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50270723 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50270723&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145962135 405255577 C03400 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50903507 C[C@H]1CC[C@H]2[C@H](C)[C@H]3CC[C@@H]4[C@@H](C[C@H]5[C@H]4C[C@@H](O)[C@H]4C[C@@H](O)CC[C@]54C)[C@@H]3CN2C1 InChI=1S/C27H45NO2/c1-15-4-7-25-16(2)18-5-6-19-20(22(18)14-28(25)13-15)11-23-21(19)12-26(30)24-10-17(29)8-9-27(23,24)3/h15-26,29-30H,4-14H2,1-3H3/t15-,16+,17-,18+,19+,20+,21-,22+,23-,24+,25-,26+,27+/m0/s1 NEMWYOKGHGSVSC-DZYYLIMLSA-N 50270724 CHEMBL4128408 Cholinesterase 18620 ChEMBL 10.1016/j.ejmech.2017.06.007 10.7270/Q20K2C34 28605675 Liu, YM; Feng, YD; Lu, X; Nie, JB; Li, W; Wang, LN; Tian, LJ; Liu, QH Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50270724 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50270724&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5316983 405255578 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50903508 C[C@H]1CC[C@H]2[C@H](C)[C@@H]3CC[C@H]4[C@@H]5CC(=O)[C@H]6C[C@@H](O)CC[C@]6(C)[C@H]5C[C@H]4[C@@H]3CN2C1 InChI=1S/C27H43NO2/c1-15-4-7-25-16(2)18-5-6-19-20(22(18)14-28(25)13-15)11-23-21(19)12-26(30)24-10-17(29)8-9-27(23,24)3/h15-25,29H,4-14H2,1-3H3/t15-,16+,17-,18-,19+,20+,21-,22+,23-,24+,25-,27+/m0/s1 MWBJDDYEYGDWCZ-ATGPSCQOSA-N 50270725 CHEMBL4128527 Cholinesterase 3050 ChEMBL 10.1016/j.ejmech.2017.06.007 10.7270/Q20K2C34 28605675 Liu, YM; Feng, YD; Lu, X; Nie, JB; Li, W; Wang, LN; Tian, LJ; Liu, QH Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50270725 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50270725&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14240940 405255579 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50903509 C[C@H]1CC[C@H]2[C@H](C)[C@@H]3CC[C@H]4[C@@H]5CC(=O)[C@H]6C[C@H](CC[C@]6(C)[C@H]5C[C@H]4[C@@H]3CN2C1)O[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O InChI=1S/C39H63NO12/c1-17-4-7-27-18(2)20-5-6-21-22(24(20)14-40(27)13-17)11-25-23(21)12-28(43)26-10-19(8-9-39(25,26)3)49-37-35(48)33(46)36(30(16-42)51-37)52-38-34(47)32(45)31(44)29(15-41)50-38/h17-27,29-38,41-42,44-48H,4-16H2,1-3H3/t17-,18+,19-,20-,21+,22+,23-,24+,25-,26+,27-,29+,30+,31+,32-,33+,34+,35+,36+,37+,38-,39+/m0/s1 PBSTXBXCICGBPQ-QUPYMMALSA-N 50270729 CHEMBL4127367 Cholinesterase 5710 ChEMBL 10.1016/j.ejmech.2017.06.007 10.7270/Q20K2C34 28605675 Liu, YM; Feng, YD; Lu, X; Nie, JB; Li, W; Wang, LN; Tian, LJ; Liu, QH Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50270729 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50270729&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145961270 405255583 C03400 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50903510 C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@]45C)[C@@H]3CC[C@H]1[C@]2(C)O InChI=1S/C27H43NO3/c1-15-4-7-25-27(3,31)21-6-5-17-18(20(21)14-28(25)13-15)11-22-19(17)12-24(30)23-10-16(29)8-9-26(22,23)2/h15-23,25,29,31H,4-14H2,1-3H3/t15-,16-,17+,18+,19-,20-,21+,22-,23+,25-,26+,27-/m0/s1 IQDIERHFZVCNRZ-LRCDAWNTSA-N 50270727 Imperialine Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2017.06.007 10.7270/Q20K2C34 28605675 Liu, YM; Feng, YD; Lu, X; Nie, JB; Li, W; Wang, LN; Tian, LJ; Liu, QH Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50270727 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50270727&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 442977 405255581 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50903515 C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@H](CC[C@]45C)O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]3CC[C@H]1[C@]2(C)O InChI=1S/C33H53NO8/c1-16-4-7-27-33(3,40)22-6-5-18-19(21(22)14-34(27)13-16)11-23-20(18)12-25(36)24-10-17(8-9-32(23,24)2)41-31-30(39)29(38)28(37)26(15-35)42-31/h16-24,26-31,35,37-40H,4-15H2,1-3H3/t16-,17-,18+,19+,20-,21-,22+,23-,24+,26+,27-,28+,29-,30+,31+,32+,33-/m0/s1 DHQFYEJMFMYGCV-DLJWJMOOSA-N 50270728 CHEMBL3787024 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2017.06.007 10.7270/Q20K2C34 28605675 Liu, YM; Feng, YD; Lu, X; Nie, JB; Li, W; Wang, LN; Tian, LJ; Liu, QH Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50270728 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50270728&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 132538 405255582 C03400 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50903819 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 21850 ChEMBL 10.1016/j.ejmech.2017.06.007 10.7270/Q20K2C34 28605675 Liu, YM; Feng, YD; Lu, X; Nie, JB; Li, W; Wang, LN; Tian, LJ; Liu, QH Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50903821 C[C@@H]1[C@@H]2NC[C@@H](C)C[C@H]2OC11CC[C@H]2[C@@H]3CC(=O)[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3C[C@@]2(O)C1=C InChI=1S/C27H41NO4/c1-14-9-23-24(28-13-14)15(2)27(32-23)8-6-19-18-11-22(30)20-10-17(29)5-7-25(20,4)21(18)12-26(19,31)16(27)3/h14-15,17-21,23-24,28-29,31H,3,5-13H2,1-2,4H3/t14-,15+,17-,18-,19-,20+,21-,23+,24-,25-,26+,27?/m0/s1 KIBKMNMAFWKVGM-CKCKDEBVSA-N 50270713 CHEMBL4129639 Cholinesterase 958300 ChEMBL 10.1016/j.ejmech.2017.06.007 10.7270/Q20K2C34 28605675 Liu, YM; Feng, YD; Lu, X; Nie, JB; Li, W; Wang, LN; Tian, LJ; Liu, QH Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50270713 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50270713&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145963491 405255572 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50903822 C[C@H]1CC[C@@H]2[C@@H](C)[C@@H]3CC[C@@H]4[C@@H](C[C@H]5[C@H]4C[C@H](O)[C@H]4C[C@@H](O)CC[C@]54C)[C@@H]3CN2C1 InChI=1S/C27H45NO2/c1-15-4-7-25-16(2)18-5-6-19-20(22(18)14-28(25)13-15)11-23-21(19)12-26(30)24-10-17(29)8-9-27(23,24)3/h15-26,29-30H,4-14H2,1-3H3/t15-,16-,17-,18-,19+,20+,21-,22+,23-,24+,25+,26-,27+/m0/s1 NEMWYOKGHGSVSC-CQNVZCOISA-N 50270722 CHEMBL4127172 Cholinesterase 2580 ChEMBL 10.1016/j.ejmech.2017.06.007 10.7270/Q20K2C34 28605675 Liu, YM; Feng, YD; Lu, X; Nie, JB; Li, W; Wang, LN; Tian, LJ; Liu, QH Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50270722 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50270722&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145960869 405255576 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50904263 C[C@H]1CC[C@H]2[C@H](C)[C@@H]3CC[C@H]4[C@@H]5CC(=O)[C@H]6C[C@H](CC[C@]6(C)[C@H]5C[C@H]4[C@@H]3CN2C1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O InChI=1S/C33H53NO7/c1-16-4-7-26-17(2)19-5-6-20-21(23(19)14-34(26)13-16)11-24-22(20)12-27(36)25-10-18(8-9-33(24,25)3)40-32-31(39)30(38)29(37)28(15-35)41-32/h16-26,28-32,35,37-39H,4-15H2,1-3H3/t16-,17+,18-,19-,20+,21+,22-,23+,24-,25+,26-,28+,29+,30-,31+,32+,33+/m0/s1 BSSXNTZKMOAXRA-MXXYQIINSA-N 50270726 CHEMBL4129894 Cholinesterase 6800 ChEMBL 10.1016/j.ejmech.2017.06.007 10.7270/Q20K2C34 28605675 Liu, YM; Feng, YD; Lu, X; Nie, JB; Li, W; Wang, LN; Tian, LJ; Liu, QH Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50270726 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50270726&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 192465 405255580 C03400 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50966642 CC(=O)OC[C@H]1O[C@@H](Oc2c(oc3ccccc3c2=O)-c2ccccc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O InChI=1S/C29H28O12/c1-15(30)35-14-22-25(36-16(2)31)27(37-17(3)32)28(38-18(4)33)29(40-22)41-26-23(34)20-12-8-9-13-21(20)39-24(26)19-10-6-5-7-11-19/h5-13,22,25,27-29H,14H2,1-4H3/t22-,25-,27+,28-,29+/m1/s1 LRLLKYAFYJTBCZ-YFTHNEECSA-N 50276060 CHEMBL4128639 Cholinesterase 45860 ChEMBL 10.1016/j.bmc.2018.05.050 10.7270/Q2V69N32 29886083 Mughal, EU; Javid, A; Sadiq, A; Murtaza, S; Zafar, MN; Khan, BA; Sumrra, SH; Tahir, MN; Kanwal, na; Khan, KM University of Gujrat http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276060 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276060&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145963662 405257357 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50966643 CC(=O)OC[C@H]1O[C@@H](Oc2c(oc3ccccc3c2=O)-c2ccccc2C(O)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O InChI=1S/C30H28O14/c1-14(31)38-13-22-25(39-15(2)32)27(40-16(3)33)28(41-17(4)34)30(43-22)44-26-23(35)20-11-7-8-12-21(20)42-24(26)18-9-5-6-10-19(18)29(36)37/h5-12,22,25,27-28,30H,13H2,1-4H3,(H,36,37)/t22-,25-,27+,28-,30+/m1/s1 PPIWWQBVKWPNEY-MMRBVXFGSA-N 50276043 CHEMBL4128409 Cholinesterase 48430 ChEMBL 10.1016/j.bmc.2018.05.050 10.7270/Q2V69N32 29886083 Mughal, EU; Javid, A; Sadiq, A; Murtaza, S; Zafar, MN; Khan, BA; Sumrra, SH; Tahir, MN; Kanwal, na; Khan, KM University of Gujrat http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276043 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276043&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145962828 405257355 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50966644 COc1ccc(cc1)-c1oc2ccccc2c(=O)c1O[C@@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O InChI=1S/C30H30O13/c1-15(31)37-14-23-26(38-16(2)32)28(39-17(3)33)29(40-18(4)34)30(42-23)43-27-24(35)21-8-6-7-9-22(21)41-25(27)19-10-12-20(36-5)13-11-19/h6-13,23,26,28-30H,14H2,1-5H3/t23-,26-,28+,29-,30+/m1/s1 DSTKWWUMSHCRBO-DTHWWUIMSA-N 50276059 CHEMBL4126201 Cholinesterase 26000 ChEMBL 10.1016/j.bmc.2018.05.050 10.7270/Q2V69N32 29886083 Mughal, EU; Javid, A; Sadiq, A; Murtaza, S; Zafar, MN; Khan, BA; Sumrra, SH; Tahir, MN; Kanwal, na; Khan, KM University of Gujrat http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276059 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276059&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145961229 405257356 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50966659 CC(=O)OC[C@H]1O[C@@H](Oc2c(oc3ccccc3c2=O)-c2cccs2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O InChI=1S/C27H26O12S/c1-13(28)33-12-19-22(34-14(2)29)25(35-15(3)30)26(36-16(4)31)27(38-19)39-24-21(32)17-8-5-6-9-18(17)37-23(24)20-10-7-11-40-20/h5-11,19,22,25-27H,12H2,1-4H3/t19-,22-,25+,26-,27+/m1/s1 NCDGXIFEWFHZKR-PDRYSNMOSA-N 50276061 CHEMBL4127253 Cholinesterase 25510 ChEMBL 10.1016/j.bmc.2018.05.050 10.7270/Q2V69N32 29886083 Mughal, EU; Javid, A; Sadiq, A; Murtaza, S; Zafar, MN; Khan, BA; Sumrra, SH; Tahir, MN; Kanwal, na; Khan, KM University of Gujrat http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276061 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276061&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145963615 405257358 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50966660 CC(=O)OC[C@H]1O[C@@H](Oc2c(oc3ccccc3c2=O)-c2ccc(F)cc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O InChI=1S/C29H27FO12/c1-14(31)36-13-22-25(37-15(2)32)27(38-16(3)33)28(39-17(4)34)29(41-22)42-26-23(35)20-7-5-6-8-21(20)40-24(26)18-9-11-19(30)12-10-18/h5-12,22,25,27-29H,13H2,1-4H3/t22-,25-,27+,28-,29+/m1/s1 ISIDGGRSSAOBCF-YFTHNEECSA-N 50276062 CHEMBL4129855 Cholinesterase 49830 ChEMBL 10.1016/j.bmc.2018.05.050 10.7270/Q2V69N32 29886083 Mughal, EU; Javid, A; Sadiq, A; Murtaza, S; Zafar, MN; Khan, BA; Sumrra, SH; Tahir, MN; Kanwal, na; Khan, KM University of Gujrat http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276062 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276062&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145961597 405257359 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50966686 CC(=O)Nc1ccc(cc1)-c1oc2ccccc2c(=O)c1O[C@@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O InChI=1S/C31H31NO13/c1-15(33)32-21-12-10-20(11-13-21)26-28(25(38)22-8-6-7-9-23(22)43-26)45-31-30(42-19(5)37)29(41-18(4)36)27(40-17(3)35)24(44-31)14-39-16(2)34/h6-13,24,27,29-31H,14H2,1-5H3,(H,32,33)/t24-,27-,29+,30-,31+/m1/s1 ZCQDOCAMVFPQOC-KCCLABFCSA-N 50276066 CHEMBL4128492 Cholinesterase 39700 ChEMBL 10.1016/j.bmc.2018.05.050 10.7270/Q2V69N32 29886083 Mughal, EU; Javid, A; Sadiq, A; Murtaza, S; Zafar, MN; Khan, BA; Sumrra, SH; Tahir, MN; Kanwal, na; Khan, KM University of Gujrat http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276066 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276066&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145961762 405257360 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50966687 CC(=O)OC[C@H]1O[C@@H](Oc2c(oc3ccccc3c2=O)-c2cccc3ccccc23)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O InChI=1S/C33H30O12/c1-17(34)39-16-26-29(40-18(2)35)31(41-19(3)36)32(42-20(4)37)33(44-26)45-30-27(38)24-13-7-8-15-25(24)43-28(30)23-14-9-11-21-10-5-6-12-22(21)23/h5-15,26,29,31-33H,16H2,1-4H3/t26-,29-,31+,32-,33+/m1/s1 SNWYYTUXANZCSA-DIBLRAHHSA-N 50276067 CHEMBL4129776 Cholinesterase 18690 ChEMBL 10.1016/j.bmc.2018.05.050 10.7270/Q2V69N32 29886083 Mughal, EU; Javid, A; Sadiq, A; Murtaza, S; Zafar, MN; Khan, BA; Sumrra, SH; Tahir, MN; Kanwal, na; Khan, KM University of Gujrat http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276067 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276067&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145961821 405257361 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50966694 CC(C)Cc1ccc(cc1)-c1oc2ccccc2c(=O)c1O[C@@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O InChI=1S/C33H36O12/c1-17(2)15-22-11-13-23(14-12-22)28-30(27(38)24-9-7-8-10-25(24)43-28)45-33-32(42-21(6)37)31(41-20(5)36)29(40-19(4)35)26(44-33)16-39-18(3)34/h7-14,17,26,29,31-33H,15-16H2,1-6H3/t26-,29-,31+,32-,33+/m1/s1 WOFGVDLURQHERS-DIBLRAHHSA-N 50276068 CHEMBL4127173 Cholinesterase 5420 ChEMBL 10.1016/j.bmc.2018.05.050 10.7270/Q2V69N32 29886083 Mughal, EU; Javid, A; Sadiq, A; Murtaza, S; Zafar, MN; Khan, BA; Sumrra, SH; Tahir, MN; Kanwal, na; Khan, KM University of Gujrat http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276068 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276068&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145960870 405257362 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50966695 CC(=O)OC[C@H]1O[C@@H](Oc2c(oc3ccccc3c2=O)-c2ccc(Br)cc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O InChI=1S/C29H27BrO12/c1-14(31)36-13-22-25(37-15(2)32)27(38-16(3)33)28(39-17(4)34)29(41-22)42-26-23(35)20-7-5-6-8-21(20)40-24(26)18-9-11-19(30)12-10-18/h5-12,22,25,27-29H,13H2,1-4H3/t22-,25-,27+,28-,29+/m1/s1 XCRWGHANDFWMRT-YFTHNEECSA-N 50276069 CHEMBL4128561 Cholinesterase 3120 ChEMBL 10.1016/j.bmc.2018.05.050 10.7270/Q2V69N32 29886083 Mughal, EU; Javid, A; Sadiq, A; Murtaza, S; Zafar, MN; Khan, BA; Sumrra, SH; Tahir, MN; Kanwal, na; Khan, KM University of Gujrat http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276069 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276069&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145960698 405257363 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50966696 CC(=O)OC[C@H]1O[C@@H](Oc2c(oc3cc(C)ccc3c2=O)-c2ccc(Br)cc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O InChI=1S/C30H29BrO12/c1-14-6-11-21-22(12-14)41-25(19-7-9-20(31)10-8-19)27(24(21)36)43-30-29(40-18(5)35)28(39-17(4)34)26(38-16(3)33)23(42-30)13-37-15(2)32/h6-12,23,26,28-30H,13H2,1-5H3/t23-,26-,28+,29-,30+/m1/s1 DVZAVNFDXZUZQN-DTHWWUIMSA-N 50276070 CHEMBL4127574 Cholinesterase 30580 ChEMBL 10.1016/j.bmc.2018.05.050 10.7270/Q2V69N32 29886083 Mughal, EU; Javid, A; Sadiq, A; Murtaza, S; Zafar, MN; Khan, BA; Sumrra, SH; Tahir, MN; Kanwal, na; Khan, KM University of Gujrat http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276070 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276070&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145962373 405257364 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50966697 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 130 ChEMBL 10.1016/j.bmc.2018.05.050 10.7270/Q2V69N32 29886083 Mughal, EU; Javid, A; Sadiq, A; Murtaza, S; Zafar, MN; Khan, BA; Sumrra, SH; Tahir, MN; Kanwal, na; Khan, KM University of Gujrat http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50966727 CSc1ccc(cc1)C1c2c(C)[nH]nc2Oc2nc3CCCCc3c(N)c12 InChI=1S/C21H22N4OS/c1-11-16-17(12-7-9-13(27-2)10-8-12)18-19(22)14-5-3-4-6-15(14)23-20(18)26-21(16)25-24-11/h7-10,17H,3-6H2,1-2H3,(H2,22,23)(H,24,25) OQQWRJDNABQZIU-UHFFFAOYSA-N 50276071 CHEMBL4126608 Cholinesterase >66050 ChEMBL 10.1016/j.bmcl.2018.05.063 10.7270/Q2KP84N0 29887354 Derabli, C; Boualia, I; Abdelwahab, AB; Boulcina, R; Bensouici, C; Kirsch, G; Debache, A Fr£res Mentouri-Constantine University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276071 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276071&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145962757 405257365 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50966731 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 40720 ChEMBL 10.1016/j.bmcl.2018.05.063 10.7270/Q2KP84N0 29887354 Derabli, C; Boualia, I; Abdelwahab, AB; Boulcina, R; Bensouici, C; Kirsch, G; Debache, A Fr£res Mentouri-Constantine University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50966732 Cc1[nH]nc2Oc3nc4CCCCc4c(N)c3C(c12)c1c(Cl)cccc1[N+]([O-])=O InChI=1S/C20H18ClN5O3/c1-9-14-16(15-11(21)6-4-8-13(15)26(27)28)17-18(22)10-5-2-3-7-12(10)23-19(17)29-20(14)25-24-9/h4,6,8,16H,2-3,5,7H2,1H3,(H2,22,23)(H,24,25) BBBBEZWTLXJLBZ-UHFFFAOYSA-N 50276079 CHEMBL4129080 Cholinesterase 1840 ChEMBL 10.1016/j.bmcl.2018.05.063 10.7270/Q2KP84N0 29887354 Derabli, C; Boualia, I; Abdelwahab, AB; Boulcina, R; Bensouici, C; Kirsch, G; Debache, A Fr£res Mentouri-Constantine University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276079 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276079&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145963076 405257367 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50966733 Cc1[nH]nc2Oc3nc4CCCCc4c(N)c3C(c12)c1ccc(C)cc1C InChI=1S/C22H24N4O/c1-11-8-9-14(12(2)10-11)18-17-13(3)25-26-22(17)27-21-19(18)20(23)15-6-4-5-7-16(15)24-21/h8-10,18H,4-7H2,1-3H3,(H2,23,24)(H,25,26) BPWNIPZCXDIMFG-UHFFFAOYSA-N 50276080 CHEMBL4126451 Cholinesterase 39030 ChEMBL 10.1016/j.bmcl.2018.05.063 10.7270/Q2KP84N0 29887354 Derabli, C; Boualia, I; Abdelwahab, AB; Boulcina, R; Bensouici, C; Kirsch, G; Debache, A Fr£res Mentouri-Constantine University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276080 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276080&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145960385 405257368 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50966772 COc1ccc2ccccc2c1C1c2c(C)[nH]nc2Oc2nc3CCCCc3c(N)c12 InChI=1S/C25H24N4O2/c1-13-19-21(20-15-8-4-3-7-14(15)11-12-18(20)30-2)22-23(26)16-9-5-6-10-17(16)27-24(22)31-25(19)29-28-13/h3-4,7-8,11-12,21H,5-6,9-10H2,1-2H3,(H2,26,27)(H,28,29) VOAWRSAQXWYEAL-UHFFFAOYSA-N 50276087 CHEMBL4130142 Cholinesterase 11350 ChEMBL 10.1016/j.bmcl.2018.05.063 10.7270/Q2KP84N0 29887354 Derabli, C; Boualia, I; Abdelwahab, AB; Boulcina, R; Bensouici, C; Kirsch, G; Debache, A Fr£res Mentouri-Constantine University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276087 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276087&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145962682 405257371 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50966777 Cc1[nH]nc2Oc3nc4CCCCc4c(N)c3C(c12)c1cccnc1 InChI=1S/C19H19N5O/c1-10-14-15(11-5-4-8-21-9-11)16-17(20)12-6-2-3-7-13(12)22-18(16)25-19(14)24-23-10/h4-5,8-9,15H,2-3,6-7H2,1H3,(H2,20,22)(H,23,24) CJILKXHDHRCEFS-UHFFFAOYSA-N 50276088 CHEMBL4130296 Cholinesterase 4260 ChEMBL 10.1016/j.bmcl.2018.05.063 10.7270/Q2KP84N0 29887354 Derabli, C; Boualia, I; Abdelwahab, AB; Boulcina, R; Bensouici, C; Kirsch, G; Debache, A Fr£res Mentouri-Constantine University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276088 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276088&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145961624 405257372 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50966779 Cc1[nH]nc2Oc3nc4CCCCc4c(N)c3C(c12)c1ccc(cc1)-c1ccccc1 InChI=1S/C26H24N4O/c1-15-21-22(18-13-11-17(12-14-18)16-7-3-2-4-8-16)23-24(27)19-9-5-6-10-20(19)28-25(23)31-26(21)30-29-15/h2-4,7-8,11-14,22H,5-6,9-10H2,1H3,(H2,27,28)(H,29,30) XYIWAZKLIBEGKS-UHFFFAOYSA-N 50276089 CHEMBL4128928 Cholinesterase >61200 ChEMBL 10.1016/j.bmcl.2018.05.063 10.7270/Q2KP84N0 29887354 Derabli, C; Boualia, I; Abdelwahab, AB; Boulcina, R; Bensouici, C; Kirsch, G; Debache, A Fr£res Mentouri-Constantine University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276089 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276089&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145960497 405257373 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50966921 Cc1[nH]nc2Oc3nc4CCCCc4c(N)c3C(c12)c1cc(ccc1Cl)[N+]([O-])=O InChI=1S/C20H18ClN5O3/c1-9-15-16(12-8-10(26(27)28)6-7-13(12)21)17-18(22)11-4-2-3-5-14(11)23-19(17)29-20(15)25-24-9/h6-8,16H,2-5H2,1H3,(H2,22,23)(H,24,25) QDELEYYBLZIYHT-UHFFFAOYSA-N 50276082 CHEMBL4127685 Cholinesterase 2500 ChEMBL 10.1016/j.bmcl.2018.05.063 10.7270/Q2KP84N0 29887354 Derabli, C; Boualia, I; Abdelwahab, AB; Boulcina, R; Bensouici, C; Kirsch, G; Debache, A Fr£res Mentouri-Constantine University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276082 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276082&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145963026 405257370 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50966926 COc1ccc(C2c3c(C)[nH]nc3Oc3nc4CCCCc4c(N)c23)c(OC)c1 InChI=1S/C22H24N4O3/c1-11-17-18(14-9-8-12(27-2)10-16(14)28-3)19-20(23)13-6-4-5-7-15(13)24-21(19)29-22(17)26-25-11/h8-10,18H,4-7H2,1-3H3,(H2,23,24)(H,25,26) NLBGRNZBLHWWNJ-UHFFFAOYSA-N 50276072 CHEMBL4127841 Cholinesterase 31110 ChEMBL 10.1016/j.bmcl.2018.05.063 10.7270/Q2KP84N0 29887354 Derabli, C; Boualia, I; Abdelwahab, AB; Boulcina, R; Bensouici, C; Kirsch, G; Debache, A Fr£res Mentouri-Constantine University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276072 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276072&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145962165 405257366 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50970661 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 17380 ChEMBL 10.1016/j.bmc.2018.05.042 10.7270/Q29889HN 30017112 Ibrar, A; Shehzadi, SA; Saeed, F; Khan, I Abbottabad University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50970664 [O-][N+](=O)c1ccc2oc(=O)c(cc2c1)-c1csc(NC(=O)Nc2ccc(F)cc2)n1 InChI=1S/C19H11FN4O5S/c20-11-1-3-12(4-2-11)21-18(26)23-19-22-15(9-30-19)14-8-10-7-13(24(27)28)5-6-16(10)29-17(14)25/h1-9H,(H2,21,22,23,26) KFBRZPHJODPHCN-UHFFFAOYSA-N 152467 1-(4-Fluorophenyl)-3-(4-(6-nitro-2-oxo-2H-chromen-3-yl)thiazol-2-yl)urea (e31) Cholinesterase 4930 ChEMBL 10.1016/j.bmc.2018.05.042 10.7270/Q29889HN 30017112 Ibrar, A; Shehzadi, SA; Saeed, F; Khan, I Abbottabad University of Science and Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=152467 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=152467&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91937704 252826718 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957650 COc1ccc(cc1)C1CC(=Nc2ccccc2S1)c1cc2cc(Br)ccc2o1 InChI=1S/C24H18BrNO2S/c1-27-18-9-6-15(7-10-18)24-14-20(26-19-4-2-3-5-23(19)29-24)22-13-16-12-17(25)8-11-21(16)28-22/h2-13,24H,14H2,1H3 OCYVMKLEVHNRGX-UHFFFAOYSA-N 50275230 CHEMBL4126049 Cholinesterase 1000 ChEMBL 10.1016/j.bmc.2018.02.049 10.7270/Q2SF2ZPJ 29866481 Mostofi, M; Mohammadi Ziarani, G; Lashgari, N Alzahra University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50275230 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50275230&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145963154 405257153 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957651 Brc1ccc2oc(cc2c1)C1=Nc2ccccc2SC(C1)c1c[nH]c2ccccc12 InChI=1S/C25H17BrN2OS/c26-16-9-10-22-15(11-16)12-23(29-22)21-13-25(30-24-8-4-3-7-20(24)28-21)18-14-27-19-6-2-1-5-17(18)19/h1-12,14,25,27H,13H2 CIFWBEDKRGQXSU-UHFFFAOYSA-N 50275231 CHEMBL4127739 Cholinesterase 28000 ChEMBL 10.1016/j.bmc.2018.02.049 10.7270/Q2SF2ZPJ 29866481 Mostofi, M; Mohammadi Ziarani, G; Lashgari, N Alzahra University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50275231 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50275231&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145961510 405257154 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957652 [O-][N+](=O)c1ccc2oc(cc2c1)C1=Nc2ccccc2SC(C1)c1c[nH]c2ccccc12 InChI=1S/C25H17N3O3S/c29-28(30)16-9-10-22-15(11-16)12-23(31-22)21-13-25(32-24-8-4-3-7-20(24)27-21)18-14-26-19-6-2-1-5-17(18)19/h1-12,14,25-26H,13H2 MEERRGGPFPGFJR-UHFFFAOYSA-N 50275236 CHEMBL4127914 Cholinesterase 72000 ChEMBL 10.1016/j.bmc.2018.02.049 10.7270/Q2SF2ZPJ 29866481 Mostofi, M; Mohammadi Ziarani, G; Lashgari, N Alzahra University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50275236 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50275236&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145961518 405257155 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957653 Oc1ccc(cc1)C1CC(=Nc2ccccc2S1)c1cc2ccccc2o1 InChI=1S/C23H17NO2S/c25-17-11-9-15(10-12-17)23-14-19(24-18-6-2-4-8-22(18)27-23)21-13-16-5-1-3-7-20(16)26-21/h1-13,23,25H,14H2 XLWWQBIHOZHJAM-UHFFFAOYSA-N 50275237 CHEMBL4126881 Cholinesterase 14000 ChEMBL 10.1016/j.bmc.2018.02.049 10.7270/Q2SF2ZPJ 29866481 Mostofi, M; Mohammadi Ziarani, G; Lashgari, N Alzahra University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50275237 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50275237&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145963382 405257156 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957654 COc1ccccc1C1CC(=Nc2ccccc2S1)c1cc2ccccc2o1 InChI=1S/C24H19NO2S/c1-26-21-12-6-3-9-17(21)24-15-19(25-18-10-4-7-13-23(18)28-24)22-14-16-8-2-5-11-20(16)27-22/h2-14,24H,15H2,1H3 DVNAYPFKCCRMBK-UHFFFAOYSA-N 50275238 CHEMBL4130145 Cholinesterase 4800 ChEMBL 10.1016/j.bmc.2018.02.049 10.7270/Q2SF2ZPJ 29866481 Mostofi, M; Mohammadi Ziarani, G; Lashgari, N Alzahra University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50275238 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50275238&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145962904 405257157 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957655 COc1cccc(c1)C1CC(=Nc2ccccc2S1)c1cc2ccccc2o1 InChI=1S/C24H19NO2S/c1-26-18-9-6-8-17(13-18)24-15-20(25-19-10-3-5-12-23(19)28-24)22-14-16-7-2-4-11-21(16)27-22/h2-14,24H,15H2,1H3 SHQVXXXYCKKTGI-UHFFFAOYSA-N 50275244 CHEMBL4127850 Cholinesterase 4100 ChEMBL 10.1016/j.bmc.2018.02.049 10.7270/Q2SF2ZPJ 29866481 Mostofi, M; Mohammadi Ziarani, G; Lashgari, N Alzahra University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50275244 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50275244&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145962384 405257158 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957656 COc1ccc(cc1)C1CC(=Nc2ccccc2S1)c1cc2ccccc2o1 InChI=1S/C24H19NO2S/c1-26-18-12-10-16(11-13-18)24-15-20(25-19-7-3-5-9-23(19)28-24)22-14-17-6-2-4-8-21(17)27-22/h2-14,24H,15H2,1H3 PKBJJBSAFTVIEI-UHFFFAOYSA-N 50275245 CHEMBL4126460 Cholinesterase 4000 ChEMBL 10.1016/j.bmc.2018.02.049 10.7270/Q2SF2ZPJ 29866481 Mostofi, M; Mohammadi Ziarani, G; Lashgari, N Alzahra University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50275245 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50275245&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145960608 405257159 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957657 C1C(Sc2ccccc2N=C1c1cc2ccccc2o1)c1cccc2ccccc12 InChI=1S/C27H19NOS/c1-3-11-20-18(8-1)10-7-12-21(20)27-17-23(28-22-13-4-6-15-26(22)30-27)25-16-19-9-2-5-14-24(19)29-25/h1-16,27H,17H2 OENQVUWFZUAMDV-UHFFFAOYSA-N 50275246 CHEMBL4129086 Cholinesterase 63000 ChEMBL 10.1016/j.bmc.2018.02.049 10.7270/Q2SF2ZPJ 29866481 Mostofi, M; Mohammadi Ziarani, G; Lashgari, N Alzahra University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50275246 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50275246&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145963268 405257160 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957658 C1C(Sc2ccccc2N=C1c1cc2ccccc2o1)c1c[nH]c2ccccc12 InChI=1S/C25H18N2OS/c1-5-11-22-16(7-1)13-23(28-22)21-14-25(29-24-12-6-4-10-20(24)27-21)18-15-26-19-9-3-2-8-17(18)19/h1-13,15,25-26H,14H2 CNWDFCYLBXMCSN-UHFFFAOYSA-N 50275247 CHEMBL4127693 Cholinesterase 60000 ChEMBL 10.1016/j.bmc.2018.02.049 10.7270/Q2SF2ZPJ 29866481 Mostofi, M; Mohammadi Ziarani, G; Lashgari, N Alzahra University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50275247 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50275247&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145963209 405257161 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957659 COc1cccc2cc(oc12)C1=Nc2ccccc2SC(C1)c1ccccc1 InChI=1S/C24H19NO2S/c1-26-20-12-7-10-17-14-21(27-24(17)20)19-15-23(16-8-3-2-4-9-16)28-22-13-6-5-11-18(22)25-19/h2-14,23H,15H2,1H3 GLRQMIQSZIKCBF-UHFFFAOYSA-N 50275253 CHEMBL4130033 Cholinesterase 2500 ChEMBL 10.1016/j.bmc.2018.02.049 10.7270/Q2SF2ZPJ 29866481 Mostofi, M; Mohammadi Ziarani, G; Lashgari, N Alzahra University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50275253 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50275253&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145961831 405257162 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957660 COc1cccc2cc(oc12)C1=Nc2ccccc2SC(C1)c1ccc(O)cc1 InChI=1S/C24H19NO3S/c1-27-20-7-4-5-16-13-21(28-24(16)20)19-14-23(15-9-11-17(26)12-10-15)29-22-8-3-2-6-18(22)25-19/h2-13,23,26H,14H2,1H3 HKNQKKLQPZKTAY-UHFFFAOYSA-N 50275254 CHEMBL4128663 Cholinesterase 4100 ChEMBL 10.1016/j.bmc.2018.02.049 10.7270/Q2SF2ZPJ 29866481 Mostofi, M; Mohammadi Ziarani, G; Lashgari, N Alzahra University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50275254 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50275254&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145961123 405257163 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957661 Brc1ccc2oc(cc2c1)C1=Nc2ccccc2SC(C1)c1ccccc1 InChI=1S/C23H16BrNOS/c24-17-10-11-20-16(12-17)13-21(26-20)19-14-23(15-6-2-1-3-7-15)27-22-9-5-4-8-18(22)25-19/h1-13,23H,14H2 NLDMGKKKRSIUAN-UHFFFAOYSA-N 50275255 CHEMBL4128273 Cholinesterase 8500 ChEMBL 10.1016/j.bmc.2018.02.049 10.7270/Q2SF2ZPJ 29866481 Mostofi, M; Mohammadi Ziarani, G; Lashgari, N Alzahra University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50275255 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50275255&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145961315 405257164 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957662 Oc1ccc(cc1)C1CC(=Nc2ccccc2S1)c1cc2cc(Br)ccc2o1 InChI=1S/C23H16BrNO2S/c24-16-7-10-20-15(11-16)12-21(27-20)19-13-23(14-5-8-17(26)9-6-14)28-22-4-2-1-3-18(22)25-19/h1-12,23,26H,13H2 WRDDWGWSUJTBLG-UHFFFAOYSA-N 50275268 CHEMBL4129645 Cholinesterase 6500 ChEMBL 10.1016/j.bmc.2018.02.049 10.7270/Q2SF2ZPJ 29866481 Mostofi, M; Mohammadi Ziarani, G; Lashgari, N Alzahra University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50275268 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50275268&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145963698 104118787 ZINC45496959 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957663 COc1ccccc1C1CC(=Nc2ccccc2S1)c1cc2cc(Br)ccc2o1 InChI=1S/C24H18BrNO2S/c1-27-21-8-4-2-6-17(21)24-14-19(26-18-7-3-5-9-23(18)29-24)22-13-15-12-16(25)10-11-20(15)28-22/h2-13,24H,14H2,1H3 XOHFTXHHKGJQHH-UHFFFAOYSA-N 50275269 CHEMBL4129504 Cholinesterase 1800 ChEMBL 10.1016/j.bmc.2018.02.049 10.7270/Q2SF2ZPJ 29866481 Mostofi, M; Mohammadi Ziarani, G; Lashgari, N Alzahra University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50275269 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50275269&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145962027 405257165 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957664 COc1cccc(c1)C1CC(=Nc2ccccc2S1)c1cc2cc(Br)ccc2o1 InChI=1S/C24H18BrNO2S/c1-27-18-6-4-5-15(12-18)24-14-20(26-19-7-2-3-8-23(19)29-24)22-13-16-11-17(25)9-10-21(16)28-22/h2-13,24H,14H2,1H3 AESPAUJNWAHVPI-UHFFFAOYSA-N 50275270 CHEMBL4126207 Cholinesterase 1000 ChEMBL 10.1016/j.bmc.2018.02.049 10.7270/Q2SF2ZPJ 29866481 Mostofi, M; Mohammadi Ziarani, G; Lashgari, N Alzahra University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50275270 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50275270&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145961446 405257166 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957665 Cc1ccc(cc1)C1CC(=Nc2ccccc2S1)c1cc2cc(Br)ccc2o1 InChI=1S/C24H18BrNOS/c1-15-6-8-16(9-7-15)24-14-20(26-19-4-2-3-5-23(19)28-24)22-13-17-12-18(25)10-11-21(17)27-22/h2-13,24H,14H2,1H3 AGAJLNVQZJQNJZ-UHFFFAOYSA-N 50275271 CHEMBL4127431 Cholinesterase 8500 ChEMBL 10.1016/j.bmc.2018.02.049 10.7270/Q2SF2ZPJ 29866481 Mostofi, M; Mohammadi Ziarani, G; Lashgari, N Alzahra University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50275271 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50275271&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145960648 405257167 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957666 Fc1ccccc1C1CC(=Nc2ccccc2S1)c1cc2cc(Br)ccc2o1 InChI=1S/C23H15BrFNOS/c24-15-9-10-20-14(11-15)12-21(27-20)19-13-23(16-5-1-2-6-17(16)25)28-22-8-4-3-7-18(22)26-19/h1-12,23H,13H2 OAYGMUGBKWWPOD-UHFFFAOYSA-N 50275272 CHEMBL4127288 Cholinesterase 13700 ChEMBL 10.1016/j.bmc.2018.02.049 10.7270/Q2SF2ZPJ 29866481 Mostofi, M; Mohammadi Ziarani, G; Lashgari, N Alzahra University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50275272 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50275272&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145961718 405257168 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957667 Brc1ccc2oc(cc2c1)C1=Nc2ccccc2SC(C1)c1cccc2ccccc12 InChI=1S/C27H18BrNOS/c28-19-12-13-24-18(14-19)15-25(30-24)23-16-27(31-26-11-4-3-10-22(26)29-23)21-9-5-7-17-6-1-2-8-20(17)21/h1-15,27H,16H2 IAZZETSMNRLLIS-UHFFFAOYSA-N 50275309 CHEMBL4128803 Cholinesterase 17000 ChEMBL 10.1016/j.bmc.2018.02.049 10.7270/Q2SF2ZPJ 29866481 Mostofi, M; Mohammadi Ziarani, G; Lashgari, N Alzahra University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50275309 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50275309&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145962623 405257169 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957668 [O-][N+](=O)c1ccc2oc(cc2c1)C1=Nc2ccccc2SC(C1)c1ccccc1F InChI=1S/C23H15FN2O3S/c24-17-6-2-1-5-16(17)23-13-19(25-18-7-3-4-8-22(18)30-23)21-12-14-11-15(26(27)28)9-10-20(14)29-21/h1-12,23H,13H2 BJAIYWQZIILQTR-UHFFFAOYSA-N 50275310 CHEMBL4129157 Cholinesterase 22000 ChEMBL 10.1016/j.bmc.2018.02.049 10.7270/Q2SF2ZPJ 29866481 Mostofi, M; Mohammadi Ziarani, G; Lashgari, N Alzahra University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50275310 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50275310&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145962640 405257170 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957669 [O-][N+](=O)c1ccc2oc(cc2c1)C1=Nc2ccccc2SC(C1)c1cccc2ccccc12 InChI=1S/C27H18N2O3S/c30-29(31)19-12-13-24-18(14-19)15-25(32-24)23-16-27(33-26-11-4-3-10-22(26)28-23)21-9-5-7-17-6-1-2-8-20(17)21/h1-15,27H,16H2 VINDCPAZBVLOEA-UHFFFAOYSA-N 50275311 CHEMBL4129309 Cholinesterase 55000 ChEMBL 10.1016/j.bmc.2018.02.049 10.7270/Q2SF2ZPJ 29866481 Mostofi, M; Mohammadi Ziarani, G; Lashgari, N Alzahra University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50275311 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50275311&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145961570 405257171 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957670 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 2630 ChEMBL 10.1016/j.bmc.2018.02.049 10.7270/Q2SF2ZPJ 29866481 Mostofi, M; Mohammadi Ziarani, G; Lashgari, N Alzahra University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50957671 COc1cccc(c1)C1CC(=Nc2ccccc2S1)c1cc2cc(Br)ccc2o1 InChI=1S/C24H18BrNO2S/c1-27-18-6-4-5-15(12-18)24-14-20(26-19-7-2-3-8-23(19)29-24)22-13-16-11-17(25)9-10-21(16)28-22/h2-13,24H,14H2,1H3 AESPAUJNWAHVPI-UHFFFAOYSA-N 50275270 CHEMBL4126207 Cholinesterase 100 ChEMBL 10.1016/j.bmc.2018.02.049 10.7270/Q2SF2ZPJ 29866481 Mostofi, M; Mohammadi Ziarani, G; Lashgari, N Alzahra University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50275270 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50275270&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145961446 405257166 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50968763 Cc1[nH]nc2Oc3nc4CCCCc4c(N)c3C(c12)c1ccc(Br)cc1 InChI=1S/C20H19BrN4O/c1-10-15-16(11-6-8-12(21)9-7-11)17-18(22)13-4-2-3-5-14(13)23-19(17)26-20(15)25-24-10/h6-9,16H,2-5H2,1H3,(H2,22,23)(H,24,25) IKJPPZCSGGZBSM-UHFFFAOYSA-N 50276092 CHEMBL4126059 Cholinesterase 11640 ChEMBL 10.1016/j.bmcl.2018.05.063 10.7270/Q2KP84N0 29887354 Derabli, C; Boualia, I; Abdelwahab, AB; Boulcina, R; Bensouici, C; Kirsch, G; Debache, A Fr£res Mentouri-Constantine University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276092 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276092&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145963563 405257374 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50968765 Cc1[nH]nc2Oc3nc4CCCCc4c(N)c3C(c12)c1ccc(Cl)cc1 InChI=1S/C20H19ClN4O/c1-10-15-16(11-6-8-12(21)9-7-11)17-18(22)13-4-2-3-5-14(13)23-19(17)26-20(15)25-24-10/h6-9,16H,2-5H2,1H3,(H2,22,23)(H,24,25) RTBXQTQOIYLQKP-UHFFFAOYSA-N 50276081 CHEMBL4127439 Cholinesterase >68150 ChEMBL 10.1016/j.bmcl.2018.05.063 10.7270/Q2KP84N0 29887354 Derabli, C; Boualia, I; Abdelwahab, AB; Boulcina, R; Bensouici, C; Kirsch, G; Debache, A Fr£res Mentouri-Constantine University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276081 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276081&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145960877 405257369 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50968766 Cc1[nH]nc2Oc3nc4CCCCc4c(N)c3C(c12)c1ccccc1 InChI=1S/C20H20N4O/c1-11-15-16(12-7-3-2-4-8-12)17-18(21)13-9-5-6-10-14(13)22-19(17)25-20(15)24-23-11/h2-4,7-8,16H,5-6,9-10H2,1H3,(H2,21,22)(H,23,24) OMYCYCMCFWGJPT-UHFFFAOYSA-N 50276093 CHEMBL4130026 Cholinesterase 36010 ChEMBL 10.1016/j.bmcl.2018.05.063 10.7270/Q2KP84N0 29887354 Derabli, C; Boualia, I; Abdelwahab, AB; Boulcina, R; Bensouici, C; Kirsch, G; Debache, A Fr£res Mentouri-Constantine University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276093 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276093&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145961388 405257375 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50969401 Cc1[nH]nc2Oc3nc4CCCCc4c(N)c3C(c12)c1ccc(cc1)[N+]([O-])=O InChI=1S/C20H19N5O3/c1-10-15-16(11-6-8-12(9-7-11)25(26)27)17-18(21)13-4-2-3-5-14(13)22-19(17)28-20(15)24-23-10/h6-9,16H,2-5H2,1H3,(H2,21,22)(H,23,24) DWZFMMTZDGIUCK-UHFFFAOYSA-N 50276159 CHEMBL4129883 Cholinesterase 2730 ChEMBL 10.1016/j.bmcl.2018.05.063 10.7270/Q2KP84N0 29887354 Derabli, C; Boualia, I; Abdelwahab, AB; Boulcina, R; Bensouici, C; Kirsch, G; Debache, A Fr£res Mentouri-Constantine University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50276159 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50276159&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145962672 405257410 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51122580 Clc1ccc(C(Cn2ccnc2)OCc2ccccc2)c(Cl)c1 InChI=1S/C18H16Cl2N2O/c19-15-6-7-16(17(20)10-15)18(11-22-9-8-21-13-22)23-12-14-4-2-1-3-5-14/h1-10,13,18H,11-12H2 CSENVQMNWOFZIZ-UHFFFAOYSA-N 50460218 CHEMBL2272315 Cholinesterase 18200 ChEMBL 10.1016/j.bmc.2018.02.014 10.7270/Q2M61NVQ 29475581 Lu, X; He, SY; Li, Q; Yang, H; Jiang, X; Lin, H; Chen, Y; Qu, W; Feng, F; Bian, Y; Zhou, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50460218 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50460218&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76334268 433927483 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51122582 Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)cc1 InChI=1S/C18H15Cl3N2O/c19-14-3-1-13(2-4-14)11-24-18(10-23-8-7-22-12-23)16-6-5-15(20)9-17(16)21/h1-9,12,18H,10-11H2 LEZWWPYKPKIXLL-UHFFFAOYSA-N 31773 ECONAZOLE::Econazole nitrate::Gyno-pevaryl::Pevaryl::cid_68589 Cholinesterase 17400 ChEMBL 10.1016/j.bmc.2018.02.014 10.7270/Q2M61NVQ 29475581 Lu, X; He, SY; Li, Q; Yang, H; Jiang, X; Lin, H; Chen, Y; Qu, W; Feng, F; Bian, Y; Zhou, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=31773 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=31773&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search ECL 6B5V,3JUS,7S8C,3R9C 3198 85240399 DB01127 C08068 ZINC00643055 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51122583 Cc1ccccc1COC(Cn1ccnc1)c1ccc(Cl)cc1Cl InChI=1S/C19H18Cl2N2O/c1-14-4-2-3-5-15(14)12-24-19(11-23-9-8-22-13-23)17-7-6-16(20)10-18(17)21/h2-10,13,19H,11-12H2,1H3 UVNCKBGWCASRKR-UHFFFAOYSA-N 50460220 CHEMBL4227497 Cholinesterase 18400 ChEMBL 10.1016/j.bmc.2018.02.014 10.7270/Q2M61NVQ 29475581 Lu, X; He, SY; Li, Q; Yang, H; Jiang, X; Lin, H; Chen, Y; Qu, W; Feng, F; Bian, Y; Zhou, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50460220 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50460220&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145969081 433927485 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51122590 Fc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)cc1 InChI=1S/C18H15Cl2FN2O/c19-14-3-6-16(17(20)9-14)18(10-23-8-7-22-12-23)24-11-13-1-4-15(21)5-2-13/h1-9,12,18H,10-11H2 YCLFWWKRZXZOEX-UHFFFAOYSA-N 50460224 CHEMBL4229031 Cholinesterase 14800 ChEMBL 10.1016/j.bmc.2018.02.014 10.7270/Q2M61NVQ 29475581 Lu, X; He, SY; Li, Q; Yang, H; Jiang, X; Lin, H; Chen, Y; Qu, W; Feng, F; Bian, Y; Zhou, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50460224 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50460224&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145989715 433927489 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51122591 CC(C)(C)c1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)cc1 InChI=1S/C22H24Cl2N2O/c1-22(2,3)17-6-4-16(5-7-17)14-27-21(13-26-11-10-25-15-26)19-9-8-18(23)12-20(19)24/h4-12,15,21H,13-14H2,1-3H3 JZTUKWPZYXUZMX-UHFFFAOYSA-N 50460221 CHEMBL4227820 Cholinesterase 46300 ChEMBL 10.1016/j.bmc.2018.02.014 10.7270/Q2M61NVQ 29475581 Lu, X; He, SY; Li, Q; Yang, H; Jiang, X; Lin, H; Chen, Y; Qu, W; Feng, F; Bian, Y; Zhou, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50460221 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50460221&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 487082 433927486 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51122592 Cc1cccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)c1 InChI=1S/C19H18Cl2N2O/c1-14-3-2-4-15(9-14)12-24-19(11-23-8-7-22-13-23)17-6-5-16(20)10-18(17)21/h2-10,13,19H,11-12H2,1H3 MFBKZWLALLZSEJ-UHFFFAOYSA-N 50460225 CHEMBL4225080 Cholinesterase 14600 ChEMBL 10.1016/j.bmc.2018.02.014 10.7270/Q2M61NVQ 29475581 Lu, X; He, SY; Li, Q; Yang, H; Jiang, X; Lin, H; Chen, Y; Qu, W; Feng, F; Bian, Y; Zhou, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50460225 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50460225&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145968756 433927490 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51122593 Cc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)cc1C InChI=1S/C20H20Cl2N2O/c1-14-3-4-16(9-15(14)2)12-25-20(11-24-8-7-23-13-24)18-6-5-17(21)10-19(18)22/h3-10,13,20H,11-12H2,1-2H3 YFHOTBFQRIYBID-UHFFFAOYSA-N 50460226 CHEMBL4228340 Cholinesterase 11200 ChEMBL 10.1016/j.bmc.2018.02.014 10.7270/Q2M61NVQ 29475581 Lu, X; He, SY; Li, Q; Yang, H; Jiang, X; Lin, H; Chen, Y; Qu, W; Feng, F; Bian, Y; Zhou, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50460226 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50460226&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145967730 433927491 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51122594 COc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)cc1 InChI=1S/C19H18Cl2N2O2/c1-24-16-5-2-14(3-6-16)12-25-19(11-23-9-8-22-13-23)17-7-4-15(20)10-18(17)21/h2-10,13,19H,11-12H2,1H3 KHOYJMNYQSPWLL-UHFFFAOYSA-N 50460227 CHEMBL4228284 Cholinesterase 16500 ChEMBL 10.1016/j.bmc.2018.02.014 10.7270/Q2M61NVQ 29475581 Lu, X; He, SY; Li, Q; Yang, H; Jiang, X; Lin, H; Chen, Y; Qu, W; Feng, F; Bian, Y; Zhou, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50460227 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50460227&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 58693509 433927492 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51122595 Fc1cccc(F)c1COC(Cn1ccnc1)c1ccc(Cl)cc1Cl InChI=1S/C18H14Cl2F2N2O/c19-12-4-5-13(15(20)8-12)18(9-24-7-6-23-11-24)25-10-14-16(21)2-1-3-17(14)22/h1-8,11,18H,9-10H2 ONDJDDDEAWTCMB-UHFFFAOYSA-N 50460223 CHEMBL4226048 Cholinesterase 19200 ChEMBL 10.1016/j.bmc.2018.02.014 10.7270/Q2M61NVQ 29475581 Lu, X; He, SY; Li, Q; Yang, H; Jiang, X; Lin, H; Chen, Y; Qu, W; Feng, F; Bian, Y; Zhou, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50460223 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50460223&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145968804 433927488 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51122596 Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)c(Cl)c1 InChI=1S/C18H14Cl4N2O/c19-13-2-1-12(16(21)7-13)10-25-18(9-24-6-5-23-11-24)15-4-3-14(20)8-17(15)22/h1-8,11,18H,9-10H2 BYBLEWFAAKGYCD-UHFFFAOYSA-N 31772 1-[2-(2,4-dichlorobenzyl)oxy-2-(2,4-dichlorophenyl)ethyl]imidazole;nitric acid::Brentan::CHEMBL91::Dactarin::Miconazole::US9138393, Miconazole Nitrate::US9144538, Miconazole Nitrate::cid_4189 Cholinesterase 6800 ChEMBL 10.1016/j.bmc.2018.02.014 10.7270/Q2M61NVQ 29475581 Lu, X; He, SY; Li, Q; Yang, H; Jiang, X; Lin, H; Chen, Y; Qu, W; Feng, F; Bian, Y; Zhou, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=31772 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=31772&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search X89 3OZU 4189 85240398 6923 CHEMBL91 DB01110 2449 C08070 ZINC00896740 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51122606 Clc1ccc(C(Cn2ccnc2)OCc2ccc(Br)cc2)c(Cl)c1 InChI=1S/C18H15BrCl2N2O/c19-14-3-1-13(2-4-14)11-24-18(10-23-8-7-22-12-23)16-6-5-15(20)9-17(16)21/h1-9,12,18H,10-11H2 MTJAXRJQQMHEOA-UHFFFAOYSA-N 50460217 CHEMBL4226970 Cholinesterase 13100 ChEMBL 10.1016/j.bmc.2018.02.014 10.7270/Q2M61NVQ 29475581 Lu, X; He, SY; Li, Q; Yang, H; Jiang, X; Lin, H; Chen, Y; Qu, W; Feng, F; Bian, Y; Zhou, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50460217 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50460217&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145969967 433927482 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51122609 Cc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)cc1 InChI=1S/C19H18Cl2N2O/c1-14-2-4-15(5-3-14)12-24-19(11-23-9-8-22-13-23)17-7-6-16(20)10-18(17)21/h2-10,13,19H,11-12H2,1H3 JYHRPGPKUARAOF-UHFFFAOYSA-N 50460219 CHEMBL4227760 Cholinesterase 10900 ChEMBL 10.1016/j.bmc.2018.02.014 10.7270/Q2M61NVQ 29475581 Lu, X; He, SY; Li, Q; Yang, H; Jiang, X; Lin, H; Chen, Y; Qu, W; Feng, F; Bian, Y; Zhou, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50460219 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50460219&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3028808 433927484 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51122610 COc1cccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)c1 InChI=1S/C19H18Cl2N2O2/c1-24-16-4-2-3-14(9-16)12-25-19(11-23-8-7-22-13-23)17-6-5-15(20)10-18(17)21/h2-10,13,19H,11-12H2,1H3 QRFIASHLIJORNJ-UHFFFAOYSA-N 50460222 CHEMBL4229113 Cholinesterase 8300 ChEMBL 10.1016/j.bmc.2018.02.014 10.7270/Q2M61NVQ 29475581 Lu, X; He, SY; Li, Q; Yang, H; Jiang, X; Lin, H; Chen, Y; Qu, W; Feng, F; Bian, Y; Zhou, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50460222 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50460222&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145989048 433927487 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51122330 COc1cc(cc(OC)c1OC)-c1nc(c([nH]1)-c1ccccc1)-c1ccccc1 InChI=1S/C24H22N2O3/c1-27-19-14-18(15-20(28-2)23(19)29-3)24-25-21(16-10-6-4-7-11-16)22(26-24)17-12-8-5-9-13-17/h4-15H,1-3H3,(H,25,26) PWMSYGNENFVGRM-UHFFFAOYSA-N 50460099 CHEMBL601724::SJ000290330 Cholinesterase 4990 ChEMBL 10.1016/j.bmc.2018.01.029 10.7270/Q21G0PWP 29429576 Gurjar, AS; Darekar, MN; Yeong, KY; Ooi, L Prin. K. M. Kundnani College of Pharmacy http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50460099 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50460099&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1089848 433927364 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51122331 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 3310 ChEMBL 10.1016/j.bmc.2018.01.029 10.7270/Q21G0PWP 29429576 Gurjar, AS; Darekar, MN; Yeong, KY; Ooi, L Prin. K. M. Kundnani College of Pharmacy http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116784 Clc1ccc(NC(=[Se])NCCCCCCNc2c3CCCCc3nc3ccccc23)cc1 InChI=1S/C26H31ClN4Se/c27-19-13-15-20(16-14-19)30-26(32)29-18-8-2-1-7-17-28-25-21-9-3-5-11-23(21)31-24-12-6-4-10-22(24)25/h3,5,9,11,13-16H,1-2,4,6-8,10,12,17-18H2,(H,28,31)(H2,29,30,32) AHQGXNOGLWRAMH-UHFFFAOYSA-N 50456701 CHEMBL4218651 Cholinesterase 37 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456701 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456701&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145970529 433923968 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116786 C(CCNc1c2CCCCc2nc2ccccc12)CC[Se]CCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C36H46N4Se/c1(11-23-37-35-27-15-3-7-19-31(27)39-32-20-8-4-16-28(32)35)13-25-41-26-14-2-12-24-38-36-29-17-5-9-21-33(29)40-34-22-10-6-18-30(34)36/h3,5,7,9,15,17,19,21H,1-2,4,6,8,10-14,16,18,20,22-26H2,(H,37,39)(H,38,40) RFJOKGIIFYOSLX-UHFFFAOYSA-N 50456702 CHEMBL4213042 Cholinesterase 41 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456702 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456702&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145967473 433923969 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116787 N#CSCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C20H25N3S/c21-15-24-14-8-2-1-7-13-22-20-16-9-3-5-11-18(16)23-19-12-6-4-10-17(19)20/h3,5,9,11H,1-2,4,6-8,10,12-14H2,(H,22,23) MMPNVOZVVJPJMK-UHFFFAOYSA-N 50456703 CHEMBL4209181 Cholinesterase 252 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456703 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456703&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145965874 433923970 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116791 C(CCNc1c2CCCCc2nc2ccccc12)CC[Se]CCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C36H46N4Se/c1(11-23-37-35-27-15-3-7-19-31(27)39-32-20-8-4-16-28(32)35)13-25-41-26-14-2-12-24-38-36-29-17-5-9-21-33(29)40-34-22-10-6-18-30(34)36/h3,5,7,9,15,17,19,21H,1-2,4,6,8,10-14,16,18,20,22-26H2,(H,37,39)(H,38,40) RFJOKGIIFYOSLX-UHFFFAOYSA-N 50456702 CHEMBL4213042 Cholinesterase 150 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456702 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456702&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145967473 433923969 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116792 N#C[Se]CCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C19H23N3Se/c20-14-23-13-7-1-6-12-21-19-15-8-2-4-10-17(15)22-18-11-5-3-9-16(18)19/h2,4,8,10H,1,3,5-7,9,11-13H2,(H,21,22) AJTMZVVUIMONJA-UHFFFAOYSA-N 50456707 CHEMBL4209322 Cholinesterase 206 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456707 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456707&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145964262 433923974 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116793 N#CSCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C19H23N3S/c20-14-23-13-7-1-6-12-21-19-15-8-2-4-10-17(15)22-18-11-5-3-9-16(18)19/h2,4,8,10H,1,3,5-7,9,11-13H2,(H,21,22) CGYJDWIDGOEQQA-UHFFFAOYSA-N 50456704 CHEMBL4208896 Cholinesterase 228 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456704 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456704&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145964919 433923971 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116797 COc1ccc(NC(=[Se])NCCCCCCNc2c3CCCCc3nc3ccccc23)cc1 InChI=1S/C27H34N4OSe/c1-32-21-16-14-20(15-17-21)30-27(33)29-19-9-3-2-8-18-28-26-22-10-4-6-12-24(22)31-25-13-7-5-11-23(25)26/h4,6,10,12,14-17H,2-3,5,7-9,11,13,18-19H2,1H3,(H,28,31)(H2,29,30,33) WCARDEWIWVIDSP-UHFFFAOYSA-N 50456709 CHEMBL4205454 Cholinesterase 29 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456709 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456709&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145977108 433923976 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116798 C(CCC[Se]c1ccccc1)CCNc1c2CCCCc2nc2ccccc12 InChI=1S/C25H30N2Se/c1(2-11-19-28-20-12-4-3-5-13-20)10-18-26-25-21-14-6-8-16-23(21)27-24-17-9-7-15-22(24)25/h3-6,8,12-14,16H,1-2,7,9-11,15,17-19H2,(H,26,27) XMDLSKASKATOJI-UHFFFAOYSA-N 50456706 CHEMBL4217176 Cholinesterase 57 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456706 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456706&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145974486 433923973 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116799 Cc1ccc(NC(=[Se])NCCCCCCNc2c3CCCCc3nc3ccccc23)cc1 InChI=1S/C27H34N4Se/c1-20-14-16-21(17-15-20)30-27(32)29-19-9-3-2-8-18-28-26-22-10-4-6-12-24(22)31-25-13-7-5-11-23(25)26/h4,6,10,12,14-17H,2-3,5,7-9,11,13,18-19H2,1H3,(H,28,31)(H2,29,30,32) GCMCSVGUGUDELR-UHFFFAOYSA-N 50456710 CHEMBL4213722 Cholinesterase 11 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456710 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456710&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145966534 433923977 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116800 C(CCC[Se]c1ccccc1)CCNc1c2CCCCc2nc2ccccc12 InChI=1S/C25H30N2Se/c1(2-11-19-28-20-12-4-3-5-13-20)10-18-26-25-21-14-6-8-16-23(21)27-24-17-9-7-15-22(24)25/h3-6,8,12-14,16H,1-2,7,9-11,15,17-19H2,(H,26,27) XMDLSKASKATOJI-UHFFFAOYSA-N 50456706 CHEMBL4217176 Cholinesterase 57 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456706 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456706&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145974486 433923973 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116801 C(CCNc1c2CCCCc2nc2ccccc12)CCSSCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C36H46N4S2/c1(11-23-37-35-27-15-3-7-19-31(27)39-32-20-8-4-16-28(32)35)13-25-41-42-26-14-2-12-24-38-36-29-17-5-9-21-33(29)40-34-22-10-6-18-30(34)36/h3,5,7,9,15,17,19,21H,1-2,4,6,8,10-14,16,18,20,22-26H2,(H,37,39)(H,38,40) CSHQXRFENGZQAM-UHFFFAOYSA-N 50456711 CHEMBL4208641 Cholinesterase 422 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456711 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456711&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145965386 433923978 C15496 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116802 N#CSCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C20H25N3S/c21-15-24-14-8-2-1-7-13-22-20-16-9-3-5-11-18(16)23-19-12-6-4-10-17(19)20/h3,5,9,11H,1-2,4,6-8,10,12-14H2,(H,22,23) MMPNVOZVVJPJMK-UHFFFAOYSA-N 50456703 CHEMBL4209181 Cholinesterase 673 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456703 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456703&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145965874 433923970 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116803 N#C[Se]CCCCCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C26H37N3Se/c27-21-30-20-14-8-6-4-2-1-3-5-7-13-19-28-26-22-15-9-11-17-24(22)29-25-18-12-10-16-23(25)26/h9,11,15,17H,1-8,10,12-14,16,18-20H2,(H,28,29) SDXFBJMDKNBGSN-UHFFFAOYSA-N 50456712 CHEMBL4204015 Cholinesterase 326 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456712 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456712&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145976801 433923979 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116804 N#C[Se]CCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C20H25N3Se/c21-15-24-14-8-2-1-7-13-22-20-16-9-3-5-11-18(16)23-19-12-6-4-10-17(19)20/h3,5,9,11H,1-2,4,6-8,10,12-14H2,(H,22,23) SSDPRLZRABLZQC-UHFFFAOYSA-N 50456713 CHEMBL4214235 Cholinesterase 672 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456713 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456713&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145972968 433923980 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116805 C(CCCSSCCCCCCNc1c2CCCCc2nc2ccccc12)CCNc1c2CCCCc2nc2ccccc12 InChI=1S/C38H50N4S2/c1(13-25-39-37-29-17-5-9-21-33(29)41-34-22-10-6-18-30(34)37)3-15-27-43-44-28-16-4-2-14-26-40-38-31-19-7-11-23-35(31)42-36-24-12-8-20-32(36)38/h5,7,9,11,17,19,21,23H,1-4,6,8,10,12-16,18,20,22,24-28H2,(H,39,41)(H,40,42) OKDAARBXBBTTDH-UHFFFAOYSA-N 50456714 CHEMBL4217969 Cholinesterase 243 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456714 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456714&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145968226 433923981 C15496 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116806 C(CCNc1c2CCCCc2nc2ccccc12)CCSSCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C36H46N4S2/c1(11-23-37-35-27-15-3-7-19-31(27)39-32-20-8-4-16-28(32)35)13-25-41-42-26-14-2-12-24-38-36-29-17-5-9-21-33(29)40-34-22-10-6-18-30(34)36/h3,5,7,9,15,17,19,21H,1-2,4,6,8,10-14,16,18,20,22-26H2,(H,37,39)(H,38,40) CSHQXRFENGZQAM-UHFFFAOYSA-N 50456711 CHEMBL4208641 Cholinesterase 166 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456711 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456711&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145965386 433923978 C15496 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116807 N#C[Se]CCCCCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C26H37N3Se/c27-21-30-20-14-8-6-4-2-1-3-5-7-13-19-28-26-22-15-9-11-17-24(22)29-25-18-12-10-16-23(25)26/h9,11,15,17H,1-8,10,12-14,16,18-20H2,(H,28,29) SDXFBJMDKNBGSN-UHFFFAOYSA-N 50456712 CHEMBL4204015 Cholinesterase 231 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456712 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456712&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145976801 433923979 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116808 N#C[Se]CCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C20H25N3Se/c21-15-24-14-8-2-1-7-13-22-20-16-9-3-5-11-18(16)23-19-12-6-4-10-17(19)20/h3,5,9,11H,1-2,4,6-8,10,12-14H2,(H,22,23) SSDPRLZRABLZQC-UHFFFAOYSA-N 50456713 CHEMBL4214235 Cholinesterase 336 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456713 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456713&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145972968 433923980 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116809 O=C(C[Se]c1ccccc1)Nc1c2CCCCc2nc2ccccc12 InChI=1S/C21H20N2OSe/c24-20(14-25-15-8-2-1-3-9-15)23-21-16-10-4-6-12-18(16)22-19-13-7-5-11-17(19)21/h1-4,6,8-10,12H,5,7,11,13-14H2,(H,22,23,24) WKOIAZMVZIDTSH-UHFFFAOYSA-N 50456705 CHEMBL4209832 Cholinesterase 518 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456705 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456705&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145966612 433923972 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116822 C(CCCSSCCCCCCNc1c2CCCCc2nc2ccccc12)CCNc1c2CCCCc2nc2ccccc12 InChI=1S/C38H50N4S2/c1(13-25-39-37-29-17-5-9-21-33(29)41-34-22-10-6-18-30(34)37)3-15-27-43-44-28-16-4-2-14-26-40-38-31-19-7-11-23-35(31)42-36-24-12-8-20-32(36)38/h5,7,9,11,17,19,21,23H,1-4,6,8,10,12-16,18,20,22,24-28H2,(H,39,41)(H,40,42) OKDAARBXBBTTDH-UHFFFAOYSA-N 50456714 CHEMBL4217969 Cholinesterase 70 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456714 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456714&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145968226 433923981 C15496 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116827 C(CCC[Se][Se]CCCCCCNc1c2CCCCc2nc2ccccc12)CCNc1c2CCCCc2nc2ccccc12 InChI=1S/C38H50N4Se2/c1(13-25-39-37-29-17-5-9-21-33(29)41-34-22-10-6-18-30(34)37)3-15-27-43-44-28-16-4-2-14-26-40-38-31-19-7-11-23-35(31)42-36-24-12-8-20-32(36)38/h5,7,9,11,17,19,21,23H,1-4,6,8,10,12-16,18,20,22,24-28H2,(H,39,41)(H,40,42) BOTNTWZLTLBAIF-UHFFFAOYSA-N 50456715 CHEMBL4213577 Cholinesterase 73 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456715 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456715&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145967250 433923982 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116828 C(CCNc1c2CCCCc2nc2ccccc12)CC[Se][Se]CCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C36H46N4Se2/c1(11-23-37-35-27-15-3-7-19-31(27)39-32-20-8-4-16-28(32)35)13-25-41-42-26-14-2-12-24-38-36-29-17-5-9-21-33(29)40-34-22-10-6-18-30(34)36/h3,5,7,9,15,17,19,21H,1-2,4,6,8,10-14,16,18,20,22-26H2,(H,37,39)(H,38,40) QUFGTPYSVLYXQC-UHFFFAOYSA-N 50456708 CHEMBL4204315 Cholinesterase 350 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456708 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456708&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145977052 433923975 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116832 O=C(C[Se]c1ccccc1)Nc1c2CCCCc2nc2ccccc12 InChI=1S/C21H20N2OSe/c24-20(14-25-15-8-2-1-3-9-15)23-21-16-10-4-6-12-18(16)22-19-13-7-5-11-17(19)21/h1-4,6,8-10,12H,5,7,11,13-14H2,(H,22,23,24) WKOIAZMVZIDTSH-UHFFFAOYSA-N 50456705 CHEMBL4209832 Cholinesterase 1708 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456705 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456705&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145966612 433923972 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116833 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 17 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116835 Cc1ccc(NC(=[Se])NCCCCCCNc2c3CCCCc3nc3ccccc23)cc1 InChI=1S/C27H34N4Se/c1-20-14-16-21(17-15-20)30-27(32)29-19-9-3-2-8-18-28-26-22-10-4-6-12-24(22)31-25-13-7-5-11-23(25)26/h4,6,10,12,14-17H,2-3,5,7-9,11,13,18-19H2,1H3,(H,28,31)(H2,29,30,32) GCMCSVGUGUDELR-UHFFFAOYSA-N 50456710 CHEMBL4213722 Cholinesterase 11 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456710 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456710&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145966534 433923977 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116836 COc1ccc(NC(=[Se])NCCCCCCNc2c3CCCCc3nc3ccccc23)cc1 InChI=1S/C27H34N4OSe/c1-32-21-16-14-20(15-17-21)30-27(33)29-19-9-3-2-8-18-28-26-22-10-4-6-12-24(22)31-25-13-7-5-11-23(25)26/h4,6,10,12,14-17H,2-3,5,7-9,11,13,18-19H2,1H3,(H,28,31)(H2,29,30,33) WCARDEWIWVIDSP-UHFFFAOYSA-N 50456709 CHEMBL4205454 Cholinesterase 29 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456709 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456709&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145977108 433923976 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116837 C(CCNc1c2CCCCc2nc2ccccc12)CC[Se][Se]CCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C36H46N4Se2/c1(11-23-37-35-27-15-3-7-19-31(27)39-32-20-8-4-16-28(32)35)13-25-41-42-26-14-2-12-24-38-36-29-17-5-9-21-33(29)40-34-22-10-6-18-30(34)36/h3,5,7,9,15,17,19,21H,1-2,4,6,8,10-14,16,18,20,22-26H2,(H,37,39)(H,38,40) QUFGTPYSVLYXQC-UHFFFAOYSA-N 50456708 CHEMBL4204315 Cholinesterase 92 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456708 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456708&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145977052 433923975 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116838 Clc1ccc(NC(=[Se])NCCCCCCNc2c3CCCCc3nc3ccccc23)cc1 InChI=1S/C26H31ClN4Se/c27-19-13-15-20(16-14-19)30-26(32)29-18-8-2-1-7-17-28-25-21-9-3-5-11-23(21)31-24-12-6-4-10-22(24)25/h3,5,9,11,13-16H,1-2,4,6-8,10,12,17-18H2,(H,28,31)(H2,29,30,32) AHQGXNOGLWRAMH-UHFFFAOYSA-N 50456701 CHEMBL4218651 Cholinesterase 15 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456701 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456701&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145970529 433923968 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116839 C(CCC[Se][Se]CCCCCCNc1c2CCCCc2nc2ccccc12)CCNc1c2CCCCc2nc2ccccc12 InChI=1S/C38H50N4Se2/c1(13-25-39-37-29-17-5-9-21-33(29)41-34-22-10-6-18-30(34)37)3-15-27-43-44-28-16-4-2-14-26-40-38-31-19-7-11-23-35(31)42-36-24-12-8-20-32(36)38/h5,7,9,11,17,19,21,23H,1-4,6,8,10,12-16,18,20,22,24-28H2,(H,39,41)(H,40,42) BOTNTWZLTLBAIF-UHFFFAOYSA-N 50456715 CHEMBL4213577 Cholinesterase 43 ChEMBL 10.1016/j.ejmech.2017.06.048 10.7270/Q2CV4MCJ 28728108 Roldán-Peña, JM; Alejandre-Ramos, D; López, Ó; Maya, I; Lagunes, I; Padrón, JM; Peña-Altamira, LE; Bartolini, M; Monti, B; Bolognesi, ML; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456715 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456715&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145967250 433923982 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117847 Nc1c2C(c3ccc(Br)cc3)n3n(-c2nc2CCCCc12)c(=O)c1ccccc1c3=O InChI=1S/C24H19BrN4O2/c25-14-11-9-13(10-12-14)21-19-20(26)17-7-3-4-8-18(17)27-22(19)29-24(31)16-6-2-1-5-15(16)23(30)28(21)29/h1-2,5-6,9-12,21H,3-4,7-8H2,(H2,26,27) NJJVXEXERSQKAY-UHFFFAOYSA-N 50457014 CHEMBL4203040 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2017.07.072 10.7270/Q2SX6GVB 28803044 Jalili-Baleh, L; Nadri, H; Moradi, A; Bukhari, SNA; Shakibaie, M; Jafari, M; Golshani, M; Homayouni Moghadam, F; Firoozpour, L; Asadipour, A; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457014 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457014&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145976255 433924281 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117848 Nc1c2C(c3ccc(Cl)cc3)n3n(-c2nc2CCCCc12)c(=O)c1ccccc1c3=O InChI=1S/C24H19ClN4O2/c25-14-11-9-13(10-12-14)21-19-20(26)17-7-3-4-8-18(17)27-22(19)29-24(31)16-6-2-1-5-15(16)23(30)28(21)29/h1-2,5-6,9-12,21H,3-4,7-8H2,(H2,26,27) SYOXVCZFGRBDJP-UHFFFAOYSA-N 50457015 CHEMBL4203173 Cholinesterase 96200 ChEMBL 10.1016/j.ejmech.2017.07.072 10.7270/Q2SX6GVB 28803044 Jalili-Baleh, L; Nadri, H; Moradi, A; Bukhari, SNA; Shakibaie, M; Jafari, M; Golshani, M; Homayouni Moghadam, F; Firoozpour, L; Asadipour, A; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457015 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457015&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145977994 433924282 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117851 CCCC1c2c(nc3CCCCc3c2N)-n2n1c(=O)c1ccccc1c2=O InChI=1S/C21H22N4O2/c1-2-7-16-17-18(22)14-10-5-6-11-15(14)23-19(17)25-21(27)13-9-4-3-8-12(13)20(26)24(16)25/h3-4,8-9,16H,2,5-7,10-11H2,1H3,(H2,22,23) BSRJYCLMXUYJMR-UHFFFAOYSA-N 50457018 CHEMBL4211075 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2017.07.072 10.7270/Q2SX6GVB 28803044 Jalili-Baleh, L; Nadri, H; Moradi, A; Bukhari, SNA; Shakibaie, M; Jafari, M; Golshani, M; Homayouni Moghadam, F; Firoozpour, L; Asadipour, A; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457018 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457018&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145966665 433924285 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117852 Nc1c2C(c3ccccc3F)n3n(-c2nc2CCCCc12)c(=O)c1ccccc1c3=O InChI=1S/C24H19FN4O2/c25-17-11-5-3-9-15(17)21-19-20(26)16-10-4-6-12-18(16)27-22(19)29-24(31)14-8-2-1-7-13(14)23(30)28(21)29/h1-3,5,7-9,11,21H,4,6,10,12H2,(H2,26,27) RGXXADQJFPKXFQ-UHFFFAOYSA-N 50457019 CHEMBL4207471 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2017.07.072 10.7270/Q2SX6GVB 28803044 Jalili-Baleh, L; Nadri, H; Moradi, A; Bukhari, SNA; Shakibaie, M; Jafari, M; Golshani, M; Homayouni Moghadam, F; Firoozpour, L; Asadipour, A; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457019 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457019&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145977191 433924286 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117853 Nc1c2C(c3ccccc3)n3n(-c2nc2CCCCc12)c(=O)c1ccccc1c3=O InChI=1S/C24H20N4O2/c25-20-17-12-6-7-13-18(17)26-22-19(20)21(14-8-2-1-3-9-14)27-23(29)15-10-4-5-11-16(15)24(30)28(22)27/h1-5,8-11,21H,6-7,12-13H2,(H2,25,26) FNIOZLJCIUGPPF-UHFFFAOYSA-N 50457020 CHEMBL4216504 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2017.07.072 10.7270/Q2SX6GVB 28803044 Jalili-Baleh, L; Nadri, H; Moradi, A; Bukhari, SNA; Shakibaie, M; Jafari, M; Golshani, M; Homayouni Moghadam, F; Firoozpour, L; Asadipour, A; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457020 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457020&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145974918 433924287 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117867 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 13 ChEMBL 10.1016/j.ejmech.2017.07.072 10.7270/Q2SX6GVB 28803044 Jalili-Baleh, L; Nadri, H; Moradi, A; Bukhari, SNA; Shakibaie, M; Jafari, M; Golshani, M; Homayouni Moghadam, F; Firoozpour, L; Asadipour, A; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117868 CC1c2c(nc3CCCCc3c2N)-n2n1c(=O)c1ccccc1c2=O InChI=1S/C19H18N4O2/c1-10-15-16(20)13-8-4-5-9-14(13)21-17(15)23-19(25)12-7-3-2-6-11(12)18(24)22(10)23/h2-3,6-7,10H,4-5,8-9H2,1H3,(H2,20,21) LKYKTXQIBVXYTH-UHFFFAOYSA-N 50457017 CHEMBL4208227 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2017.07.072 10.7270/Q2SX6GVB 28803044 Jalili-Baleh, L; Nadri, H; Moradi, A; Bukhari, SNA; Shakibaie, M; Jafari, M; Golshani, M; Homayouni Moghadam, F; Firoozpour, L; Asadipour, A; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457017 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457017&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145975019 433924284 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117869 Nc1c2C(c3cccc(O)c3)n3n(-c2nc2CCCCc12)c(=O)c1ccccc1c3=O InChI=1S/C24H20N4O3/c25-20-17-10-3-4-11-18(17)26-22-19(20)21(13-6-5-7-14(29)12-13)27-23(30)15-8-1-2-9-16(15)24(31)28(22)27/h1-2,5-9,12,21,29H,3-4,10-11H2,(H2,25,26) WHAINPZSBJNYNQ-UHFFFAOYSA-N 50457030 CHEMBL4206121 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2017.07.072 10.7270/Q2SX6GVB 28803044 Jalili-Baleh, L; Nadri, H; Moradi, A; Bukhari, SNA; Shakibaie, M; Jafari, M; Golshani, M; Homayouni Moghadam, F; Firoozpour, L; Asadipour, A; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457030 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457030&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145977641 433924297 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117870 Nc1c2C(c3cccc(F)c3)n3n(-c2nc2CCCCc12)c(=O)c1ccccc1c3=O InChI=1S/C24H19FN4O2/c25-14-7-5-6-13(12-14)21-19-20(26)17-10-3-4-11-18(17)27-22(19)29-24(31)16-9-2-1-8-15(16)23(30)28(21)29/h1-2,5-9,12,21H,3-4,10-11H2,(H2,26,27) URFUSBSIPDQEGU-UHFFFAOYSA-N 50457026 CHEMBL4207023 Cholinesterase 37200 ChEMBL 10.1016/j.ejmech.2017.07.072 10.7270/Q2SX6GVB 28803044 Jalili-Baleh, L; Nadri, H; Moradi, A; Bukhari, SNA; Shakibaie, M; Jafari, M; Golshani, M; Homayouni Moghadam, F; Firoozpour, L; Asadipour, A; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457026 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457026&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145977913 433924293 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117871 COc1cc(OC)cc(c1)C1c2c(nc3CCCCc3c2N)-n2n1c(=O)c1ccccc1c2=O InChI=1S/C26H24N4O4/c1-33-15-11-14(12-16(13-15)34-2)23-21-22(27)19-9-5-6-10-20(19)28-24(21)30-26(32)18-8-4-3-7-17(18)25(31)29(23)30/h3-4,7-8,11-13,23H,5-6,9-10H2,1-2H3,(H2,27,28) IVSXLKSALNOPES-UHFFFAOYSA-N 50457031 CHEMBL4216769 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2017.07.072 10.7270/Q2SX6GVB 28803044 Jalili-Baleh, L; Nadri, H; Moradi, A; Bukhari, SNA; Shakibaie, M; Jafari, M; Golshani, M; Homayouni Moghadam, F; Firoozpour, L; Asadipour, A; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457031 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457031&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145972138 433924298 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117872 COc1ccccc1C1c2c(nc3CCCCc3c2N)-n2n1c(=O)c1ccccc1c2=O InChI=1S/C25H22N4O3/c1-32-19-13-7-5-11-17(19)22-20-21(26)16-10-4-6-12-18(16)27-23(20)29-25(31)15-9-3-2-8-14(15)24(30)28(22)29/h2-3,5,7-9,11,13,22H,4,6,10,12H2,1H3,(H2,26,27) TWHPNYFELJDTTN-UHFFFAOYSA-N 50457028 CHEMBL4218303 Cholinesterase 93280 ChEMBL 10.1016/j.ejmech.2017.07.072 10.7270/Q2SX6GVB 28803044 Jalili-Baleh, L; Nadri, H; Moradi, A; Bukhari, SNA; Shakibaie, M; Jafari, M; Golshani, M; Homayouni Moghadam, F; Firoozpour, L; Asadipour, A; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457028 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457028&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145970761 433924295 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117873 Nc1c2C(c3ccccc3Br)n3n(-c2nc2CCCCc12)c(=O)c1ccccc1c3=O InChI=1S/C24H19BrN4O2/c25-17-11-5-3-9-15(17)21-19-20(26)16-10-4-6-12-18(16)27-22(19)29-24(31)14-8-2-1-7-13(14)23(30)28(21)29/h1-3,5,7-9,11,21H,4,6,10,12H2,(H2,26,27) DWKRDIXAGYAASJ-UHFFFAOYSA-N 50457016 CHEMBL4210767 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2017.07.072 10.7270/Q2SX6GVB 28803044 Jalili-Baleh, L; Nadri, H; Moradi, A; Bukhari, SNA; Shakibaie, M; Jafari, M; Golshani, M; Homayouni Moghadam, F; Firoozpour, L; Asadipour, A; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457016 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457016&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145965233 433924283 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117874 Nc1c2C(c3ccccc3Cl)n3n(-c2nc2CCCCc12)c(=O)c1ccccc1c3=O InChI=1S/C24H19ClN4O2/c25-17-11-5-3-9-15(17)21-19-20(26)16-10-4-6-12-18(16)27-22(19)29-24(31)14-8-2-1-7-13(14)23(30)28(21)29/h1-3,5,7-9,11,21H,4,6,10,12H2,(H2,26,27) JLGSTYJZLURPGJ-UHFFFAOYSA-N 50457022 CHEMBL4208973 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2017.07.072 10.7270/Q2SX6GVB 28803044 Jalili-Baleh, L; Nadri, H; Moradi, A; Bukhari, SNA; Shakibaie, M; Jafari, M; Golshani, M; Homayouni Moghadam, F; Firoozpour, L; Asadipour, A; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457022 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457022&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145964483 433924289 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117875 Nc1c2C(c3ccc(cc3)[N+]([O-])=O)n3n(-c2nc2CCCCc12)c(=O)c1ccccc1c3=O InChI=1S/C24H19N5O4/c25-20-17-7-3-4-8-18(17)26-22-19(20)21(13-9-11-14(12-10-13)29(32)33)27-23(30)15-5-1-2-6-16(15)24(31)28(22)27/h1-2,5-6,9-12,21H,3-4,7-8H2,(H2,25,26) XUOCWVHCSSTTNV-UHFFFAOYSA-N 50457032 CHEMBL4212290 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2017.07.072 10.7270/Q2SX6GVB 28803044 Jalili-Baleh, L; Nadri, H; Moradi, A; Bukhari, SNA; Shakibaie, M; Jafari, M; Golshani, M; Homayouni Moghadam, F; Firoozpour, L; Asadipour, A; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457032 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457032&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145965536 433924299 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117876 Nc1c2C(c3ccc(F)cc3)n3n(-c2nc2CCCCc12)c(=O)c1ccccc1c3=O InChI=1S/C24H19FN4O2/c25-14-11-9-13(10-12-14)21-19-20(26)17-7-3-4-8-18(17)27-22(19)29-24(31)16-6-2-1-5-15(16)23(30)28(21)29/h1-2,5-6,9-12,21H,3-4,7-8H2,(H2,26,27) YMIZCEJFPBPANM-UHFFFAOYSA-N 50457024 CHEMBL4207926 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2017.07.072 10.7270/Q2SX6GVB 28803044 Jalili-Baleh, L; Nadri, H; Moradi, A; Bukhari, SNA; Shakibaie, M; Jafari, M; Golshani, M; Homayouni Moghadam, F; Firoozpour, L; Asadipour, A; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457024 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457024&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145975240 433924291 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117878 Cc1cccc(c1)C1c2c(nc3CCCCc3c2N)-n2n1c(=O)c1ccccc1c2=O InChI=1S/C25H22N4O2/c1-14-7-6-8-15(13-14)22-20-21(26)18-11-4-5-12-19(18)27-23(20)29-25(31)17-10-3-2-9-16(17)24(30)28(22)29/h2-3,6-10,13,22H,4-5,11-12H2,1H3,(H2,26,27) RTXZUXYMDTUCCC-UHFFFAOYSA-N 50457013 CHEMBL4213928 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2017.07.072 10.7270/Q2SX6GVB 28803044 Jalili-Baleh, L; Nadri, H; Moradi, A; Bukhari, SNA; Shakibaie, M; Jafari, M; Golshani, M; Homayouni Moghadam, F; Firoozpour, L; Asadipour, A; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457013 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457013&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145964448 433924280 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117879 Cc1ccccc1C1c2c(nc3CCCCc3c2N)-n2n1c(=O)c1ccccc1c2=O InChI=1S/C25H22N4O2/c1-14-8-2-3-9-15(14)22-20-21(26)18-12-6-7-13-19(18)27-23(20)29-25(31)17-11-5-4-10-16(17)24(30)28(22)29/h2-5,8-11,22H,6-7,12-13H2,1H3,(H2,26,27) LUQGMCFATGXFJD-UHFFFAOYSA-N 50457033 CHEMBL4204269 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2017.07.072 10.7270/Q2SX6GVB 28803044 Jalili-Baleh, L; Nadri, H; Moradi, A; Bukhari, SNA; Shakibaie, M; Jafari, M; Golshani, M; Homayouni Moghadam, F; Firoozpour, L; Asadipour, A; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457033 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457033&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145975324 433924300 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117880 Nc1c2C(c3cccc(c3)[N+]([O-])=O)n3n(-c2nc2CCCCc12)c(=O)c1ccccc1c3=O InChI=1S/C24H19N5O4/c25-20-17-10-3-4-11-18(17)26-22-19(20)21(13-6-5-7-14(12-13)29(32)33)27-23(30)15-8-1-2-9-16(15)24(31)28(22)27/h1-2,5-9,12,21H,3-4,10-11H2,(H2,25,26) IJJDUTAIZOTZOQ-UHFFFAOYSA-N 50457025 CHEMBL4210751 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2017.07.072 10.7270/Q2SX6GVB 28803044 Jalili-Baleh, L; Nadri, H; Moradi, A; Bukhari, SNA; Shakibaie, M; Jafari, M; Golshani, M; Homayouni Moghadam, F; Firoozpour, L; Asadipour, A; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457025 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457025&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145964330 433924292 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117886 CCCCCC1c2c(nc3CCCCc3c2N)-n2n1c(=O)c1ccccc1c2=O InChI=1S/C23H26N4O2/c1-2-3-4-13-18-19-20(24)16-11-7-8-12-17(16)25-21(19)27-23(29)15-10-6-5-9-14(15)22(28)26(18)27/h5-6,9-10,18H,2-4,7-8,11-13H2,1H3,(H2,24,25) MSDRFBAYPPQQCX-UHFFFAOYSA-N 50457021 CHEMBL4202878 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2017.07.072 10.7270/Q2SX6GVB 28803044 Jalili-Baleh, L; Nadri, H; Moradi, A; Bukhari, SNA; Shakibaie, M; Jafari, M; Golshani, M; Homayouni Moghadam, F; Firoozpour, L; Asadipour, A; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457021 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457021&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145978675 433924288 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117887 Nc1c2C(c3cccc(Br)c3)n3n(-c2nc2CCCCc12)c(=O)c1ccccc1c3=O InChI=1S/C24H19BrN4O2/c25-14-7-5-6-13(12-14)21-19-20(26)17-10-3-4-11-18(17)27-22(19)29-24(31)16-9-2-1-8-15(16)23(30)28(21)29/h1-2,5-9,12,21H,3-4,10-11H2,(H2,26,27) WVWUWMLJWTUZGJ-UHFFFAOYSA-N 50457027 CHEMBL4203909 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2017.07.072 10.7270/Q2SX6GVB 28803044 Jalili-Baleh, L; Nadri, H; Moradi, A; Bukhari, SNA; Shakibaie, M; Jafari, M; Golshani, M; Homayouni Moghadam, F; Firoozpour, L; Asadipour, A; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457027 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457027&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145976293 433924294 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117888 Nc1c2C(c3ccccc3[N+]([O-])=O)n3n(-c2nc2CCCCc12)c(=O)c1ccccc1c3=O InChI=1S/C24H19N5O4/c25-20-15-9-3-5-11-17(15)26-22-19(20)21(16-10-4-6-12-18(16)29(32)33)27-23(30)13-7-1-2-8-14(13)24(31)28(22)27/h1-2,4,6-8,10,12,21H,3,5,9,11H2,(H2,25,26) MFGCQLVIQBCFAG-UHFFFAOYSA-N 50457029 CHEMBL4209859 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2017.07.072 10.7270/Q2SX6GVB 28803044 Jalili-Baleh, L; Nadri, H; Moradi, A; Bukhari, SNA; Shakibaie, M; Jafari, M; Golshani, M; Homayouni Moghadam, F; Firoozpour, L; Asadipour, A; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457029 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457029&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145964057 433924296 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117889 Cc1ccc(cc1)C1c2c(nc3CCCCc3c2N)-n2n1c(=O)c1ccccc1c2=O InChI=1S/C25H22N4O2/c1-14-10-12-15(13-11-14)22-20-21(26)18-8-4-5-9-19(18)27-23(20)29-25(31)17-7-3-2-6-16(17)24(30)28(22)29/h2-3,6-7,10-13,22H,4-5,8-9H2,1H3,(H2,26,27) IHSYDPUXRATJCV-UHFFFAOYSA-N 50457023 CHEMBL4207397 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2017.07.072 10.7270/Q2SX6GVB 28803044 Jalili-Baleh, L; Nadri, H; Moradi, A; Bukhari, SNA; Shakibaie, M; Jafari, M; Golshani, M; Homayouni Moghadam, F; Firoozpour, L; Asadipour, A; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457023 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457023&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145977688 433924290 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117890 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 14 ChEMBL 10.1016/j.ejmech.2017.08.013 10.7270/Q2P84FGR 28810188 Reddy, EK; Remya, C; Mantosh, K; Sajith, AM; Omkumar, RV; Sadasivan, C; Anwar, S Technology and Research University-VFSTRU (Vignan's University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117891 Cn1cc(cn1)-c1ccc2c(N)c3CC(CCc3nc2c1)C(=O)NCc1ccccc1 InChI=1S/C25H25N5O/c1-30-15-19(14-28-30)17-7-9-20-23(12-17)29-22-10-8-18(11-21(22)24(20)26)25(31)27-13-16-5-3-2-4-6-16/h2-7,9,12,14-15,18H,8,10-11,13H2,1H3,(H2,26,29)(H,27,31) AQNWKOYXYYOBTE-UHFFFAOYSA-N 50457034 CHEMBL4211600 Cholinesterase 2260 ChEMBL 10.1016/j.ejmech.2017.08.013 10.7270/Q2P84FGR 28810188 Reddy, EK; Remya, C; Mantosh, K; Sajith, AM; Omkumar, RV; Sadasivan, C; Anwar, S Technology and Research University-VFSTRU (Vignan's University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457034 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457034&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145966920 433924301 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117900 NNC(=O)C1CCc2nc3ccccc3c(N)c2C1 InChI=1S/C14H16N4O/c15-13-9-3-1-2-4-11(9)17-12-6-5-8(7-10(12)13)14(19)18-16/h1-4,8H,5-7,16H2,(H2,15,17)(H,18,19) GWPNWCJCDDXBIK-UHFFFAOYSA-N 50457035 CHEMBL4205993 Cholinesterase 2990 ChEMBL 10.1016/j.ejmech.2017.08.013 10.7270/Q2P84FGR 28810188 Reddy, EK; Remya, C; Mantosh, K; Sajith, AM; Omkumar, RV; Sadasivan, C; Anwar, S Technology and Research University-VFSTRU (Vignan's University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457035 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457035&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145976137 433924302 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117901 Nc1c2CC(CCc2nc2ccccc12)C(=O)NCCc1ccccc1 InChI=1S/C22H23N3O/c23-21-17-8-4-5-9-19(17)25-20-11-10-16(14-18(20)21)22(26)24-13-12-15-6-2-1-3-7-15/h1-9,16H,10-14H2,(H2,23,25)(H,24,26) HWXMVNJHAQBMGN-UHFFFAOYSA-N 50457042 CHEMBL4218238 Cholinesterase 4050 ChEMBL 10.1016/j.ejmech.2017.08.013 10.7270/Q2P84FGR 28810188 Reddy, EK; Remya, C; Mantosh, K; Sajith, AM; Omkumar, RV; Sadasivan, C; Anwar, S Technology and Research University-VFSTRU (Vignan's University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457042 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457042&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145968236 433924309 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117902 Nc1c2CC(CCc2nc2ccccc12)C(=O)NCCCc1ccccc1 InChI=1S/C23H25N3O/c24-22-18-10-4-5-11-20(18)26-21-13-12-17(15-19(21)22)23(27)25-14-6-9-16-7-2-1-3-8-16/h1-5,7-8,10-11,17H,6,9,12-15H2,(H2,24,26)(H,25,27) OYHDIURQIIDFSG-UHFFFAOYSA-N 50457037 CHEMBL4213301 Cholinesterase 3680 ChEMBL 10.1016/j.ejmech.2017.08.013 10.7270/Q2P84FGR 28810188 Reddy, EK; Remya, C; Mantosh, K; Sajith, AM; Omkumar, RV; Sadasivan, C; Anwar, S Technology and Research University-VFSTRU (Vignan's University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457037 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457037&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145966036 433924304 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117903 Nc1c2CC(CCc2nc2cc(Br)ccc12)C(=O)NCc1ccccc1 InChI=1S/C21H20BrN3O/c22-15-7-8-16-19(11-15)25-18-9-6-14(10-17(18)20(16)23)21(26)24-12-13-4-2-1-3-5-13/h1-5,7-8,11,14H,6,9-10,12H2,(H2,23,25)(H,24,26) UMMGKEQHDBVJNT-UHFFFAOYSA-N 50457038 CHEMBL4213832 Cholinesterase 10240 ChEMBL 10.1016/j.ejmech.2017.08.013 10.7270/Q2P84FGR 28810188 Reddy, EK; Remya, C; Mantosh, K; Sajith, AM; Omkumar, RV; Sadasivan, C; Anwar, S Technology and Research University-VFSTRU (Vignan's University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457038 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457038&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145963765 433924305 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117904 Cn1cc(cn1)-c1ccc2c(N)c3CC(CCc3nc2c1)C(=O)NCCc1ccccc1 InChI=1S/C26H27N5O/c1-31-16-20(15-29-31)18-7-9-21-24(14-18)30-23-10-8-19(13-22(23)25(21)27)26(32)28-12-11-17-5-3-2-4-6-17/h2-7,9,14-16,19H,8,10-13H2,1H3,(H2,27,30)(H,28,32) DHAAKZWEGFAAAG-UHFFFAOYSA-N 50457043 CHEMBL4204944 Cholinesterase 10570 ChEMBL 10.1016/j.ejmech.2017.08.013 10.7270/Q2P84FGR 28810188 Reddy, EK; Remya, C; Mantosh, K; Sajith, AM; Omkumar, RV; Sadasivan, C; Anwar, S Technology and Research University-VFSTRU (Vignan's University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457043 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457043&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145976340 433924310 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117905 Cn1cc(cn1)-c1ccc2c(N)c3CC(CCc3nc2c1)C(=O)NCCCc1ccccc1 InChI=1S/C27H29N5O/c1-32-17-21(16-30-32)19-9-11-22-25(15-19)31-24-12-10-20(14-23(24)26(22)28)27(33)29-13-5-8-18-6-3-2-4-7-18/h2-4,6-7,9,11,15-17,20H,5,8,10,12-14H2,1H3,(H2,28,31)(H,29,33) RKEGPIWIIXWMRR-UHFFFAOYSA-N 50457040 CHEMBL4217809 Cholinesterase 2770 ChEMBL 10.1016/j.ejmech.2017.08.013 10.7270/Q2P84FGR 28810188 Reddy, EK; Remya, C; Mantosh, K; Sajith, AM; Omkumar, RV; Sadasivan, C; Anwar, S Technology and Research University-VFSTRU (Vignan's University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457040 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457040&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145974749 433924307 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117906 Cn1nccc1NC(=O)C1CCc2nc3cc(Br)ccc3c(N)c2C1 InChI=1S/C18H18BrN5O/c1-24-16(6-7-21-24)23-18(25)10-2-5-14-13(8-10)17(20)12-4-3-11(19)9-15(12)22-14/h3-4,6-7,9-10H,2,5,8H2,1H3,(H2,20,22)(H,23,25) MQTZXCFUXXTUJW-UHFFFAOYSA-N 50457041 CHEMBL4203832 Cholinesterase 20930 ChEMBL 10.1016/j.ejmech.2017.08.013 10.7270/Q2P84FGR 28810188 Reddy, EK; Remya, C; Mantosh, K; Sajith, AM; Omkumar, RV; Sadasivan, C; Anwar, S Technology and Research University-VFSTRU (Vignan's University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457041 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457041&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145977037 433924308 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117909 CNC(=O)C1CCc2nc3cc(Br)ccc3c(N)c2C1 InChI=1S/C15H16BrN3O/c1-18-15(20)8-2-5-12-11(6-8)14(17)10-4-3-9(16)7-13(10)19-12/h3-4,7-8H,2,5-6H2,1H3,(H2,17,19)(H,18,20) ZGVLEPXVPCWAAW-UHFFFAOYSA-N 50457044 CHEMBL4205467 Cholinesterase 47290 ChEMBL 10.1016/j.ejmech.2017.08.013 10.7270/Q2P84FGR 28810188 Reddy, EK; Remya, C; Mantosh, K; Sajith, AM; Omkumar, RV; Sadasivan, C; Anwar, S Technology and Research University-VFSTRU (Vignan's University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457044 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457044&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145977615 433924311 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117911 Nc1c2CC(CCc2nc2cc(Br)ccc12)C(=O)NCCCc1ccccc1 InChI=1S/C23H24BrN3O/c24-17-9-10-18-21(14-17)27-20-11-8-16(13-19(20)22(18)25)23(28)26-12-4-7-15-5-2-1-3-6-15/h1-3,5-6,9-10,14,16H,4,7-8,11-13H2,(H2,25,27)(H,26,28) MKXGHWZEYYSQRA-UHFFFAOYSA-N 50457045 CHEMBL4206709 Cholinesterase 5110 ChEMBL 10.1016/j.ejmech.2017.08.013 10.7270/Q2P84FGR 28810188 Reddy, EK; Remya, C; Mantosh, K; Sajith, AM; Omkumar, RV; Sadasivan, C; Anwar, S Technology and Research University-VFSTRU (Vignan's University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457045 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457045&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145977662 433924312 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117914 Nc1c2CC(CCc2nc2ccccc12)C(=O)NCc1ccccc1 InChI=1S/C21H21N3O/c22-20-16-8-4-5-9-18(16)24-19-11-10-15(12-17(19)20)21(25)23-13-14-6-2-1-3-7-14/h1-9,15H,10-13H2,(H2,22,24)(H,23,25) CBKZHRPPOLFDDE-UHFFFAOYSA-N 50457036 CHEMBL4217709 Cholinesterase 10770 ChEMBL 10.1016/j.ejmech.2017.08.013 10.7270/Q2P84FGR 28810188 Reddy, EK; Remya, C; Mantosh, K; Sajith, AM; Omkumar, RV; Sadasivan, C; Anwar, S Technology and Research University-VFSTRU (Vignan's University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457036 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457036&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145974508 433924303 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117915 Nc1c2CC(CCc2nc2cc(Br)ccc12)C(=O)NCCc1ccccc1 InChI=1S/C22H22BrN3O/c23-16-7-8-17-20(13-16)26-19-9-6-15(12-18(19)21(17)24)22(27)25-11-10-14-4-2-1-3-5-14/h1-5,7-8,13,15H,6,9-12H2,(H2,24,26)(H,25,27) XWHXBDJVKUBUPH-UHFFFAOYSA-N 50457039 CHEMBL4208905 Cholinesterase 7170 ChEMBL 10.1016/j.ejmech.2017.08.013 10.7270/Q2P84FGR 28810188 Reddy, EK; Remya, C; Mantosh, K; Sajith, AM; Omkumar, RV; Sadasivan, C; Anwar, S Technology and Research University-VFSTRU (Vignan's University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457039 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457039&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145965162 433924306 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117916 Nc1c2CC(CCc2nc2cc(ccc12)-c1cncnc1)C(=O)NCCCc1ccccc1 InChI=1S/C27H27N5O/c28-26-22-10-8-19(21-15-29-17-30-16-21)14-25(22)32-24-11-9-20(13-23(24)26)27(33)31-12-4-7-18-5-2-1-3-6-18/h1-3,5-6,8,10,14-17,20H,4,7,9,11-13H2,(H2,28,32)(H,31,33) QSAIYXTWZROLFQ-UHFFFAOYSA-N 50457046 CHEMBL4215508 Cholinesterase 18020 ChEMBL 10.1016/j.ejmech.2017.08.013 10.7270/Q2P84FGR 28810188 Reddy, EK; Remya, C; Mantosh, K; Sajith, AM; Omkumar, RV; Sadasivan, C; Anwar, S Technology and Research University-VFSTRU (Vignan's University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50457046 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50457046&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145973935 433924313 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51021765 COC(=O)c1cc(OC)c2OCOc2c1-c1c2OCOc2c(OC)cc1C(=O)NCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C36H37N3O9/c1-42-26-16-22(28(33-31(26)45-18-47-33)29-23(36(41)44-3)17-27(43-2)32-34(29)48-19-46-32)35(40)38-15-9-8-14-37-30-20-10-4-6-12-24(20)39-25-13-7-5-11-21(25)30/h4,6,10,12,16-17H,5,7-9,11,13-15,18-19H2,1-3H3,(H,37,39)(H,38,40) ZPXHUZUXFHUXKW-UHFFFAOYSA-N 50289516 CHEMBL4174025 Cholinesterase 75 ChEMBL 10.1016/j.ejmech.2017.12.005 10.7270/Q24B33WB 29268129 Cen, J; Guo, H; Hong, C; Lv, J; Yang, Y; Wang, T; Fang, D; Luo, W; Wang, C Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50289516 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50289516&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 6473904 104131087 ZINC34072783 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51021766 COC(=O)c1cc(OC)c2OCOc2c1-c1c2OCOc2c(OC)cc1C(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C38H41N3O9/c1-44-28-18-24(30(35-33(28)47-20-49-35)31-25(38(43)46-3)19-29(45-2)34-36(31)50-21-48-34)37(42)40-17-11-5-4-10-16-39-32-22-12-6-8-14-26(22)41-27-15-9-7-13-23(27)32/h6,8,12,14,18-19H,4-5,7,9-11,13,15-17,20-21H2,1-3H3,(H,39,41)(H,40,42) BZHRIIYJBLQRMP-UHFFFAOYSA-N 50289517 CHEMBL4163312 Cholinesterase 4.0 ChEMBL 10.1016/j.ejmech.2017.12.005 10.7270/Q24B33WB 29268129 Cen, J; Guo, H; Hong, C; Lv, J; Yang, Y; Wang, T; Fang, D; Luo, W; Wang, C Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50289517 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50289517&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 6473925 104131088 ZINC06483758 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51021767 COC(=O)c1cc(OC)c2OCOc2c1-c1c2OCOc2c(OC)cc1C(=O)NCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C40H45N3O9/c1-46-30-20-26(32(37-35(30)49-22-51-37)33-27(40(45)48-3)21-31(47-2)36-38(33)52-23-50-36)39(44)42-19-13-7-5-4-6-12-18-41-34-24-14-8-10-16-28(24)43-29-17-11-9-15-25(29)34/h8,10,14,16,20-21H,4-7,9,11-13,15,17-19,22-23H2,1-3H3,(H,41,43)(H,42,44) ZWANBUHCGPBIAB-UHFFFAOYSA-N 50289518 CHEMBL4176630 Cholinesterase 6.5 ChEMBL 10.1016/j.ejmech.2017.12.005 10.7270/Q24B33WB 29268129 Cen, J; Guo, H; Hong, C; Lv, J; Yang, Y; Wang, T; Fang, D; Luo, W; Wang, C Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50289518 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50289518&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44282963 104131089 ZINC29230641 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51021768 COC(=O)c1cc(OC)c2OCOc2c1-c1c2OCOc2c(OC)cc1C(=O)NCCCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C42H49N3O9/c1-48-32-22-28(34(39-37(32)51-24-53-39)35-29(42(47)50-3)23-33(49-2)38-40(35)54-25-52-38)41(46)44-21-15-9-7-5-4-6-8-14-20-43-36-26-16-10-12-18-30(26)45-31-19-13-11-17-27(31)36/h10,12,16,18,22-23H,4-9,11,13-15,17,19-21,24-25H2,1-3H3,(H,43,45)(H,44,46) AVQNAJUSQIGOFZ-UHFFFAOYSA-N 50289519 CHEMBL4168769 Cholinesterase 8.6 ChEMBL 10.1016/j.ejmech.2017.12.005 10.7270/Q24B33WB 29268129 Cen, J; Guo, H; Hong, C; Lv, J; Yang, Y; Wang, T; Fang, D; Luo, W; Wang, C Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50289519 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50289519&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5353912 104131090 ZINC43938657 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51021769 COC(=O)c1cc(OC)c2OCOc2c1-c1c2OCOc2c(OC)cc1C(=O)NCCCCCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C44H53N3O9/c1-50-34-24-30(36(41-39(34)53-26-55-41)37-31(44(49)52-3)25-35(51-2)40-42(37)56-27-54-40)43(48)46-23-17-11-9-7-5-4-6-8-10-16-22-45-38-28-18-12-14-20-32(28)47-33-21-15-13-19-29(33)38/h12,14,18,20,24-25H,4-11,13,15-17,19,21-23,26-27H2,1-3H3,(H,45,47)(H,46,48) DTDFKCKRCDAYHV-UHFFFAOYSA-N 50289520 CHEMBL4173262 Cholinesterase 35 ChEMBL 10.1016/j.ejmech.2017.12.005 10.7270/Q24B33WB 29268129 Cen, J; Guo, H; Hong, C; Lv, J; Yang, Y; Wang, T; Fang, D; Luo, W; Wang, C Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50289520 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50289520&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10341373 104131091 ZINC40748816 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51022161 COC(=O)c1cc(OC)c2OCOc2c1-c1c2OCOc2c(OC)cc1C(=O)OC InChI=1S/C20H18O10/c1-23-11-5-9(19(21)25-3)13(17-15(11)27-7-29-17)14-10(20(22)26-4)6-12(24-2)16-18(14)30-8-28-16/h5-6H,7-8H2,1-4H3 JMZOMFYRADAWOG-UHFFFAOYSA-N 50289527 Bifendate Cholinesterase >50000 ChEMBL 10.1016/j.ejmech.2017.12.005 10.7270/Q24B33WB 29268129 Cen, J; Guo, H; Hong, C; Lv, J; Yang, Y; Wang, T; Fang, D; Luo, W; Wang, C Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50289527 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50289527&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44283920 104131098 ZINC00840703 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51022165 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 24 ChEMBL 10.1016/j.ejmech.2017.12.005 10.7270/Q24B33WB 29268129 Cen, J; Guo, H; Hong, C; Lv, J; Yang, Y; Wang, T; Fang, D; Luo, W; Wang, C Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117328 [Br-].Cc1cc(=O)oc2cc(OCc3cc[n+](Cc4ccc(Br)cc4)cc3)ccc12 InChI=1S/C23H19BrNO3/c1-16-12-23(26)28-22-13-20(6-7-21(16)22)27-15-18-8-10-25(11-9-18)14-17-2-4-19(24)5-3-17/h2-13H,14-15H2,1H3/q+1 QUKIDURQJXXGLR-UHFFFAOYSA-N 50456818 CHEMBL4213345 Cholinesterase 4.9 ChEMBL 10.1016/j.ejmech.2017.07.055 10.7270/Q2GM89X1 28797883 Lan, JS; Ding, Y; Liu, Y; Kang, P; Hou, JW; Zhang, XY; Xie, SS; Zhang, T Shanghai University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456818 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456818&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145964200 433924085 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117335 [Br-].Cc1cc(=O)oc2cc(OCc3cc[n+](Cc4ccc(F)cc4)cc3)ccc12 InChI=1S/C23H19FNO3/c1-16-12-23(26)28-22-13-20(6-7-21(16)22)27-15-18-8-10-25(11-9-18)14-17-2-4-19(24)5-3-17/h2-13H,14-15H2,1H3/q+1 RDJYPEQKOFLDSU-UHFFFAOYSA-N 50456823 CHEMBL4217755 Cholinesterase 3.0 ChEMBL 10.1016/j.ejmech.2017.07.055 10.7270/Q2GM89X1 28797883 Lan, JS; Ding, Y; Liu, Y; Kang, P; Hou, JW; Zhang, XY; Xie, SS; Zhang, T Shanghai University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456823 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456823&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145974973 433924090 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117343 Cc1cc(=O)oc2cc(O)ccc12 InChI=1S/C10H8O3/c1-6-4-10(12)13-9-5-7(11)2-3-8(6)9/h2-5,11H,1H3 HSHNITRMYYLLCV-UHFFFAOYSA-N 50022178 4-Methyl-7-hydroxycoumarin::4-methylumbelliferone::7-Hydroxy-4-methyl-2-oxo-2H-1-benzopyran::7-Hydroxy-4-methyl-2-oxo-3-chromene::7-Hydroxy-4-methyl-2H-1-benzopyran-2-one::7-Hydroxy-4-methyl-2H-2-one (1)::7-Hydroxy-4-methylcoumarin::7-hydroxy-4-methyl-2H-chromen-2-one::CHEMBL12208::Coumarin derivative, 3b::Imecromone::beta-Methylumbelliferone::cid_5280567 Cholinesterase >100 ChEMBL 10.1016/j.ejmech.2017.07.055 10.7270/Q2GM89X1 28797883 Lan, JS; Ding, Y; Liu, Y; Kang, P; Hou, JW; Zhang, XY; Xie, SS; Zhang, T Shanghai University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50022178 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50022178&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 4MU 4AX7,4V28,3ETS,6Z69,5JR3,5IK8,5IK5 5280567 103932801 17224 CHEMBL12208 DB07118 C03081 ZINC00058121 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117344 [Br-].Cc1cc(=O)oc2cc(OCc3cc[n+](Cc4ccccc4F)cc3)ccc12 InChI=1S/C23H19FNO3/c1-16-12-23(26)28-22-13-19(6-7-20(16)22)27-15-17-8-10-25(11-9-17)14-18-4-2-3-5-21(18)24/h2-13H,14-15H2,1H3/q+1 BBBDMVQFKWOHPN-UHFFFAOYSA-N 50456822 CHEMBL4205764 Cholinesterase 1.6 ChEMBL 10.1016/j.ejmech.2017.07.055 10.7270/Q2GM89X1 28797883 Lan, JS; Ding, Y; Liu, Y; Kang, P; Hou, JW; Zhang, XY; Xie, SS; Zhang, T Shanghai University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456822 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456822&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145975154 433924089 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117345 [Br-].Cc1cc(=O)oc2cc(OCc3cc[n+](Cc4cccc(F)c4)cc3)ccc12 InChI=1S/C23H19FNO3/c1-16-11-23(26)28-22-13-20(5-6-21(16)22)27-15-17-7-9-25(10-8-17)14-18-3-2-4-19(24)12-18/h2-13H,14-15H2,1H3/q+1 YEQXVVSCJCAGCN-UHFFFAOYSA-N 50456827 CHEMBL4206041 Cholinesterase 2.7 ChEMBL 10.1016/j.ejmech.2017.07.055 10.7270/Q2GM89X1 28797883 Lan, JS; Ding, Y; Liu, Y; Kang, P; Hou, JW; Zhang, XY; Xie, SS; Zhang, T Shanghai University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456827 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456827&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145978096 433924094 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117346 [Br-].Cc1ccccc1C[n+]1ccc(COc2ccc3c(C)cc(=O)oc3c2)cc1 InChI=1S/C24H22NO3/c1-17-5-3-4-6-20(17)15-25-11-9-19(10-12-25)16-27-21-7-8-22-18(2)13-24(26)28-23(22)14-21/h3-14H,15-16H2,1-2H3/q+1 KYEOIBNAXBQIIL-UHFFFAOYSA-N 50456825 CHEMBL4210401 Cholinesterase 1.6 ChEMBL 10.1016/j.ejmech.2017.07.055 10.7270/Q2GM89X1 28797883 Lan, JS; Ding, Y; Liu, Y; Kang, P; Hou, JW; Zhang, XY; Xie, SS; Zhang, T Shanghai University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456825 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456825&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145964757 433924092 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117347 [Br-].Cc1ccc(C[n+]2ccc(COc3ccc4c(C)cc(=O)oc4c3)cc2)cc1 InChI=1S/C24H22NO3/c1-17-3-5-19(6-4-17)15-25-11-9-20(10-12-25)16-27-21-7-8-22-18(2)13-24(26)28-23(22)14-21/h3-14H,15-16H2,1-2H3/q+1 XXWKFTXCPBFORX-UHFFFAOYSA-N 50456819 CHEMBL4213874 Cholinesterase 7.7 ChEMBL 10.1016/j.ejmech.2017.07.055 10.7270/Q2GM89X1 28797883 Lan, JS; Ding, Y; Liu, Y; Kang, P; Hou, JW; Zhang, XY; Xie, SS; Zhang, T Shanghai University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456819 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456819&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145965605 433924086 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117348 [Br-].Cc1cc(=O)oc2cc(OCc3cc[n+](Cc4ccccc4Br)cc3)ccc12 InChI=1S/C23H19BrNO3/c1-16-12-23(26)28-22-13-19(6-7-20(16)22)27-15-17-8-10-25(11-9-17)14-18-4-2-3-5-21(18)24/h2-13H,14-15H2,1H3/q+1 MXIWEACZSLWUNJ-UHFFFAOYSA-N 50456821 CHEMBL4208961 Cholinesterase 0.480000 ChEMBL 10.1016/j.ejmech.2017.07.055 10.7270/Q2GM89X1 28797883 Lan, JS; Ding, Y; Liu, Y; Kang, P; Hou, JW; Zhang, XY; Xie, SS; Zhang, T Shanghai University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456821 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456821&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145963788 433924088 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117349 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 4.6 ChEMBL 10.1016/j.ejmech.2017.07.055 10.7270/Q2GM89X1 28797883 Lan, JS; Ding, Y; Liu, Y; Kang, P; Hou, JW; Zhang, XY; Xie, SS; Zhang, T Shanghai University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117367 [Br-].Cc1cc(=O)oc2cc(OCc3cc[n+](Cc4ccccc4)cc3)ccc12 InChI=1S/C23H20NO3/c1-17-13-23(25)27-22-14-20(7-8-21(17)22)26-16-19-9-11-24(12-10-19)15-18-5-3-2-4-6-18/h2-14H,15-16H2,1H3/q+1 KAQFXSGSNQJYSZ-UHFFFAOYSA-N 50456824 CHEMBL4217466 Cholinesterase 4.2 ChEMBL 10.1016/j.ejmech.2017.07.055 10.7270/Q2GM89X1 28797883 Lan, JS; Ding, Y; Liu, Y; Kang, P; Hou, JW; Zhang, XY; Xie, SS; Zhang, T Shanghai University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456824 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456824&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145973774 433924091 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117368 [Br-].Cc1cccc(C[n+]2ccc(COc3ccc4c(C)cc(=O)oc4c3)cc2)c1 InChI=1S/C24H22NO3/c1-17-4-3-5-20(12-17)15-25-10-8-19(9-11-25)16-27-21-6-7-22-18(2)13-24(26)28-23(22)14-21/h3-14H,15-16H2,1-2H3/q+1 DBRDRUNIMYQHRB-UHFFFAOYSA-N 50456826 CHEMBL4205520 Cholinesterase 2.3 ChEMBL 10.1016/j.ejmech.2017.07.055 10.7270/Q2GM89X1 28797883 Lan, JS; Ding, Y; Liu, Y; Kang, P; Hou, JW; Zhang, XY; Xie, SS; Zhang, T Shanghai University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456826 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456826&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145976117 433924093 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117369 [Br-].Cc1cc(=O)oc2cc(OCc3cc[n+](Cc4cccc(c4)[N+]([O-])=O)cc3)ccc12 InChI=1S/C23H19N2O5/c1-16-11-23(26)30-22-13-20(5-6-21(16)22)29-15-17-7-9-24(10-8-17)14-18-3-2-4-19(12-18)25(27)28/h2-13H,14-15H2,1H3/q+1 HZUIZIMBKPSMMN-UHFFFAOYSA-N 50456820 CHEMBL4205110 Cholinesterase 4.4 ChEMBL 10.1016/j.ejmech.2017.07.055 10.7270/Q2GM89X1 28797883 Lan, JS; Ding, Y; Liu, Y; Kang, P; Hou, JW; Zhang, XY; Xie, SS; Zhang, T Shanghai University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456820 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456820&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145975130 433924087 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117376 [Br-].Cc1cc(=O)oc2cc(OCc3cc[n+](Cc4cccc(Br)c4)cc3)ccc12 InChI=1S/C23H19BrNO3/c1-16-11-23(26)28-22-13-20(5-6-21(16)22)27-15-17-7-9-25(10-8-17)14-18-3-2-4-19(24)12-18/h2-13H,14-15H2,1H3/q+1 DHPPKOMQWCJTCC-UHFFFAOYSA-N 50456817 CHEMBL4218281 Cholinesterase 4.4 ChEMBL 10.1016/j.ejmech.2017.07.055 10.7270/Q2GM89X1 28797883 Lan, JS; Ding, Y; Liu, Y; Kang, P; Hou, JW; Zhang, XY; Xie, SS; Zhang, T Shanghai University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456817 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456817&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145969616 433924084 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116414 CN(C)CCCC1(OCc2cc(ccc12)C(=O)NNC(=O)c1ccc(C)cc1)c1ccc(F)cc1 InChI=1S/C28H30FN3O3/c1-19-5-7-20(8-6-19)26(33)30-31-27(34)21-9-14-25-22(17-21)18-35-28(25,15-4-16-32(2)3)23-10-12-24(29)13-11-23/h5-14,17H,4,15-16,18H2,1-3H3,(H,30,33)(H,31,34) XXYGHNXBCRFKDK-UHFFFAOYSA-N 50456471 CHEMBL4209438 Cholinesterase 157900 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456471 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456471&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145965424 433923738 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116415 CN(C)CCCC1(OCc2cc(ccc12)C(=O)NNC(=O)c1cccc(O)c1)c1ccc(F)cc1 InChI=1S/C27H28FN3O4/c1-31(2)14-4-13-27(21-8-10-22(28)11-9-21)24-12-7-19(15-20(24)17-35-27)26(34)30-29-25(33)18-5-3-6-23(32)16-18/h3,5-12,15-16,32H,4,13-14,17H2,1-2H3,(H,29,33)(H,30,34) GKNNSIBJYVCFEP-UHFFFAOYSA-N 50456472 CHEMBL4209262 Cholinesterase 129160 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456472 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456472&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145965641 433923739 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116416 CN(C)CCCC1(OCc2cc(ccc12)C(=O)NNC(=O)c1cccc(F)c1)c1ccc(F)cc1 InChI=1S/C27H27F2N3O3/c1-32(2)14-4-13-27(21-8-10-22(28)11-9-21)24-12-7-19(15-20(24)17-35-27)26(34)31-30-25(33)18-5-3-6-23(29)16-18/h3,5-12,15-16H,4,13-14,17H2,1-2H3,(H,30,33)(H,31,34) LVSZACXTNQFFGL-UHFFFAOYSA-N 50456473 CHEMBL4215720 Cholinesterase 184560 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456473 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456473&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145971845 433923740 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117511 COc1ccc(CC(=O)Nc2ccc(CN(C)Cc3ccccc3)cc2)cc1OC InChI=1S/C25H28N2O3/c1-27(17-19-7-5-4-6-8-19)18-20-9-12-22(13-10-20)26-25(28)16-21-11-14-23(29-2)24(15-21)30-3/h4-15H,16-18H2,1-3H3,(H,26,28) SIOOQAQHGMCZBA-UHFFFAOYSA-N 50456908 CHEMBL4203538 Cholinesterase 1480 ChEMBL 10.1016/j.ejmech.2017.07.077 10.7270/Q2Q52S78 28800459 Wang, J; Cai, P; Yang, XL; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456908 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456908&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145977029 433924175 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117513 COc1cc2cc(-c3ccc(CN(C)Cc4ccccc4)cc3)c(=O)oc2cc1OC InChI=1S/C26H25NO4/c1-27(16-18-7-5-4-6-8-18)17-19-9-11-20(12-10-19)22-13-21-14-24(29-2)25(30-3)15-23(21)31-26(22)28/h4-15H,16-17H2,1-3H3 KXMCSAUVAHKCOR-UHFFFAOYSA-N 10949 3-(4-{[Benzyl(methyl)amino]methyl}-phenyl)-6,7-dimethoxy-2H-2-chromenone::3-(4-{[benzyl(methyl)amino]methyl}phenyl)-6,7-dimethoxy-2H-chromen-2-one::AP2238::CHEMBL75121 Cholinesterase 12360 ChEMBL 10.1016/j.ejmech.2017.07.077 10.7270/Q2Q52S78 28800459 Wang, J; Cai, P; Yang, XL; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10949 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10949&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 9844749 46511515 CHEMBL75121 ZINC03991705 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116425 CN(C)CCCC1(OCc2cc(ccc12)C(=O)NNC(=O)c1ccccc1)c1ccc(F)cc1 InChI=1S/C27H28FN3O3/c1-31(2)16-6-15-27(22-10-12-23(28)13-11-22)24-14-9-20(17-21(24)18-34-27)26(33)30-29-25(32)19-7-4-3-5-8-19/h3-5,7-14,17H,6,15-16,18H2,1-2H3,(H,29,32)(H,30,33) FHULOFWVDUKGSX-UHFFFAOYSA-N 50456482 CHEMBL4216171 Cholinesterase 75810 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456482 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456482&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145972112 433923749 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116431 CN(C)CCCC1(OCc2cc(ccc12)C(=O)NNC(=O)c1ccc(N)cc1)c1ccc(F)cc1 InChI=1S/C27H29FN4O3/c1-32(2)15-3-14-27(21-7-9-22(28)10-8-21)24-13-6-19(16-20(24)17-35-27)26(34)31-30-25(33)18-4-11-23(29)12-5-18/h4-13,16H,3,14-15,17,29H2,1-2H3,(H,30,33)(H,31,34) FPYQKZTXJZNSIB-UHFFFAOYSA-N 50456487 CHEMBL4203958 Cholinesterase 5980 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456487 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456487&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145968677 433923754 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116432 CN(C)CCCC1(OCc2cc(ccc12)C(=O)NNC(=O)c1ccccc1O)c1ccc(F)cc1 InChI=1S/C27H28FN3O4/c1-31(2)15-5-14-27(20-9-11-21(28)12-10-20)23-13-8-18(16-19(23)17-35-27)25(33)29-30-26(34)22-6-3-4-7-24(22)32/h3-4,6-13,16,32H,5,14-15,17H2,1-2H3,(H,29,33)(H,30,34) IIFIKBRLGGIKBG-UHFFFAOYSA-N 50456488 CHEMBL4214178 Cholinesterase 88990 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456488 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456488&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145973868 433923755 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116433 CN(C)CCCC1(OCc2cc(ccc12)C(=O)NNC(=O)c1cccc(c1)[N+]([O-])=O)c1ccc(F)cc1 InChI=1S/C27H27FN4O5/c1-31(2)14-4-13-27(21-8-10-22(28)11-9-21)24-12-7-19(15-20(24)17-37-27)26(34)30-29-25(33)18-5-3-6-23(16-18)32(35)36/h3,5-12,15-16H,4,13-14,17H2,1-2H3,(H,29,33)(H,30,34) SYSIHPWSARQUEM-UHFFFAOYSA-N 50456485 CHEMBL4218237 Cholinesterase 184560 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456485 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456485&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145967995 433923752 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116434 CN(C)CCCC1(OCc2cc(ccc12)C(=O)NNC(=O)c1ccc(cc1)[N+]([O-])=O)c1ccc(F)cc1 InChI=1S/C27H27FN4O5/c1-31(2)15-3-14-27(21-7-9-22(28)10-8-21)24-13-6-19(16-20(24)17-37-27)26(34)30-29-25(33)18-4-11-23(12-5-18)32(35)36/h4-13,16H,3,14-15,17H2,1-2H3,(H,29,33)(H,30,34) NQIZAVWWLLSNTF-UHFFFAOYSA-N 50456486 CHEMBL4206506 Cholinesterase 168900 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456486 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456486&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145977405 433923753 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116435 CN(C)CCCC1(OCc2cc(ccc12)C(=O)NNC(=O)c1ccccc1C)c1ccc(F)cc1 InChI=1S/C28H30FN3O3/c1-19-7-4-5-8-24(19)27(34)31-30-26(33)20-9-14-25-21(17-20)18-35-28(25,15-6-16-32(2)3)22-10-12-23(29)13-11-22/h4-5,7-14,17H,6,15-16,18H2,1-3H3,(H,30,33)(H,31,34) HOAKEDYWJYTYOQ-UHFFFAOYSA-N 50456489 CHEMBL4213831 Cholinesterase 232810 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456489 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456489&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145963764 433923756 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116436 CN(C)CCCC1(OCc2cc(ccc12)C(=O)NNC(=O)c1ccccc1Cl)c1ccc(F)cc1 InChI=1S/C27H27ClFN3O3/c1-32(2)15-5-14-27(20-9-11-21(29)12-10-20)23-13-8-18(16-19(23)17-35-27)25(33)30-31-26(34)22-6-3-4-7-24(22)28/h3-4,6-13,16H,5,14-15,17H2,1-2H3,(H,30,33)(H,31,34) YUVNYENYNAULJW-UHFFFAOYSA-N 50456490 CHEMBL4214338 Cholinesterase 69260 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456490 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456490&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145974116 433923757 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116437 CN(C)CCCC1(OCc2cc(ccc12)C(=O)NNC(=O)c1cccc(Cl)c1)c1ccc(F)cc1 InChI=1S/C27H27ClFN3O3/c1-32(2)14-4-13-27(21-8-10-23(29)11-9-21)24-12-7-19(15-20(24)17-35-27)26(34)31-30-25(33)18-5-3-6-22(28)16-18/h3,5-12,15-16H,4,13-14,17H2,1-2H3,(H,30,33)(H,31,34) RROFZSOCAJAQLB-UHFFFAOYSA-N 50456491 CHEMBL4206917 Cholinesterase 3900 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456491 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456491&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145970975 433923758 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116438 CN(C)CCCC1(OCc2cc(ccc12)C(=O)NNC(=O)c1ccccc1F)c1ccc(F)cc1 InChI=1S/C27H27F2N3O3/c1-32(2)15-5-14-27(20-9-11-21(28)12-10-20)23-13-8-18(16-19(23)17-35-27)25(33)30-31-26(34)22-6-3-4-7-24(22)29/h3-4,6-13,16H,5,14-15,17H2,1-2H3,(H,30,33)(H,31,34) ZWUSYPRYLUUDAJ-UHFFFAOYSA-N 50456475 CHEMBL4204043 Cholinesterase 71380 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456475 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456475&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145968678 433923742 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116439 CN(C)CCCC1(OCc2cc(ccc12)C(=O)NNC(=O)c1ccccc1Br)c1ccc(F)cc1 InChI=1S/C27H27BrFN3O3/c1-32(2)15-5-14-27(20-9-11-21(29)12-10-20)23-13-8-18(16-19(23)17-35-27)25(33)30-31-26(34)22-6-3-4-7-24(22)28/h3-4,6-13,16H,5,14-15,17H2,1-2H3,(H,30,33)(H,31,34) KDZRPPOZLQJESQ-UHFFFAOYSA-N 50456492 CHEMBL4211286 Cholinesterase 2110 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456492 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456492&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145963869 433923759 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116440 CN(C)CCCC1(OCc2cc(ccc12)C(=O)NNC(=O)c1cccc(Br)c1)c1ccc(F)cc1 InChI=1S/C27H27BrFN3O3/c1-32(2)14-4-13-27(21-8-10-23(29)11-9-21)24-12-7-19(15-20(24)17-35-27)26(34)31-30-25(33)18-5-3-6-22(28)16-18/h3,5-12,15-16H,4,13-14,17H2,1-2H3,(H,30,33)(H,31,34) REQQVSQVVBSRJU-UHFFFAOYSA-N 50456477 CHEMBL4212773 Cholinesterase 130120 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456477 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456477&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145967221 433923744 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116441 CN(C)CCCC1(OCc2cc(ccc12)C(=O)NNC(=O)c1ccc(Br)cc1)c1ccc(F)cc1 InChI=1S/C27H27BrFN3O3/c1-32(2)15-3-14-27(21-7-11-23(29)12-8-21)24-13-6-19(16-20(24)17-35-27)26(34)31-30-25(33)18-4-9-22(28)10-5-18/h4-13,16H,3,14-15,17H2,1-2H3,(H,30,33)(H,31,34) AWYXUDWXPVGWIH-UHFFFAOYSA-N 50456493 CHEMBL4207870 Cholinesterase 190270 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456493 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456493&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145970279 433923760 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116442 CN(C)CCCC1(OCc2cc(ccc12)C(=O)NNC(=O)c1ccc(I)cc1)c1ccc(F)cc1 InChI=1S/C27H27FIN3O3/c1-32(2)15-3-14-27(21-7-9-22(28)10-8-21)24-13-6-19(16-20(24)17-35-27)26(34)31-30-25(33)18-4-11-23(29)12-5-18/h4-13,16H,3,14-15,17H2,1-2H3,(H,30,33)(H,31,34) PYJINMPCFFAKJA-UHFFFAOYSA-N 50456479 CHEMBL4203093 Cholinesterase 5880 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456479 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456479&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145969810 433923746 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116443 COc1ccc(cc1)C(=O)NNC(=O)c1ccc2c(COC2(CCCN(C)C)c2ccc(F)cc2)c1 InChI=1S/C28H30FN3O4/c1-32(2)16-4-15-28(22-8-10-23(29)11-9-22)25-14-7-20(17-21(25)18-36-28)27(34)31-30-26(33)19-5-12-24(35-3)13-6-19/h5-14,17H,4,15-16,18H2,1-3H3,(H,30,33)(H,31,34) WOTJUFUZFZTDMO-UHFFFAOYSA-N 50456480 CHEMBL4211271 Cholinesterase 196220 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456480 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456480&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145966906 433923747 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116444 CNC(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1 InChI=1S/C15H21N3O2/c1-15-7-8-17(3)13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2/h5-6,9,13H,7-8H2,1-4H3,(H,16,19)/t13-,15+/m1/s1 PIJVFDBKTWXHHD-HIFRSBDPSA-N 50004000 (3aS,8aR)-1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol-5-yl methylcarbamate::Antilirium::CHEMBL94::Eserine::Physostol::physostigmine Cholinesterase 850 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50004000 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50004000&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5983 103917788 27953 CHEMBL94 DB00981 6598 C06535 ZINC33971762 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116450 CN(C)CCCC1(OCc2cc(ccc12)C(=O)NNC(=O)c1ccc(Cl)cc1)c1ccc(F)cc1 InChI=1S/C27H27ClFN3O3/c1-32(2)15-3-14-27(21-7-11-23(29)12-8-21)24-13-6-19(16-20(24)17-35-27)26(34)31-30-25(33)18-4-9-22(28)10-5-18/h4-13,16H,3,14-15,17H2,1-2H3,(H,30,33)(H,31,34) XADFVDFOVPZOCS-UHFFFAOYSA-N 50456474 CHEMBL4211808 Cholinesterase 138110 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456474 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456474&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145964803 433923741 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116451 COc1ccccc1C(=O)NNC(=O)c1ccc2c(COC2(CCCN(C)C)c2ccc(F)cc2)c1 InChI=1S/C28H30FN3O4/c1-32(2)16-6-15-28(21-10-12-22(29)13-11-21)24-14-9-19(17-20(24)18-36-28)26(33)30-31-27(34)23-7-4-5-8-25(23)35-3/h4-5,7-14,17H,6,15-16,18H2,1-3H3,(H,30,33)(H,31,34) RPYQPDGWNFKMTF-UHFFFAOYSA-N 50456496 CHEMBL4214748 Cholinesterase 130440 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456496 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456496&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145972751 433923763 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116456 CN(C)CCCC1(OCc2cc(ccc12)C(=O)NNC(=O)c1ccccc1N)c1ccc(F)cc1 InChI=1S/C27H29FN4O3/c1-32(2)15-5-14-27(20-9-11-21(28)12-10-20)23-13-8-18(16-19(23)17-35-27)25(33)30-31-26(34)22-6-3-4-7-24(22)29/h3-4,6-13,16H,5,14-15,17,29H2,1-2H3,(H,30,33)(H,31,34) MEJYJNPWPOLTPU-UHFFFAOYSA-N 50456483 CHEMBL4208835 Cholinesterase 68210 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456483 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456483&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145966085 433923750 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116457 CN(C)CCCC1(OCc2cc(ccc12)C(=O)NNC(=O)c1ccccc1[N+]([O-])=O)c1ccc(F)cc1 InChI=1S/C27H27FN4O5/c1-31(2)15-5-14-27(20-9-11-21(28)12-10-20)23-13-8-18(16-19(23)17-37-27)25(33)29-30-26(34)22-6-3-4-7-24(22)32(35)36/h3-4,6-13,16H,5,14-15,17H2,1-2H3,(H,29,33)(H,30,34) LYTYCRASCAGGJW-UHFFFAOYSA-N 50456497 CHEMBL4210873 Cholinesterase 76340 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456497 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456497&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145965709 433923764 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116458 CN(C)CCCC1(OCc2cc(ccc12)C(=O)NNC(=O)c1cccc(C)c1)c1ccc(F)cc1 InChI=1S/C28H30FN3O3/c1-19-6-4-7-20(16-19)26(33)30-31-27(34)21-8-13-25-22(17-21)18-35-28(25,14-5-15-32(2)3)23-9-11-24(29)12-10-23/h4,6-13,16-17H,5,14-15,18H2,1-3H3,(H,30,33)(H,31,34) NHTYFSDJFPMEDU-UHFFFAOYSA-N 50456494 CHEMBL4218764 Cholinesterase 88730 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456494 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456494&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145967559 433923761 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116459 CN(C)CCCC1(OCc2cc(ccc12)C(=O)NNC(=O)c1ccc(F)cc1)c1ccc(F)cc1 InChI=1S/C27H27F2N3O3/c1-32(2)15-3-14-27(21-7-11-23(29)12-8-21)24-13-6-19(16-20(24)17-35-27)26(34)31-30-25(33)18-4-9-22(28)10-5-18/h4-13,16H,3,14-15,17H2,1-2H3,(H,30,33)(H,31,34) XFTUTUMJPJVUQC-UHFFFAOYSA-N 50456476 CHEMBL4216253 Cholinesterase 178900 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456476 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456476&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145971869 433923743 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116460 CN(C)CCCC1(OCc2cc(ccc12)C(=O)NNC(=O)c1cccc(I)c1)c1ccc(F)cc1 InChI=1S/C27H27FIN3O3/c1-32(2)14-4-13-27(21-8-10-22(28)11-9-21)24-12-7-19(15-20(24)17-35-27)26(34)31-30-25(33)18-5-3-6-23(29)16-18/h3,5-12,15-16H,4,13-14,17H2,1-2H3,(H,30,33)(H,31,34) XVHXRIVFXWUHOG-UHFFFAOYSA-N 50456495 CHEMBL4203513 Cholinesterase 70210 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456495 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456495&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145967751 433923762 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116461 CN(C)CCCC1(OCc2cc(ccc12)C(=O)NNC(=O)c1ccccc1I)c1ccc(F)cc1 InChI=1S/C27H27FIN3O3/c1-32(2)15-5-14-27(20-9-11-21(28)12-10-20)23-13-8-18(16-19(23)17-35-27)25(33)30-31-26(34)22-6-3-4-7-24(22)29/h3-4,6-13,16H,5,14-15,17H2,1-2H3,(H,30,33)(H,31,34) RTJXZDSSMAYJQX-UHFFFAOYSA-N 50456478 CHEMBL4208382 Cholinesterase 77890 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456478 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456478&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145968687 433923745 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116465 CN(C)CCCC1(OCc2cc(ccc12)C(=O)NNC(=O)c1ccc(O)cc1)c1ccc(F)cc1 InChI=1S/C27H28FN3O4/c1-31(2)15-3-14-27(21-7-9-22(28)10-8-21)24-13-6-19(16-20(24)17-35-27)26(34)30-29-25(33)18-4-11-23(32)12-5-18/h4-13,16,32H,3,14-15,17H2,1-2H3,(H,29,33)(H,30,34) QCKFRVLTTTYFIE-UHFFFAOYSA-N 50456484 CHEMBL4205992 Cholinesterase 191520 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456484 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456484&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145970973 433923751 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51116467 COc1cc(ccc1O)C(=O)NNC(=O)c1ccc2c(COC2(CCCN(C)C)c2ccc(F)cc2)c1 InChI=1S/C28H30FN3O5/c1-32(2)14-4-13-28(21-7-9-22(29)10-8-21)23-11-5-18(15-20(23)17-37-28)26(34)30-31-27(35)19-6-12-24(33)25(16-19)36-3/h5-12,15-16,33H,4,13-14,17H2,1-3H3,(H,30,34)(H,31,35) CYAYSFUWPPPDKY-UHFFFAOYSA-N 50456481 CHEMBL4216238 Cholinesterase 76900 ChEMBL 10.1016/j.ejmech.2017.06.036 10.7270/Q2KK9FDX 28688279 Nisa, MU; Munawar, MA; Iqbal, A; Ahmed, A; Ashraf, M; Gardener, QA; Khan, MA University of the Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456481 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456481&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145974908 433923748 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117522 CN(Cc1ccccc1)Cc1ccc(NC(=O)c2ccccc2)cc1 InChI=1S/C22H22N2O/c1-24(16-18-8-4-2-5-9-18)17-19-12-14-21(15-13-19)23-22(25)20-10-6-3-7-11-20/h2-15H,16-17H2,1H3,(H,23,25) YAWSFCANPYOQHU-UHFFFAOYSA-N 50456914 CHEMBL4204899 Cholinesterase 5300 ChEMBL 10.1016/j.ejmech.2017.07.077 10.7270/Q2Q52S78 28800459 Wang, J; Cai, P; Yang, XL; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456914 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456914&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145978521 433924181 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117523 CN(Cc1ccccc1)Cc1ccc(NC(=O)CCc2ccccc2)cc1 InChI=1S/C24H26N2O/c1-26(18-21-10-6-3-7-11-21)19-22-12-15-23(16-13-22)25-24(27)17-14-20-8-4-2-5-9-20/h2-13,15-16H,14,17-19H2,1H3,(H,25,27) IJDAKQCRDGXBIO-UHFFFAOYSA-N 50456915 CHEMBL4204053 Cholinesterase 5290 ChEMBL 10.1016/j.ejmech.2017.07.077 10.7270/Q2Q52S78 28800459 Wang, J; Cai, P; Yang, XL; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456915 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456915&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145978487 433924182 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117524 CCN(Cc1ccccc1)Cc1ccc(NC(=O)CCc2ccccc2)cc1 InChI=1S/C25H28N2O/c1-2-27(19-22-11-7-4-8-12-22)20-23-13-16-24(17-14-23)26-25(28)18-15-21-9-5-3-6-10-21/h3-14,16-17H,2,15,18-20H2,1H3,(H,26,28) QBDBVOXKUCCNLN-UHFFFAOYSA-N 50456916 CHEMBL4203519 Cholinesterase 13900 ChEMBL 10.1016/j.ejmech.2017.07.077 10.7270/Q2Q52S78 28800459 Wang, J; Cai, P; Yang, XL; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456916 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456916&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145976271 433924183 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117525 CN(Cc1ccccc1)Cc1ccc(NC(=O)Cc2ccc(O)cc2)cc1 InChI=1S/C23H24N2O2/c1-25(16-19-5-3-2-4-6-19)17-20-7-11-21(12-8-20)24-23(27)15-18-9-13-22(26)14-10-18/h2-14,26H,15-17H2,1H3,(H,24,27) XWYLEVNGSMGPPA-UHFFFAOYSA-N 50456917 CHEMBL4208392 Cholinesterase 3480 ChEMBL 10.1016/j.ejmech.2017.07.077 10.7270/Q2Q52S78 28800459 Wang, J; Cai, P; Yang, XL; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456917 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456917&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145977734 433924184 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117526 CN(Cc1ccccc1)Cc1ccc(NC(=O)Cc2ccc(O)c(O)c2)cc1 InChI=1S/C23H24N2O3/c1-25(15-17-5-3-2-4-6-17)16-18-7-10-20(11-8-18)24-23(28)14-19-9-12-21(26)22(27)13-19/h2-13,26-27H,14-16H2,1H3,(H,24,28) KNINRYGFSSXZLA-UHFFFAOYSA-N 50456918 CHEMBL4214951 Cholinesterase 2280 ChEMBL 10.1016/j.ejmech.2017.07.077 10.7270/Q2Q52S78 28800459 Wang, J; Cai, P; Yang, XL; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456918 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456918&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145973676 433924185 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117527 COc1ccc(CC(=O)Nc2ccc(CN(C)Cc3ccccc3)cc2)cc1O InChI=1S/C24H26N2O3/c1-26(16-18-6-4-3-5-7-18)17-19-8-11-21(12-9-19)25-24(28)15-20-10-13-23(29-2)22(27)14-20/h3-14,27H,15-17H2,1-2H3,(H,25,28) HKPNHUAZURUPMZ-UHFFFAOYSA-N 50456911 CHEMBL4217212 Cholinesterase 2400 ChEMBL 10.1016/j.ejmech.2017.07.077 10.7270/Q2Q52S78 28800459 Wang, J; Cai, P; Yang, XL; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456911 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456911&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145972622 433924178 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117528 CCN(Cc1ccccc1)Cc1ccc(NC(=O)Cc2ccc(OC)c(OC)c2)cc1 InChI=1S/C26H30N2O3/c1-4-28(18-20-8-6-5-7-9-20)19-21-10-13-23(14-11-21)27-26(29)17-22-12-15-24(30-2)25(16-22)31-3/h5-16H,4,17-19H2,1-3H3,(H,27,29) HVTXLPYMZKCXHD-UHFFFAOYSA-N 50456906 CHEMBL4203653 Cholinesterase 3300 ChEMBL 10.1016/j.ejmech.2017.07.077 10.7270/Q2Q52S78 28800459 Wang, J; Cai, P; Yang, XL; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456906 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456906&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145977785 433924173 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117529 CN(Cc1ccccc1)Cc1ccc(NC(=O)\C=C\c2ccc(O)cc2)cc1 InChI=1S/C24H24N2O2/c1-26(17-20-5-3-2-4-6-20)18-21-7-12-22(13-8-21)25-24(28)16-11-19-9-14-23(27)15-10-19/h2-16,27H,17-18H2,1H3,(H,25,28)/b16-11+ HCRUXWJAWJFAGF-LFIBNONCSA-N 50195816 CHEMBL3970226 Cholinesterase 9500 ChEMBL 10.1016/j.ejmech.2017.07.077 10.7270/Q2Q52S78 28800459 Wang, J; Cai, P; Yang, XL; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50195816 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50195816&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134154267 375977256 CHEMBL3970226 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117530 CN(Cc1ccccc1)Cc1ccc(NC(=O)\C=C\c2ccc(O)c(O)c2)cc1 InChI=1S/C24H24N2O3/c1-26(16-19-5-3-2-4-6-19)17-20-7-11-21(12-8-20)25-24(29)14-10-18-9-13-22(27)23(28)15-18/h2-15,27-28H,16-17H2,1H3,(H,25,29)/b14-10+ NANDDLAEPXKMHJ-GXDHUFHOSA-N 50456919 CHEMBL4216806 Cholinesterase 9720 ChEMBL 10.1016/j.ejmech.2017.07.077 10.7270/Q2Q52S78 28800459 Wang, J; Cai, P; Yang, XL; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456919 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456919&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145973525 433924186 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117531 COc1ccc(\C=C\C(=O)Nc2ccc(CN(C)Cc3ccccc3)cc2)cc1OC InChI=1S/C26H28N2O3/c1-28(18-21-7-5-4-6-8-21)19-22-9-13-23(14-10-22)27-26(29)16-12-20-11-15-24(30-2)25(17-20)31-3/h4-17H,18-19H2,1-3H3,(H,27,29)/b16-12+ SBRJGGDKKJIEFJ-FOWTUZBSSA-N 50195815 CHEMBL3917990 Cholinesterase 3720 ChEMBL 10.1016/j.ejmech.2017.07.077 10.7270/Q2Q52S78 28800459 Wang, J; Cai, P; Yang, XL; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50195815 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50195815&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134142725 375977255 CHEMBL3917990 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117532 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 2890 ChEMBL 10.1016/j.ejmech.2017.07.077 10.7270/Q2Q52S78 28800459 Wang, J; Cai, P; Yang, XL; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117549 CN(Cc1ccccc1)Cc1ccc(NC(=O)Cc2ccccc2)cc1 InChI=1S/C23H24N2O/c1-25(17-20-10-6-3-7-11-20)18-21-12-14-22(15-13-21)24-23(26)16-19-8-4-2-5-9-19/h2-15H,16-18H2,1H3,(H,24,26) JSRJKSWBGDRGCG-UHFFFAOYSA-N 50456907 CHEMBL4218997 Cholinesterase 5280 ChEMBL 10.1016/j.ejmech.2017.07.077 10.7270/Q2Q52S78 28800459 Wang, J; Cai, P; Yang, XL; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456907 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456907&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145970790 433924174 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117550 CCN(Cc1ccccc1)Cc1ccc(NC(=O)Cc2ccc(O)c(O)c2)cc1 InChI=1S/C24H26N2O3/c1-2-26(16-18-6-4-3-5-7-18)17-19-8-11-21(12-9-19)25-24(29)15-20-10-13-22(27)23(28)14-20/h3-14,27-28H,2,15-17H2,1H3,(H,25,29) NXGXSRJQERFLRS-UHFFFAOYSA-N 50456910 CHEMBL4212229 Cholinesterase 5950 ChEMBL 10.1016/j.ejmech.2017.07.077 10.7270/Q2Q52S78 28800459 Wang, J; Cai, P; Yang, XL; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456910 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456910&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145967436 433924177 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117554 CCN(Cc1ccccc1)Cc1ccc(NC(=O)Cc2ccccc2)cc1 InChI=1S/C24H26N2O/c1-2-26(18-21-11-7-4-8-12-21)19-22-13-15-23(16-14-22)25-24(27)17-20-9-5-3-6-10-20/h3-16H,2,17-19H2,1H3,(H,25,27) FELMACAEBYKKOI-UHFFFAOYSA-N 50456909 CHEMBL4215728 Cholinesterase 13950 ChEMBL 10.1016/j.ejmech.2017.07.077 10.7270/Q2Q52S78 28800459 Wang, J; Cai, P; Yang, XL; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456909 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456909&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145972095 433924176 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117561 CN(Cc1ccccc1)Cc1ccc(NC(=O)\C=C\c2ccccc2)cc1 InChI=1S/C24H24N2O/c1-26(18-21-10-6-3-7-11-21)19-22-12-15-23(16-13-22)25-24(27)17-14-20-8-4-2-5-9-20/h2-17H,18-19H2,1H3,(H,25,27)/b17-14+ KMEVTHHMQHAIQF-SAPNQHFASA-N 50456921 CHEMBL4215324 Cholinesterase 8210 ChEMBL 10.1016/j.ejmech.2017.07.077 10.7270/Q2Q52S78 28800459 Wang, J; Cai, P; Yang, XL; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456921 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456921&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145973924 433924188 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117568 COc1ccc(\C=C\C(=O)Nc2ccc(CN(C)Cc3ccccc3)cc2)cc1 InChI=1S/C25H26N2O2/c1-27(18-21-6-4-3-5-7-21)19-22-8-13-23(14-9-22)26-25(28)17-12-20-10-15-24(29-2)16-11-20/h3-17H,18-19H2,1-2H3,(H,26,28)/b17-12+ DBXKIEJEFALTHY-SFQUDFHCSA-N 50195870 CHEMBL3978533 Cholinesterase 8210 ChEMBL 10.1016/j.ejmech.2017.07.077 10.7270/Q2Q52S78 28800459 Wang, J; Cai, P; Yang, XL; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50195870 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50195870&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134152913 104077817 CHEMBL3978533 ZINC27215469 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117572 CCN(Cc1ccccc1)Cc1ccc(NC(=O)c2ccccc2)cc1 InChI=1S/C23H24N2O/c1-2-25(17-19-9-5-3-6-10-19)18-20-13-15-22(16-14-20)24-23(26)21-11-7-4-8-12-21/h3-16H,2,17-18H2,1H3,(H,24,26) ZXNVYPMWMISWNF-UHFFFAOYSA-N 50456922 CHEMBL4207272 Cholinesterase 13920 ChEMBL 10.1016/j.ejmech.2017.07.077 10.7270/Q2Q52S78 28800459 Wang, J; Cai, P; Yang, XL; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456922 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456922&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145976681 433924189 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117573 CCN(Cc1ccccc1)Cc1ccc(NC(=O)Cc2ccc(O)cc2)cc1 InChI=1S/C24H26N2O2/c1-2-26(17-20-6-4-3-5-7-20)18-21-8-12-22(13-9-21)25-24(28)16-19-10-14-23(27)15-11-19/h3-15,27H,2,16-18H2,1H3,(H,25,28) CMCUYOUITXXJIA-UHFFFAOYSA-N 50456920 CHEMBL4207876 Cholinesterase 4450 ChEMBL 10.1016/j.ejmech.2017.07.077 10.7270/Q2Q52S78 28800459 Wang, J; Cai, P; Yang, XL; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456920 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456920&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145977206 433924187 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117574 CCN(Cc1ccccc1)Cc1ccc(NC(=O)Cc2ccc(OC)c(O)c2)cc1 InChI=1S/C25H28N2O3/c1-3-27(17-19-7-5-4-6-8-19)18-20-9-12-22(13-10-20)26-25(29)16-21-11-14-24(30-2)23(28)15-21/h4-15,28H,3,16-18H2,1-2H3,(H,26,29) FBMQROMIUKCEIV-UHFFFAOYSA-N 50456912 CHEMBL4214755 Cholinesterase 3290 ChEMBL 10.1016/j.ejmech.2017.07.077 10.7270/Q2Q52S78 28800459 Wang, J; Cai, P; Yang, XL; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456912 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456912&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145972994 433924179 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51117575 COc1cc(\C=C\C(=O)Nc2ccc(CN(C)Cc3ccccc3)cc2)ccc1O InChI=1S/C25H26N2O3/c1-27(17-20-6-4-3-5-7-20)18-21-8-12-22(13-9-21)26-25(29)15-11-19-10-14-23(28)24(16-19)30-2/h3-16,28H,17-18H2,1-2H3,(H,26,29)/b15-11+ IXTWYODPRCKMGS-RVDMUPIBSA-N 50456913 CHEMBL3891025 Cholinesterase 8780 ChEMBL 10.1016/j.ejmech.2017.07.077 10.7270/Q2Q52S78 28800459 Wang, J; Cai, P; Yang, XL; Li, F; Wu, JJ; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50456913 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50456913&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134137541 433924180 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51054184 O=C1CN(C(=O)CN1S(=O)(=O)c1ccccc1)S(=O)(=O)c1ccccc1 InChI=1S/C16H14N2O6S2/c19-15-12-18(26(23,24)14-9-5-2-6-10-14)16(20)11-17(15)25(21,22)13-7-3-1-4-8-13/h1-10H,11-12H2 NHASEHCTEAENPG-UHFFFAOYSA-N 50458341 CHEMBL4213483 Cholinesterase >200 ChEMBL 10.1016/j.ejmech.2018.02.078 10.7270/Q2SJ1P72 29524731 Kumar, D; Gupta, SK; Ganeshpurkar, A; Gutti, G; Krishnamurthy, S; Modi, G; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458341 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458341&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12037467 433925606 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51054211 Clc1cccc(c1)S(=O)(=O)N1CC(=O)N(CC1=O)S(=O)(=O)c1cccc(Cl)c1 InChI=1S/C16H12Cl2N2O6S2/c17-11-3-1-5-13(7-11)27(23,24)19-9-16(22)20(10-15(19)21)28(25,26)14-6-2-4-12(18)8-14/h1-8H,9-10H2 ZZGFEYLJMXLEMZ-UHFFFAOYSA-N 50458342 CHEMBL4212010 Cholinesterase 197 ChEMBL 10.1016/j.ejmech.2018.02.078 10.7270/Q2SJ1P72 29524731 Kumar, D; Gupta, SK; Ganeshpurkar, A; Gutti, G; Krishnamurthy, S; Modi, G; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458342 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458342&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145965758 433925607 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51054235 Brc1ccc(cc1)S(=O)(=O)N1CC(=O)N(CC1=O)S(=O)(=O)c1ccc(Br)cc1 InChI=1S/C16H12Br2N2O6S2/c17-11-1-5-13(6-2-11)27(23,24)19-9-16(22)20(10-15(19)21)28(25,26)14-7-3-12(18)4-8-14/h1-8H,9-10H2 BRYVXLBZZFSISP-UHFFFAOYSA-N 50458329 CHEMBL4216989 Cholinesterase 191 ChEMBL 10.1016/j.ejmech.2018.02.078 10.7270/Q2SJ1P72 29524731 Kumar, D; Gupta, SK; Ganeshpurkar, A; Gutti, G; Krishnamurthy, S; Modi, G; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458329 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458329&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145973991 433925594 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51054238 Nc1ccc(cc1)S(=O)(=O)N1CC(=O)N(CC1=O)S(=O)(=O)c1ccc(N)cc1 InChI=1S/C16H16N4O6S2/c17-11-1-5-13(6-2-11)27(23,24)19-9-16(22)20(10-15(19)21)28(25,26)14-7-3-12(18)4-8-14/h1-8H,9-10,17-18H2 HLYKQNMYOPEKGU-UHFFFAOYSA-N 50458330 CHEMBL4213539 Cholinesterase >200 ChEMBL 10.1016/j.ejmech.2018.02.078 10.7270/Q2SJ1P72 29524731 Kumar, D; Gupta, SK; Ganeshpurkar, A; Gutti, G; Krishnamurthy, S; Modi, G; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458330 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458330&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145965593 433925595 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51054245 Nc1ccc(cc1)S(=O)(=O)N1C(C(=O)N(C(C1=O)c1ccccc1)S(=O)(=O)c1ccc(N)cc1)c1ccccc1 InChI=1S/C28H24N4O6S2/c29-21-11-15-23(16-12-21)39(35,36)31-25(19-7-3-1-4-8-19)27(33)32(26(28(31)34)20-9-5-2-6-10-20)40(37,38)24-17-13-22(30)14-18-24/h1-18,25-26H,29-30H2 QUOALYCSYFNATG-UHFFFAOYSA-N 50458343 CHEMBL4215499 Cholinesterase >200 ChEMBL 10.1016/j.ejmech.2018.02.078 10.7270/Q2SJ1P72 29524731 Kumar, D; Gupta, SK; Ganeshpurkar, A; Gutti, G; Krishnamurthy, S; Modi, G; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458343 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458343&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145973471 433925608 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51054246 [O-][N+](=O)c1ccc(cc1)S(=O)(=O)N1C(C(=O)N(C(C1=O)c1ccccc1)S(=O)(=O)c1ccc(cc1)[N+]([O-])=O)c1ccccc1 InChI=1S/C28H20N4O10S2/c33-27-25(19-7-3-1-4-8-19)29(43(39,40)23-15-11-21(12-16-23)31(35)36)28(34)26(20-9-5-2-6-10-20)30(27)44(41,42)24-17-13-22(14-18-24)32(37)38/h1-18,25-26H JREVZBFUZBCAHI-UHFFFAOYSA-N 50458327 CHEMBL4212851 Cholinesterase 176 ChEMBL 10.1016/j.ejmech.2018.02.078 10.7270/Q2SJ1P72 29524731 Kumar, D; Gupta, SK; Ganeshpurkar, A; Gutti, G; Krishnamurthy, S; Modi, G; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458327 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458327&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145966498 433925592 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51054657 Cc1ccc(cc1)S(=O)(=O)N1C(C(=O)N(C(C1=O)c1ccccc1)S(=O)(=O)c1ccc(C)cc1)c1ccccc1 InChI=1S/C30H26N2O6S2/c1-21-13-17-25(18-14-21)39(35,36)31-27(23-9-5-3-6-10-23)30(34)32(28(29(31)33)24-11-7-4-8-12-24)40(37,38)26-19-15-22(2)16-20-26/h3-20,27-28H,1-2H3 MOPJXEDQQIUQNN-UHFFFAOYSA-N 50458334 CHEMBL4208373 Cholinesterase >200 ChEMBL 10.1016/j.ejmech.2018.02.078 10.7270/Q2SJ1P72 29524731 Kumar, D; Gupta, SK; Ganeshpurkar, A; Gutti, G; Krishnamurthy, S; Modi, G; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458334 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458334&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145976981 433925599 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51054658 Cc1cccc(c1)S(=O)(=O)N1C(C(=O)N(C(C1=O)c1ccccc1)S(=O)(=O)c1cccc(C)c1)c1ccccc1 InChI=1S/C30H26N2O6S2/c1-21-11-9-17-25(19-21)39(35,36)31-27(23-13-5-3-6-14-23)30(34)32(28(29(31)33)24-15-7-4-8-16-24)40(37,38)26-18-10-12-22(2)20-26/h3-20,27-28H,1-2H3 WARRTXYFSVNHOR-UHFFFAOYSA-N 50458344 CHEMBL4217715 Cholinesterase >200 ChEMBL 10.1016/j.ejmech.2018.02.078 10.7270/Q2SJ1P72 29524731 Kumar, D; Gupta, SK; Ganeshpurkar, A; Gutti, G; Krishnamurthy, S; Modi, G; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458344 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458344&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145974965 433925609 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51054659 Oc1ccc(cc1)S(=O)(=O)N1C(Cc2ccccc2)C(=O)N(C(Cc2ccccc2)C1=O)S(=O)(=O)c1ccc(O)cc1 InChI=1S/C30H26N2O8S2/c33-23-11-15-25(16-12-23)41(37,38)31-27(19-21-7-3-1-4-8-21)29(35)32(42(39,40)26-17-13-24(34)14-18-26)28(30(31)36)20-22-9-5-2-6-10-22/h1-18,27-28,33-34H,19-20H2 JIDIUFAYOFZXKK-UHFFFAOYSA-N 50458336 CHEMBL4209854 Cholinesterase 199 ChEMBL 10.1016/j.ejmech.2018.02.078 10.7270/Q2SJ1P72 29524731 Kumar, D; Gupta, SK; Ganeshpurkar, A; Gutti, G; Krishnamurthy, S; Modi, G; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458336 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458336&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145963828 433925601 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055145 [O-][N+](=O)c1ccc(cc1)S(=O)(=O)N1C(Cc2ccccc2)C(=O)N(C(Cc2ccccc2)C1=O)S(=O)(=O)c1ccc(cc1)[N+]([O-])=O InChI=1S/C30H24N4O10S2/c35-29-27(19-21-7-3-1-4-8-21)31(45(41,42)25-15-11-23(12-16-25)33(37)38)30(36)28(20-22-9-5-2-6-10-22)32(29)46(43,44)26-17-13-24(14-18-26)34(39)40/h1-18,27-28H,19-20H2 BLAOWEJIYCDMGB-UHFFFAOYSA-N 50458338 CHEMBL4212321 Cholinesterase 163 ChEMBL 10.1016/j.ejmech.2018.02.078 10.7270/Q2SJ1P72 29524731 Kumar, D; Gupta, SK; Ganeshpurkar, A; Gutti, G; Krishnamurthy, S; Modi, G; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458338 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458338&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145966951 433925603 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055146 Brc1ccc(cc1)S(=O)(=O)N1C(Cc2ccccc2)C(=O)N(C(Cc2ccccc2)C1=O)S(=O)(=O)c1ccc(Br)cc1 InChI=1S/C30H24Br2N2O6S2/c31-23-11-15-25(16-12-23)41(37,38)33-27(19-21-7-3-1-4-8-21)29(35)34(42(39,40)26-17-13-24(32)14-18-26)28(30(33)36)20-22-9-5-2-6-10-22/h1-18,27-28H,19-20H2 OOQRCNGGNKHHNX-UHFFFAOYSA-N 50458345 CHEMBL4211783 Cholinesterase 181 ChEMBL 10.1016/j.ejmech.2018.02.078 10.7270/Q2SJ1P72 29524731 Kumar, D; Gupta, SK; Ganeshpurkar, A; Gutti, G; Krishnamurthy, S; Modi, G; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458345 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458345&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145963892 433925610 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055153 CCCS(=O)(=O)N1CC(=O)N(CC1=O)S(=O)(=O)CCC InChI=1S/C10H18N2O6S2/c1-3-5-19(15,16)11-7-10(14)12(8-9(11)13)20(17,18)6-4-2/h3-8H2,1-2H3 QAJJUEGEGCSINW-UHFFFAOYSA-N 50458340 CHEMBL4204702 Cholinesterase >200 ChEMBL 10.1016/j.ejmech.2018.02.078 10.7270/Q2SJ1P72 29524731 Kumar, D; Gupta, SK; Ganeshpurkar, A; Gutti, G; Krishnamurthy, S; Modi, G; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458340 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458340&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145977825 433925605 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055691 Cc1ccc(cc1)S(=O)(=O)N1CC(=O)N(CC1=O)S(=O)(=O)c1ccc(C)cc1 InChI=1S/C18H18N2O6S2/c1-13-3-7-15(8-4-13)27(23,24)19-11-18(22)20(12-17(19)21)28(25,26)16-9-5-14(2)6-10-16/h3-10H,11-12H2,1-2H3 DAFVMWVFXRJGCI-UHFFFAOYSA-N 50458346 CHEMBL4216463 Cholinesterase >200 ChEMBL 10.1016/j.ejmech.2018.02.078 10.7270/Q2SJ1P72 29524731 Kumar, D; Gupta, SK; Ganeshpurkar, A; Gutti, G; Krishnamurthy, S; Modi, G; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458346 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458346&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 285263 433925611 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055692 Brc1cccc(c1)S(=O)(=O)N1C(C(=O)N(C(C1=O)c1ccccc1)S(=O)(=O)c1cccc(Br)c1)c1ccccc1 InChI=1S/C28H20Br2N2O6S2/c29-21-13-7-15-23(17-21)39(35,36)31-25(19-9-3-1-4-10-19)27(33)32(26(28(31)34)20-11-5-2-6-12-20)40(37,38)24-16-8-14-22(30)18-24/h1-18,25-26H CMHZFBFUKIIWSL-UHFFFAOYSA-N 50458335 CHEMBL4213796 Cholinesterase 193 ChEMBL 10.1016/j.ejmech.2018.02.078 10.7270/Q2SJ1P72 29524731 Kumar, D; Gupta, SK; Ganeshpurkar, A; Gutti, G; Krishnamurthy, S; Modi, G; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458335 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458335&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145965824 433925600 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055693 CCCCS(=O)(=O)N1CC(=O)N(CC1=O)S(=O)(=O)CCCC InChI=1S/C12H22N2O6S2/c1-3-5-7-21(17,18)13-9-12(16)14(10-11(13)15)22(19,20)8-6-4-2/h3-10H2,1-2H3 YRHRSRQHPDGLOK-UHFFFAOYSA-N 50458349 CHEMBL4205187 Cholinesterase >200 ChEMBL 10.1016/j.ejmech.2018.02.078 10.7270/Q2SJ1P72 29524731 Kumar, D; Gupta, SK; Ganeshpurkar, A; Gutti, G; Krishnamurthy, S; Modi, G; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458349 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458349&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145978296 433925614 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055699 Fc1ccc(cc1)S(=O)(=O)N1CC(=O)N(CC1=O)S(=O)(=O)c1ccc(F)cc1 InChI=1S/C16H12F2N2O6S2/c17-11-1-5-13(6-2-11)27(23,24)19-9-16(22)20(10-15(19)21)28(25,26)14-7-3-12(18)4-8-14/h1-8H,9-10H2 VBWOPNFOLDOQMD-UHFFFAOYSA-N 50458331 CHEMBL4204268 Cholinesterase 186 ChEMBL 10.1016/j.ejmech.2018.02.078 10.7270/Q2SJ1P72 29524731 Kumar, D; Gupta, SK; Ganeshpurkar, A; Gutti, G; Krishnamurthy, S; Modi, G; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458331 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458331&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145975098 433925596 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055700 Oc1cccc(c1)S(=O)(=O)N1C(Cc2ccccc2)C(=O)N(C(Cc2ccccc2)C1=O)S(=O)(=O)c1cccc(O)c1 InChI=1S/C30H26N2O8S2/c33-23-13-7-15-25(19-23)41(37,38)31-27(17-21-9-3-1-4-10-21)29(35)32(42(39,40)26-16-8-14-24(34)20-26)28(30(31)36)18-22-11-5-2-6-12-22/h1-16,19-20,27-28,33-34H,17-18H2 IFEDYZQSQFDVSG-UHFFFAOYSA-N 50458337 CHEMBL4204978 Cholinesterase >200 ChEMBL 10.1016/j.ejmech.2018.02.078 10.7270/Q2SJ1P72 29524731 Kumar, D; Gupta, SK; Ganeshpurkar, A; Gutti, G; Krishnamurthy, S; Modi, G; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458337 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458337&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145977843 433925602 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055713 COc1ccc(cc1)S(=O)(=O)N1CC(=O)N(CC1=O)S(=O)(=O)c1ccc(OC)cc1 InChI=1S/C18H18N2O8S2/c1-27-13-3-7-15(8-4-13)29(23,24)19-11-18(22)20(12-17(19)21)30(25,26)16-9-5-14(28-2)6-10-16/h3-10H,11-12H2,1-2H3 LMKHBMPBGCHZPI-UHFFFAOYSA-N 50458347 CHEMBL4208599 Cholinesterase >200 ChEMBL 10.1016/j.ejmech.2018.02.078 10.7270/Q2SJ1P72 29524731 Kumar, D; Gupta, SK; Ganeshpurkar, A; Gutti, G; Krishnamurthy, S; Modi, G; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458347 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458347&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145963779 433925612 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055714 Clc1ccc(cc1)S(=O)(=O)N1C(C(=O)N(C(C1=O)c1ccccc1)S(=O)(=O)c1ccc(Cl)cc1)c1ccccc1 InChI=1S/C28H20Cl2N2O6S2/c29-21-11-15-23(16-12-21)39(35,36)31-25(19-7-3-1-4-8-19)27(33)32(26(28(31)34)20-9-5-2-6-10-20)40(37,38)24-17-13-22(30)14-18-24/h1-18,25-26H AWDIEUWPIRIVDC-UHFFFAOYSA-N 50458333 CHEMBL4210820 Cholinesterase 161 ChEMBL 10.1016/j.ejmech.2018.02.078 10.7270/Q2SJ1P72 29524731 Kumar, D; Gupta, SK; Ganeshpurkar, A; Gutti, G; Krishnamurthy, S; Modi, G; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458333 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458333&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145967366 433925598 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055715 Brc1ccc(cc1)S(=O)(=O)N1C(C(=O)N(C(C1=O)c1ccccc1)S(=O)(=O)c1ccc(Br)cc1)c1ccccc1 InChI=1S/C28H20Br2N2O6S2/c29-21-11-15-23(16-12-21)39(35,36)31-25(19-7-3-1-4-8-19)27(33)32(26(28(31)34)20-9-5-2-6-10-20)40(37,38)24-17-13-22(30)14-18-24/h1-18,25-26H PFDDVBQKOQRERD-UHFFFAOYSA-N 50458350 CHEMBL4212764 Cholinesterase 183 ChEMBL 10.1016/j.ejmech.2018.02.078 10.7270/Q2SJ1P72 29524731 Kumar, D; Gupta, SK; Ganeshpurkar, A; Gutti, G; Krishnamurthy, S; Modi, G; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458350 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458350&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145966492 433925615 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055716 Brc1cccc(c1)S(=O)(=O)N1C(Cc2ccccc2)C(=O)N(C(Cc2ccccc2)C1=O)S(=O)(=O)c1cccc(Br)c1 InChI=1S/C30H24Br2N2O6S2/c31-23-13-7-15-25(19-23)41(37,38)33-27(17-21-9-3-1-4-10-21)29(35)34(42(39,40)26-16-8-14-24(32)20-26)28(30(33)36)18-22-11-5-2-6-12-22/h1-16,19-20,27-28H,17-18H2 CVKQJOMLCYQJQV-UHFFFAOYSA-N 50458339 CHEMBL4216896 Cholinesterase 191 ChEMBL 10.1016/j.ejmech.2018.02.078 10.7270/Q2SJ1P72 29524731 Kumar, D; Gupta, SK; Ganeshpurkar, A; Gutti, G; Krishnamurthy, S; Modi, G; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458339 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458339&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145973750 433925604 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055747 Clc1ccc(cc1)S(=O)(=O)N1C(Cc2ccccc2)C(=O)N(C(Cc2ccccc2)C1=O)S(=O)(=O)c1ccc(Cl)cc1 InChI=1S/C30H24Cl2N2O6S2/c31-23-11-15-25(16-12-23)41(37,38)33-27(19-21-7-3-1-4-8-21)29(35)34(42(39,40)26-17-13-24(32)14-18-26)28(30(33)36)20-22-9-5-2-6-10-22/h1-18,27-28H,19-20H2 AUGUMRHDSHYMFZ-UHFFFAOYSA-N 50458348 CHEMBL4207976 Cholinesterase 158 ChEMBL 10.1016/j.ejmech.2018.02.078 10.7270/Q2SJ1P72 29524731 Kumar, D; Gupta, SK; Ganeshpurkar, A; Gutti, G; Krishnamurthy, S; Modi, G; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458348 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458348&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145977208 433925613 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055758 Clc1ccc(cc1)S(=O)(=O)N1CC(=O)N(CC1=O)S(=O)(=O)c1ccc(Cl)cc1 InChI=1S/C16H12Cl2N2O6S2/c17-11-1-5-13(6-2-11)27(23,24)19-9-16(22)20(10-15(19)21)28(25,26)14-7-3-12(18)4-8-14/h1-8H,9-10H2 NKHCRCPMJAYOND-UHFFFAOYSA-N 50458328 CHEMBL4204787 Cholinesterase 180 ChEMBL 10.1016/j.ejmech.2018.02.078 10.7270/Q2SJ1P72 29524731 Kumar, D; Gupta, SK; Ganeshpurkar, A; Gutti, G; Krishnamurthy, S; Modi, G; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458328 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458328&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145977588 433925593 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51055759 Oc1ccc(cc1)S(=O)(=O)N1C(C(=O)N(C(C1=O)c1ccccc1)S(=O)(=O)c1ccc(O)cc1)c1ccccc1 InChI=1S/C28H22N2O8S2/c31-21-11-15-23(16-12-21)39(35,36)29-25(19-7-3-1-4-8-19)27(33)30(26(28(29)34)20-9-5-2-6-10-20)40(37,38)24-17-13-22(32)14-18-24/h1-18,25-26,31-32H FZSXKKGJJJPNLY-UHFFFAOYSA-N 50458332 CHEMBL4209133 Cholinesterase >200 ChEMBL 10.1016/j.ejmech.2018.02.078 10.7270/Q2SJ1P72 29524731 Kumar, D; Gupta, SK; Ganeshpurkar, A; Gutti, G; Krishnamurthy, S; Modi, G; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458332 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458332&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145964255 433925597 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101657 [Cl-].Clc1ccc(C[n+]2ccc(Cn3c4CCCCc4c4ccccc34)cc2)cc1 InChI=1S/C11H17NO2S2/c1-6-8(13)12-7(9(14)15-6)10(2,3)16-11(12,4)5/h6-7H,1-5H3 CEZPOFIGLMNQMP-UHFFFAOYSA-N 50421750 CHEMBL4169890 Cholinesterase 2100 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50421750 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50421750&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145955347 164150625 ZINC27880140 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101658 [Cl-].Cc1ccccc1C[n+]1cccc(Cn2c3CCCCc3c3ccccc23)c1 InChI=1S/C7H9NO2S2/c1-4-6(9)8-3-11-2-5(8)7(10)12-4/h4-5H,2-3H2,1H3 QTWHVXCQSZHINS-UHFFFAOYSA-N 50421748 CHEMBL4159886 Cholinesterase 380 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50421748 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50421748&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145958122 164150623 ZINC27874352 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991006 Cc1cc(N2CCN(CC2)c2nc(NC3CC3)nc(Nc3cccc(c3)C(F)(F)F)n2)n2ncnc2n1 InChI=1S/C23H24F3N11/c1-14-11-18(37-21(29-14)27-13-28-37)35-7-9-36(10-8-35)22-33-19(30-16-5-6-16)32-20(34-22)31-17-4-2-3-15(12-17)23(24,25)26/h2-4,11-13,16H,5-10H2,1H3,(H2,30,31,32,33,34) NDKYGYGMHJDWIS-UHFFFAOYSA-N 50282173 CHEMBL4176666 Cholinesterase 1900 ChEMBL 10.1016/j.ejmech.2017.04.064 10.7270/Q2G73H9R 28478343 Jameel, E; Meena, P; Maqbool, M; Kumar, J; Ahmed, W; Mumtazuddin, S; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282173 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282173&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145973162 104123847 ZINC29414918 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991008 Cc1cc(N2CCN(CC2)c2nc(Cl)nc(Nc3cccc(c3)C(F)(F)F)n2)n2ncnc2n1 InChI=1S/C20H18ClF3N10/c1-12-9-15(34-18(27-12)25-11-26-34)32-5-7-33(8-6-32)19-30-16(21)29-17(31-19)28-14-4-2-3-13(10-14)20(22,23)24/h2-4,9-11H,5-8H2,1H3,(H,28,29,30,31) GSLAMSZEEYMKPM-UHFFFAOYSA-N 50282171 CHEMBL4176742 Cholinesterase 1880 ChEMBL 10.1016/j.ejmech.2017.04.064 10.7270/Q2G73H9R 28478343 Jameel, E; Meena, P; Maqbool, M; Kumar, J; Ahmed, W; Mumtazuddin, S; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282171 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282171&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145975729 104123845 ZINC29415505 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991015 COc1ccc(Nc2nc(Cl)nc(Nc3ccc(F)c(Cl)c3)n2)cc1 InChI=1S/C16H12Cl2FN5O/c1-25-11-5-2-9(3-6-11)20-15-22-14(18)23-16(24-15)21-10-4-7-13(19)12(17)8-10/h2-8H,1H3,(H2,20,21,22,23,24) XQXWVVKTZURFKG-UHFFFAOYSA-N 50282178 CHEMBL4174114 Cholinesterase 1639 ChEMBL 10.1016/j.ejmech.2017.04.064 10.7270/Q2G73H9R 28478343 Jameel, E; Meena, P; Maqbool, M; Kumar, J; Ahmed, W; Mumtazuddin, S; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282178 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282178&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145949548 104123852 ZINC44181533 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991020 Cc1ccc(Nc2nc(Cl)nc(Nc3ccc(F)c(Cl)c3)n2)cc1 InChI=1S/C16H12Cl2FN5/c1-9-2-4-10(5-3-9)20-15-22-14(18)23-16(24-15)21-11-6-7-13(19)12(17)8-11/h2-8H,1H3,(H2,20,21,22,23,24) ZYFUQXCMILKUMR-UHFFFAOYSA-N 50282174 CHEMBL4163412 Cholinesterase 2770 ChEMBL 10.1016/j.ejmech.2017.04.064 10.7270/Q2G73H9R 28478343 Jameel, E; Meena, P; Maqbool, M; Kumar, J; Ahmed, W; Mumtazuddin, S; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282174 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282174&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145958030 104123848 ZINC29463790 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991021 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 56 ChEMBL 10.1016/j.ejmech.2017.04.064 10.7270/Q2G73H9R 28478343 Jameel, E; Meena, P; Maqbool, M; Kumar, J; Ahmed, W; Mumtazuddin, S; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991022 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 2720 ChEMBL 10.1016/j.ejmech.2017.04.064 10.7270/Q2G73H9R 28478343 Jameel, E; Meena, P; Maqbool, M; Kumar, J; Ahmed, W; Mumtazuddin, S; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991042 Fc1ccc(Nc2nc(Cl)nc(Nc3cccc(c3)C(F)(F)F)n2)cc1Cl InChI=1S/C16H9Cl2F4N5/c17-11-7-10(4-5-12(11)19)24-15-26-13(18)25-14(27-15)23-9-3-1-2-8(6-9)16(20,21)22/h1-7H,(H2,23,24,25,26,27) FSVKMMRKGGWQQP-UHFFFAOYSA-N 50282185 CHEMBL4177486 Cholinesterase 3983 ChEMBL 10.1016/j.ejmech.2017.04.064 10.7270/Q2G73H9R 28478343 Jameel, E; Meena, P; Maqbool, M; Kumar, J; Ahmed, W; Mumtazuddin, S; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282185 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282185&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145971298 104123859 ZINC29475033 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991043 COc1ccc(Nc2nc(Cl)nc(Nc3cccc(c3)C(F)(F)F)n2)cc1 InChI=1S/C17H13ClF3N5O/c1-27-13-7-5-11(6-8-13)22-15-24-14(18)25-16(26-15)23-12-4-2-3-10(9-12)17(19,20)21/h2-9H,1H3,(H2,22,23,24,25,26) WEEBHADDNRNTDF-UHFFFAOYSA-N 50282180 CHEMBL4166865 Cholinesterase 2961 ChEMBL 10.1016/j.ejmech.2017.04.064 10.7270/Q2G73H9R 28478343 Jameel, E; Meena, P; Maqbool, M; Kumar, J; Ahmed, W; Mumtazuddin, S; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282180 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282180&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3620709 104123854 ZINC44324102 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991044 Cc1ccc(Nc2nc(Cl)nc(Nc3cccc(c3)C(F)(F)F)n2)cc1 InChI=1S/C17H13ClF3N5/c1-10-5-7-12(8-6-10)22-15-24-14(18)25-16(26-15)23-13-4-2-3-11(9-13)17(19,20)21/h2-9H,1H3,(H2,22,23,24,25,26) KZTIIZPVRFVAMJ-UHFFFAOYSA-N 50282175 CHEMBL4162346 Cholinesterase 2090 ChEMBL 10.1016/j.ejmech.2017.04.064 10.7270/Q2G73H9R 28478343 Jameel, E; Meena, P; Maqbool, M; Kumar, J; Ahmed, W; Mumtazuddin, S; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282175 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282175&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145958479 104123849 ZINC29472300 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991045 Fc1ccc(Nc2nc(Cl)nc(Nc3cccc(c3)C(F)(F)F)n2)cc1 InChI=1S/C16H10ClF4N5/c17-13-24-14(22-11-6-4-10(18)5-7-11)26-15(25-13)23-12-3-1-2-9(8-12)16(19,20)21/h1-8H,(H2,22,23,24,25,26) HADBPXNQQGFTKU-UHFFFAOYSA-N 50282186 CHEMBL4170265 Cholinesterase 2450 ChEMBL 10.1016/j.ejmech.2017.04.064 10.7270/Q2G73H9R 28478343 Jameel, E; Meena, P; Maqbool, M; Kumar, J; Ahmed, W; Mumtazuddin, S; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282186 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282186&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145956279 104123860 74799 ZINC04899447 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991046 Fc1ccc(Nc2nc(Cl)nc(Nc3cccc(c3)C(F)(F)F)n2)c(F)c1 InChI=1S/C16H9ClF5N5/c17-13-25-14(23-10-3-1-2-8(6-10)16(20,21)22)27-15(26-13)24-12-5-4-9(18)7-11(12)19/h1-7H,(H2,23,24,25,26,27) HUKXJIDZZZGPDM-UHFFFAOYSA-N 50282184 CHEMBL4175196 Cholinesterase 4330 ChEMBL 10.1016/j.ejmech.2017.04.064 10.7270/Q2G73H9R 28478343 Jameel, E; Meena, P; Maqbool, M; Kumar, J; Ahmed, W; Mumtazuddin, S; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282184 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282184&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145952153 104123858 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991047 FC(F)(F)c1cccc(Nc2nc(NC3CC3)nc(n2)N2CCNCC2)c1 InChI=1S/C17H20F3N7/c18-17(19,20)11-2-1-3-13(10-11)23-15-24-14(22-12-4-5-12)25-16(26-15)27-8-6-21-7-9-27/h1-3,10,12,21H,4-9H2,(H2,22,23,24,25,26) NCWADNOZGFPCTN-UHFFFAOYSA-N 50282183 CHEMBL4167322 Cholinesterase 3650 ChEMBL 10.1016/j.ejmech.2017.04.064 10.7270/Q2G73H9R 28478343 Jameel, E; Meena, P; Maqbool, M; Kumar, J; Ahmed, W; Mumtazuddin, S; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282183 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282183&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145952951 104123857 ZINC29469247 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991048 Cc1ccc(Nc2nc(Nc3ccc(F)c(Cl)c3)nc(n2)N2CCN(CC2)c2cc(C)nc3ncnn23)cc1 InChI=1S/C26H25ClFN11/c1-16-3-5-18(6-4-16)32-23-34-24(33-19-7-8-21(28)20(27)14-19)36-26(35-23)38-11-9-37(10-12-38)22-13-17(2)31-25-29-15-30-39(22)25/h3-8,13-15H,9-12H2,1-2H3,(H2,32,33,34,35,36) PZHDBHCJUXSDHS-UHFFFAOYSA-N 50282176 CHEMBL4169871 Cholinesterase 3782 ChEMBL 10.1016/j.ejmech.2017.04.064 10.7270/Q2G73H9R 28478343 Jameel, E; Meena, P; Maqbool, M; Kumar, J; Ahmed, W; Mumtazuddin, S; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282176 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282176&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145954662 104123850 ZINC29415153 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991049 Cc1cc(N2CCN(CC2)c2nc(Nc3ccc(F)cc3)nc(Nc3cccc(c3)C(F)(F)F)n2)n2ncnc2n1 InChI=1S/C26H23F4N11/c1-16-13-21(41-24(33-16)31-15-32-41)39-9-11-40(12-10-39)25-37-22(34-19-7-5-18(27)6-8-19)36-23(38-25)35-20-4-2-3-17(14-20)26(28,29)30/h2-8,13-15H,9-12H2,1H3,(H2,34,35,36,37,38) SZGCDBYDVRQVBR-UHFFFAOYSA-N 50282172 CHEMBL4161947 Cholinesterase 2490 ChEMBL 10.1016/j.ejmech.2017.04.064 10.7270/Q2G73H9R 28478343 Jameel, E; Meena, P; Maqbool, M; Kumar, J; Ahmed, W; Mumtazuddin, S; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282172 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282172&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145958697 104123846 ZINC03789916 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991050 Cc1cc(N2CCN(CC2)c2nc(Nc3cccc(c3)C(F)(F)F)nc(Nc3ccc(F)c(Cl)c3)n2)n2ncnc2n1 InChI=1S/C26H22ClF4N11/c1-15-11-21(42-24(34-15)32-14-33-42)40-7-9-41(10-8-40)25-38-22(35-17-4-2-3-16(12-17)26(29,30)31)37-23(39-25)36-18-5-6-20(28)19(27)13-18/h2-6,11-14H,7-10H2,1H3,(H2,35,36,37,38,39) AKHIAHNIELGDSR-UHFFFAOYSA-N 50282187 CHEMBL4173299 Cholinesterase 2614 ChEMBL 10.1016/j.ejmech.2017.04.064 10.7270/Q2G73H9R 28478343 Jameel, E; Meena, P; Maqbool, M; Kumar, J; Ahmed, W; Mumtazuddin, S; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282187 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282187&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145951634 104123861 ZINC13541045 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991051 Cc1ccc(Nc2nc(Nc3cccc(c3)C(F)(F)F)nc(n2)N2CCN(CC2)c2cc(C)nc3ncnn23)cc1 InChI=1S/C27H26F3N11/c1-17-6-8-20(9-7-17)34-23-36-24(35-21-5-3-4-19(15-21)27(28,29)30)38-26(37-23)40-12-10-39(11-13-40)22-14-18(2)33-25-31-16-32-41(22)25/h3-9,14-16H,10-13H2,1-2H3,(H2,34,35,36,37,38) NHPROEHKJVDCPV-UHFFFAOYSA-N 50282188 CHEMBL4165386 Cholinesterase 1750 ChEMBL 10.1016/j.ejmech.2017.04.064 10.7270/Q2G73H9R 28478343 Jameel, E; Meena, P; Maqbool, M; Kumar, J; Ahmed, W; Mumtazuddin, S; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282188 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282188&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145954467 104123862 ZINC29474333 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991052 Cc1cc(N2CCN(CC2)c2nc(Cl)nc(Nc3ccccc3F)n2)n2ncnc2n1 InChI=1S/C19H18ClFN10/c1-12-10-15(31-18(24-12)22-11-23-31)29-6-8-30(9-7-29)19-27-16(20)26-17(28-19)25-14-5-3-2-4-13(14)21/h2-5,10-11H,6-9H2,1H3,(H,25,26,27,28) AVSHVVVPQDPTEP-UHFFFAOYSA-N 50282181 CHEMBL4168812 Cholinesterase 2230 ChEMBL 10.1016/j.ejmech.2017.04.064 10.7270/Q2G73H9R 28478343 Jameel, E; Meena, P; Maqbool, M; Kumar, J; Ahmed, W; Mumtazuddin, S; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282181 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282181&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145954140 104123855 ZINC29472156 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991053 Cc1cc(N2CCN(CC2)c2nc(Cl)nc(Nc3ccc(F)cc3)n2)n2ncnc2n1 InChI=1S/C19H18ClFN10/c1-12-10-15(31-18(24-12)22-11-23-31)29-6-8-30(9-7-29)19-27-16(20)26-17(28-19)25-14-4-2-13(21)3-5-14/h2-5,10-11H,6-9H2,1H3,(H,25,26,27,28) UUINGQHFCFDGCU-UHFFFAOYSA-N 50282182 CHEMBL4161552 Cholinesterase 930 ChEMBL 10.1016/j.ejmech.2017.04.064 10.7270/Q2G73H9R 28478343 Jameel, E; Meena, P; Maqbool, M; Kumar, J; Ahmed, W; Mumtazuddin, S; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282182 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282182&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145957466 104123856 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991054 COc1ccc(Nc2nc(Cl)nc(n2)N2CCN(CC2)c2cc(C)nc3ncnn23)cc1 InChI=1S/C20H21ClN10O/c1-13-11-16(31-19(24-13)22-12-23-31)29-7-9-30(10-8-29)20-27-17(21)26-18(28-20)25-14-3-5-15(32-2)6-4-14/h3-6,11-12H,7-10H2,1-2H3,(H,25,26,27,28) YHMGUHMAWJMHLB-UHFFFAOYSA-N 50282177 CHEMBL4172159 Cholinesterase 1520 ChEMBL 10.1016/j.ejmech.2017.04.064 10.7270/Q2G73H9R 28478343 Jameel, E; Meena, P; Maqbool, M; Kumar, J; Ahmed, W; Mumtazuddin, S; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282177 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282177&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145951162 104123851 ZINC44323283 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101659 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 350 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101661 [Br-].Cc1ccccc1C[n+]1ccc(Cn2c3CCCCc3c3ccccc23)cc1 InChI=1S/C13H19NO2S/c1-8-7-17-12(15)6-14(13(8)16)11-5-9-2-3-10(11)4-9/h8-11H,2-7H2,1H3 YNMYWLLFWVJYPI-UHFFFAOYSA-N 50421751 CHEMBL4174929 Cholinesterase 400 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50421751 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50421751&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145952355 164150626 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101662 [Cl-].Cc1cccc(C[n+]2ccc(Cn3c4CCCCc4c4ccccc34)cc2)c1 InChI=1S/C8H11NO2S2/c1-5-2-13-8(11)6-3-12-4-9(6)7(5)10/h5-6H,2-4H2,1H3/t5?,6-/m0/s1 ORZHASRWVCKXBQ-GDVGLLTNSA-N 50421752 CHEMBL4166704 Cholinesterase 240 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50421752 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50421752&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145953807 164150627 ZINC27886746 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101663 [Cl-].Cc1ccc(C[n+]2ccc(Cn3c4CCCCc4c4ccccc34)cc2)cc1 InChI=1S/C14H14ClNO2S/c15-11-7-3-6-10-13(11)19-12(17)8-16(14(10)18)9-4-1-2-5-9/h3,6-7,9H,1-2,4-5,8H2 YIWALYDBQDXAKF-UHFFFAOYSA-N 50421745 CHEMBL4165332 Cholinesterase 700 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50421745 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50421745&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145963751 164150620 ZINC27894293 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101664 [Cl-].Fc1ccccc1C[n+]1ccc(Cn2c3CCCCc3c3ccccc23)cc1 InChI=1S/C14H15NO2S/c1-9-8-18-14(17)12-6-10-4-2-3-5-11(10)7-15(12)13(9)16/h2-5,9,12H,6-8H2,1H3/t9-,12-/m0/s1 GWSDRJYGBYCJNK-CABZTGNLSA-N 50421753 CHEMBL4175629 Cholinesterase 630 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50421753 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50421753&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145974528 164150628 ZINC27877871 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101665 [Br-].Fc1cccc(C[n+]2ccc(Cn3c4CCCCc4c4ccccc34)cc2)c1 InChI=1S/C8H11NO2S/c1-5-7(10)9-4-2-3-6(9)8(11)12-5/h5-6H,2-4H2,1H3/t5?,6-/m0/s1 BWUFFNRDKQQEQQ-GDVGLLTNSA-N 50421754 CHEMBL4172701 Cholinesterase 980 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50421754 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50421754&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145952470 164150629 ZINC27880114 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101666 [Cl-].Fc1ccc(C[n+]2ccc(Cn3c4CCCCc4c4ccccc34)cc2)cc1 InChI=1S/C14H15NO2S/c1-9-12(16)15-8-11-6-4-3-5-10(11)7-14(15,2)13(17)18-9/h3-6,9H,7-8H2,1-2H3/t9-,14+/m0/s1 LSFYYMKSZJZJFS-LKFCYVNXSA-N 50421746 CHEMBL4175199 Cholinesterase 730 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50421746 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50421746&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145952367 164150621 ZINC27877624 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101667 [Br-].C(c1cc[n+](Cc2ccccc2)cc1)n1c2CCCCc2c2ccccc12 InChI=1S/C14H15NO2S/c16-13-9-15(10-5-1-2-6-10)14(17)11-7-3-4-8-12(11)18-13/h3-4,7-8,10H,1-2,5-6,9H2 RTGJXGFVEKGEKC-UHFFFAOYSA-N 50421755 CHEMBL4169308 Cholinesterase 480 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50421755 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50421755&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145954160 164150630 ZINC27867350 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101668 [Cl-].Clc1ccccc1C[n+]1cccc(Cn2c3CCCCc3c3ccccc23)c1 InChI=1S/C14H15NO2S/c1-9-8-18-14(17)12-6-10-4-2-3-5-11(10)7-15(12)13(9)16/h2-5,9,12H,6-8H2,1H3/t9-,12+/m1/s1 GWSDRJYGBYCJNK-SKDRFNHKSA-N 50421756 CHEMBL4161385 Cholinesterase 200 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50421756 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50421756&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145958184 164150631 ZINC27877864 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101669 [Cl-].Clc1cccc(C[n+]2cccc(Cn3c4CCCCc4c4ccccc34)c2)c1 InChI=1S/C12H19NO2S/c1-8-10(14)13(9-6-4-5-7-9)12(2,3)11(15)16-8/h8-9H,4-7H2,1-3H3 YRFFURNCPYYBFT-UHFFFAOYSA-N 50421757 CHEMBL4160961 Cholinesterase 250 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50421757 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50421757&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145958653 164150632 ZINC27880960 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101670 [Cl-].Clc1ccc(C[n+]2cccc(Cn3c4CCCCc4c4ccccc34)c2)cc1 InChI=1S/C11H17NO2S/c1-7-11(14)15-8(2)10(13)12(7)9-5-3-4-6-9/h7-9H,3-6H2,1-2H3 AEUNLQOVYCFCBB-UHFFFAOYSA-N 50421747 CHEMBL4171576 Cholinesterase 220 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50421747 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50421747&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145950917 164150622 ZINC27874365 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101671 [Cl-].Fc1ccccc1C[n+]1cccc(Cn2c3CCCCc3c3ccccc23)c1 InChI=1S/C10H15NO2S/c1-7-10(13)11(6-9(12)14-7)8-4-2-3-5-8/h7-8H,2-6H2,1H3 ZQWCCXOGVKDRQB-UHFFFAOYSA-N 50421759 CHEMBL4176078 Cholinesterase 510 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50421759 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50421759&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145973133 164150634 ZINC27874373 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101672 [Cl-].Fc1cccc(C[n+]2cccc(Cn3c4CCCCc4c4ccccc34)c2)c1 InChI=1S/C51H68N10O14S/c1-5-6-16-36(57-47(68)39(61-50(71)75-51(2,3)4)25-31-19-21-33(22-20-31)76(72,73)74)45(66)55-29-42(62)56-40(26-32-28-54-35-17-11-10-15-34(32)35)48(69)58-37(18-12-23-52)46(67)60-41(27-43(63)64)49(70)59-38(44(53)65)24-30-13-8-7-9-14-30/h7-11,13-15,17,19-22,28,36-41,54H,5-6,12,16,18,23-27,29,52H2,1-4H3,(H2,53,65)(H,55,66)(H,56,62)(H,57,68)(H,58,69)(H,59,70)(H,60,67)(H,61,71)(H,63,64)(H,72,73,74)/t36-,37-,38-,39-,40-,41-/m0/s1 WIAWRJHGDZZOOT-SKGSPYGFSA-N 50421880 CHEMBL4168234 Cholinesterase 560 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50421880 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50421880&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145955499 164150755 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101673 [Cl-].Fc1ccc(C[n+]2cccc(Cn3c4CCCCc4c4ccccc34)c2)cc1 InChI=1S/C24H41N9O8S2/c1-12(34)9-29-14-11-42-43-24(2,3)18(19(25)38)32-20(39)13(8-17(36)37)31-16(35)10-30-21(40)15(33(4)22(14)41)6-5-7-28-23(26)27/h13-15,18,29H,5-11H2,1-4H3,(H2,25,38)(H,30,40)(H,31,35)(H,32,39)(H,36,37)(H4,26,27,28)/t13-,14-,15-,18-/m0/s1 ADQVGEYLOUWALW-XSWJXKHESA-N 50421970 CHEMBL4167804 Cholinesterase 520 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50421970 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50421970&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145952757 164150845 ZINC84687337 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101674 Cc1cccc(C[n+]2cccc(Cn3c4CCCCc4c4ccccc34)c2)c1 InChI=1S/C52H78N4O2/c1-4-5-6-7-8-12-21-36-56(44-50-30-15-17-32-52(50)58-3)37-22-13-11-20-34-54-42-48-28-24-26-46(40-48)38-45-25-23-27-47(39-45)41-53-33-18-9-10-19-35-55-43-49-29-14-16-31-51(49)57-2/h14-17,23-32,39-40,53-55H,4-13,18-22,33-38,41-44H2,1-3H3 NFJQBUGSZFHLLW-UHFFFAOYSA-N 50422386 CHEMBL4169820 Cholinesterase 110 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50422386 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50422386&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145946518 164151261 ZINC95614401 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101675 [Cl-].Cc1ccc(C[n+]2cccc(Cn3c4CCCCc4c4ccccc34)c2)cc1 InChI=1S/C52H76N4O2/c1-53-35-17-7-5-6-8-18-36-54(2)38-20-10-12-22-40-56(44-50-24-14-16-26-52(50)58-4)42-46-29-33-48(34-30-46)47-31-27-45(28-32-47)41-55(39-21-11-9-19-37-53)43-49-23-13-15-25-51(49)57-3/h13-16,23-34H,5-12,17-22,35-44H2,1-4H3 ROGXZPOSTXFOEE-UHFFFAOYSA-N 50422387 CHEMBL4159171 Cholinesterase 88 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50422387 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50422387&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145958839 164151262 ZINC95541490 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101676 [Br-].C(c1ccc[n+](Cc2ccccc2)c1)n1c2CCCCc2c2ccccc12 InChI=1S/C15H17NO3S/c1-19-12-8-4-7-11-14(12)20-13(17)9-16(15(11)18)10-5-2-3-6-10/h4,7-8,10H,2-3,5-6,9H2,1H3 ZGSJXYCUXMKBAY-UHFFFAOYSA-N 50421749 CHEMBL4173247 Cholinesterase 380 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50421749 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50421749&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145949925 164150624 ZINC27894287 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101679 [Br-].Fc1cccc(C[n+]2ccc(CN3C(=O)CCC3=O)cc2)c1 InChI=1S/C53H78N4O2/c1-54-35-17-7-5-6-8-18-36-55(2)38-20-10-12-22-40-57(45-51-24-14-16-26-53(51)59-4)43-49-33-29-47(30-34-49)41-46-27-31-48(32-28-46)42-56(39-21-11-9-19-37-54)44-50-23-13-15-25-52(50)58-3/h13-16,23-34H,5-12,17-22,35-45H2,1-4H3 WGMIKGYQYXHTPN-UHFFFAOYSA-N 50422388 CHEMBL4162941 Cholinesterase 45610 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50422388 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50422388&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145959225 164151263 ZINC95542004 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101680 [Cl-].Fc1ccccc1C[n+]1ccc(CN2C(=O)c3ccccc3C2=O)cc1 InChI=1S/C36H60N4/c1-39-27-13-7-3-4-8-14-28-40(2)30-16-10-6-12-26-38-32-34-19-23-36(24-20-34)35-21-17-33(18-22-35)31-37-25-11-5-9-15-29-39/h17-24,37-38H,3-16,25-32H2,1-2H3 JNLGNBFPHBIXHZ-UHFFFAOYSA-N 50422393 CHEMBL4170878 Cholinesterase 8710 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50422393 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50422393&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145949799 164151268 ZINC13475064 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101682 Clc1ccccc1C[n+]1ccc(\C=C2\C(=O)Nc3ccccc23)cc1 InChI=1S/C36H62N4O2/c1-41-35-23-13-11-21-33(35)31-39(29-19-9-5-15-25-37)27-17-7-3-4-8-18-28-40(30-20-10-6-16-26-38)32-34-22-12-14-24-36(34)42-2/h11-14,21-24H,3-10,15-20,25-32,37-38H2,1-2H3 RHYIUHUONWWZJC-UHFFFAOYSA-N 50422394 CHEMBL3558149 Cholinesterase 1370000 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50422394 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50422394&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118708834 164151269 ZINC26985053 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101683 [Br-].Fc1cccc(C[n+]2ccc(CNC(=O)c3cc4ccccc4oc3=O)cc2)c1 InChI=1S/C51H76N4O2/c1-4-5-6-7-8-12-21-38-55(43-49-24-15-17-26-51(49)57-3)39-22-13-11-20-36-53-41-45-29-33-47(34-30-45)46-31-27-44(28-32-46)40-52-35-18-9-10-19-37-54-42-48-23-14-16-25-50(48)56-2/h14-17,23-34,52-54H,4-13,18-22,35-43H2,1-3H3 NFZSWEFRCGCRKE-UHFFFAOYSA-N 50422395 CHEMBL4174316 Cholinesterase 12160 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50422395 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50422395&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145950192 164151270 ZINC95546310 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101684 [Cl-].Cc1ccc(C[n+]2cccc(Cn3c4CCCCc4c4ccccc34)c2)cc1 InChI=1S/C52H76N4O2/c1-53-35-17-7-5-6-8-18-36-54(2)38-20-10-12-22-40-56(44-50-24-14-16-26-52(50)58-4)42-46-29-33-48(34-30-46)47-31-27-45(28-32-47)41-55(39-21-11-9-19-37-53)43-49-23-13-15-25-51(49)57-3/h13-16,23-34H,5-12,17-22,35-44H2,1-4H3 ROGXZPOSTXFOEE-UHFFFAOYSA-N 50422387 CHEMBL4159171 Cholinesterase 90 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50422387 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50422387&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145958839 164151262 ZINC95541490 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101700 [Cl-].Clc1ccccc1C[n+]1ccc(Cn2c3CCCCc3c3ccccc23)cc1 InChI=1S/C40H70N4O2/c1-45-39-27-17-15-25-37(39)35-43-33-23-13-11-21-31-41-29-19-9-7-5-3-4-6-8-10-20-30-42-32-22-12-14-24-34-44-36-38-26-16-18-28-40(38)46-2/h15-18,25-28,41-44H,3-14,19-24,29-36H2,1-2H3 PMCCMEISWXQOME-UHFFFAOYSA-N 50422396 CHEMBL4159647 Cholinesterase 290 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50422396 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50422396&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145960117 164151271 ZINC27617096 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101701 [Br-].Clc1cccc(C[n+]2ccc(Cn3c4CCCCc4c4ccccc34)cc2)c1 InChI=1S/C13H15NO2S/c1-9-3-5-11(6-4-9)14-7-12(15)17-8-10(2)13(14)16/h3-6,10H,7-8H2,1-2H3 ORJJWXMVPDTPRE-UHFFFAOYSA-N 50421744 CHEMBL4161962 Cholinesterase 260 ChEMBL 10.1016/j.ejmech.2018.05.031 10.7270/Q2765HWM 29857276 Ghobadian, R; Mahdavi, M; Nadri, H; Moradi, A; Edraki, N; Akbarzadeh, T; Sharifzadeh, M; Bukhari, SNA; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50421744 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50421744&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145959185 164150619 ZINC27874338 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991330 OC(=O)C(F)(F)F.BrC1=C[C@@]23C[C@@H](NC4=C2C2=NCCc5c[nH]c(c25)C4=O)SC3=CC1=O InChI=1S/C18H12BrN3O2S.C2HF3O2/c19-8-4-18-5-11(25-10(18)3-9(8)23)22-16-13(18)14-12-7(1-2-20-14)6-21-15(12)17(16)24;3-2(4,5)1(6)7/h3-4,6,11,21-22H,1-2,5H2;(H,6,7)/t11-,18-;/m0./s1 HTQCLDPXCLWKEF-IMAPBUGXSA-N 50282225 DISCORHABDIN B Cholinesterase 137000 ChEMBL 10.1016/j.ejmech.2017.05.019 10.7270/Q25Q4ZMK 28505534 Botić, T; Defant, A; Zanini, P; Žužek, MC; Frangež, R; Janussen, D; Kersken, D; Knez, Ž; Mancini, I; Sepčić, K University of Maribor http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282225 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282225&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 135858649 104123899 ZINC28769293 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991339 OC(=O)C(F)(F)F.BrC1=C[C@@]2(CCC1=O)C=CNC1=C2C2=NCCc3c[nH]c(c23)C1=O InChI=1S/C18H14BrN3O2.C2HF3O2/c19-10-7-18(3-1-11(10)23)4-6-21-16-13(18)14-12-9(2-5-20-14)8-22-15(12)17(16)24;3-2(4,5)1(6)7/h4,6-8,21-22H,1-3,5H2;(H,6,7)/t18-;/m1./s1 PYPXMVIZEKXZPO-GMUIIQOCSA-N 50282228 CHEMBL4168617 Cholinesterase 7000 ChEMBL 10.1016/j.ejmech.2017.05.019 10.7270/Q25Q4ZMK 28505534 Botić, T; Defant, A; Zanini, P; Žužek, MC; Frangež, R; Janussen, D; Kersken, D; Knez, Ž; Mancini, I; Sepčić, K University of Maribor http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282228 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282228&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145953009 104123902 ZINC28770069 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991340 OC(=O)C(F)(F)F.BrC1=C[C@@]2(CCC1=O)C=CNC1=C2C2=NCCc3c[nH]c(c23)C1=O InChI=1S/C18H14BrN3O2.C2HF3O2/c19-10-7-18(3-1-11(10)23)4-6-21-16-13(18)14-12-9(2-5-20-14)8-22-15(12)17(16)24;3-2(4,5)1(6)7/h4,6-8,21-22H,1-3,5H2;(H,6,7)/t18-;/m1./s1 PYPXMVIZEKXZPO-GMUIIQOCSA-N 50282228 CHEMBL4168617 Cholinesterase 5000 ChEMBL 10.1016/j.ejmech.2017.05.019 10.7270/Q25Q4ZMK 28505534 Botić, T; Defant, A; Zanini, P; Žužek, MC; Frangež, R; Janussen, D; Kersken, D; Knez, Ž; Mancini, I; Sepčić, K University of Maribor http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282228 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282228&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145953009 104123902 ZINC28770069 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991349 OC(=O)C(F)(F)F.OC1C(Br)=CC2(C=CNC3=C2C2=NCCc4c[nH]c(c24)C3=O)C=C1Br InChI=1S/C18H13Br2N3O2/c19-9-5-18(6-10(20)16(9)24)2-4-22-15-12(18)13-11-8(1-3-21-13)7-23-14(11)17(15)25/h2,4-7,16,22-24H,1,3H2 RZRKLCBSFPOTIQ-UHFFFAOYSA-N 50282226 CHEMBL4160694 Cholinesterase 15800 ChEMBL 10.1016/j.ejmech.2017.05.019 10.7270/Q25Q4ZMK 28505534 Botić, T; Defant, A; Zanini, P; Žužek, MC; Frangež, R; Janussen, D; Kersken, D; Knez, Ž; Mancini, I; Sepčić, K University of Maribor http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282226 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282226&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145956435 104123900 ZINC28771153 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991350 O[C@H]1[C@H]2C(=O)C=C3S[C@H]4C[C@@]13C1=C(N4)C(=O)c3[nH]cc4CC[N+]2=C1c34 InChI=1S/C18H13N3O3S/c22-7-3-8-18-4-9(25-8)20-13-11(18)15-10-6(5-19-12(10)16(13)23)1-2-21(15)14(7)17(18)24/h3,5,9,14,17,24H,1-2,4H2,(H,19,20,23)/p+1/t9-,14+,17-,18+/m0/s1 QJMJSLBHDYZDDN-JRXCTEAYSA-O 50190657 CHEMBL1194747 Cholinesterase 531000 ChEMBL 10.1016/j.ejmech.2017.05.019 10.7270/Q25Q4ZMK 28505534 Botić, T; Defant, A; Zanini, P; Žužek, MC; Frangež, R; Janussen, D; Kersken, D; Knez, Ž; Mancini, I; Sepčić, K University of Maribor http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50190657 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50190657&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11784554 375075572 CHEMBL1194747 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991351 OC(=O)c1ccccc1O.CNC(=O)Oc1ccc2N[C@H]3NCC[C@@]3(C)c2c1 InChI=1S/C13H17N3O2.C7H6O3/c1-13-5-6-15-11(13)16-10-4-3-8(7-9(10)13)18-12(17)14-2;8-6-4-2-1-3-5(6)7(9)10/h3-4,7,11,15-16H,5-6H2,1-2H3,(H,14,17);1-4,8H,(H,9,10)/t11-,13+;/m1./s1 IURNUQXLRLZNBM-YLAFAASESA-N 50282227 CHEMBL4172401 Cholinesterase 28500 ChEMBL 10.1016/j.ejmech.2017.05.019 10.7270/Q25Q4ZMK 28505534 Botić, T; Defant, A; Zanini, P; Žužek, MC; Frangež, R; Janussen, D; Kersken, D; Knez, Ž; Mancini, I; Sepčić, K University of Maribor http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282227 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282227&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145950325 104123901 ZINC28770349 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991356 OC(=O)C(F)(F)F.OC1C(Br)=CC2(C=CNC3=C2C2=NCCc4c[nH]c(c24)C3=O)C=C1Br InChI=1S/C18H13Br2N3O2/c19-9-5-18(6-10(20)16(9)24)2-4-22-15-12(18)13-11-8(1-3-21-13)7-23-14(11)17(15)25/h2,4-7,16,22-24H,1,3H2 RZRKLCBSFPOTIQ-UHFFFAOYSA-N 50282226 CHEMBL4160694 Cholinesterase 17500 ChEMBL 10.1016/j.ejmech.2017.05.019 10.7270/Q25Q4ZMK 28505534 Botić, T; Defant, A; Zanini, P; Žužek, MC; Frangež, R; Janussen, D; Kersken, D; Knez, Ž; Mancini, I; Sepčić, K University of Maribor http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282226 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282226&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145956435 104123900 ZINC28771153 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991394 OC(=O)C(F)(F)F.BrC1=C[C@@]23C[C@@H](NC4=C2C2=NCCc5c[nH]c(c25)C4=O)SC3=CC1=O InChI=1S/C18H12BrN3O2S.C2HF3O2/c19-8-4-18-5-11(25-10(18)3-9(8)23)22-16-13(18)14-12-7(1-2-20-14)6-21-15(12)17(16)24;3-2(4,5)1(6)7/h3-4,6,11,21-22H,1-2,5H2;(H,6,7)/t11-,18-;/m0./s1 HTQCLDPXCLWKEF-IMAPBUGXSA-N 50282225 DISCORHABDIN B Cholinesterase 76000 ChEMBL 10.1016/j.ejmech.2017.05.019 10.7270/Q25Q4ZMK 28505534 Botić, T; Defant, A; Zanini, P; Žužek, MC; Frangež, R; Janussen, D; Kersken, D; Knez, Ž; Mancini, I; Sepčić, K University of Maribor http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282225 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282225&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 135858649 104123899 ZINC28769293 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025621 [Br-].COc1cc2CC(Cc3cc[n+](Cc4ccccc4)cc3Br)C(=O)c2cc1OC InChI=1S/C24H23BrNO3.BrH/c1-28-22-12-18-11-19(24(27)20(18)13-23(22)29-2)10-17-8-9-26(15-21(17)25)14-16-6-4-3-5-7-16;/h3-9,12-13,15,19H,10-11,14H2,1-2H3;1H/q+1;/p-1 HJANHZWEMNJHRA-UHFFFAOYSA-M 50291665 CHEMBL4165327 Cholinesterase 1790 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291665 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291665&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44270821 104133217 ZINC34633878 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025631 [Br-].COc1ccc2C(=O)C(Cc3cc[n+](Cc4cccc(C)c4)cc3Br)CCc2c1 InChI=1S/C25H25BrNO2.BrH/c1-17-4-3-5-18(12-17)15-27-11-10-20(24(26)16-27)13-21-7-6-19-14-22(29-2)8-9-23(19)25(21)28;/h3-5,8-12,14,16,21H,6-7,13,15H2,1-2H3;1H/q+1;/p-1 URQLWKHIBWHRSU-UHFFFAOYSA-M 50291664 CHEMBL4173239 Cholinesterase 665 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291664 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291664&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 15283362 104133216 ZINC03823180 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51025632 [Br-].CC(=O)c1c[n+](Cc2ccccc2C)ccc1CC1Cc2cc(OCC(F)(F)F)ccc2C1=O InChI=1S/C27H25F3NO3.BrH/c1-17-5-3-4-6-20(17)14-31-10-9-19(25(15-31)18(2)32)11-22-12-21-13-23(34-16-27(28,29)30)7-8-24(21)26(22)33;/h3-10,13,15,22H,11-12,14,16H2,1-2H3;1H/q+1;/p-1 OXDVLOBECZLLSJ-UHFFFAOYSA-M 50291637 CHEMBL4173784 Cholinesterase 4147 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291637 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291637&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 21710166 104133189 ZINC36338516 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51026202 [Br-].COc1cc2CC(Cc3cc[n+](Cc4cccc(O)c4)cc3C(N)=O)C(=O)c2cc1OC InChI=1S/C25H24N2O5.BrH/c1-31-22-11-17-10-18(24(29)20(17)12-23(22)32-2)9-16-6-7-27(14-21(16)25(26)30)13-15-4-3-5-19(28)8-15;/h3-8,11-12,14,18H,9-10,13H2,1-2H3,(H2-,26,28,30);1H CNPFVVYWSOWDLU-UHFFFAOYSA-N 50291632 CHEMBL4169887 Cholinesterase 5361 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291632 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291632&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 22097211 104133184 ZINC00834724 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51026203 [Br-].COc1cc2CC(Cc3cc[n+](Cc4nc5ccccc5o4)cc3C(N)=O)C(=O)c2cc1OC InChI=1S/C26H23N3O5.BrH/c1-32-22-11-16-10-17(25(30)18(16)12-23(22)33-2)9-15-7-8-29(13-19(15)26(27)31)14-24-28-20-5-3-4-6-21(20)34-24;/h3-8,11-13,17H,9-10,14H2,1-2H3,(H-,27,31);1H GLTSFVAGZUAGAD-UHFFFAOYSA-N 50291631 CHEMBL4163016 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291631 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291631&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44268353 104133183 ZINC36338519 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51026206 COc1ccc2C(=O)C(CC3C=CN(Cc4cccc(c4)C(F)(F)F)C=C3C(C)=O)CCc2c1 InChI=1S/C27H26F3NO3/c1-17(32)25-16-31(15-18-4-3-5-22(12-18)27(28,29)30)11-10-20(25)13-21-7-6-19-14-23(34-2)8-9-24(19)26(21)33/h3-5,8-12,14,16,20-21H,6-7,13,15H2,1-2H3 FIWOMRSDWULALA-UHFFFAOYSA-N 50291634 CHEMBL4172950 Cholinesterase >10000 ChEMBL 10.1016/j.ejmech.2017.12.084 10.7270/Q2FN18RR 29324339 Azzouz, R; Peauger, L; Gembus, V; Ţînţaş, ML; Sopková-de Oliveira Santos, J; Papamicaël, C; Levacher, V VFP Therapies http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50291634 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50291634&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 22097186 104133186 ZINC40465202 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991803 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 5.0 ChEMBL 10.1016/j.ejmech.2017.07.009 10.7270/Q26H4KZR 28734245 Pluta, K; Jeleń, M; Morak-Młodawska, B; Zimecki, M; Artym, J; Kocięba, M; Zaczyńska, E The Medical University of Silesia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991810 CSc1ccc2N(CCC3CCCCN3C)c3nc4ccccc4cc3Sc2c1 InChI=1S/C24H27N3S2/c1-26-13-6-5-8-18(26)12-14-27-21-11-10-19(28-2)16-22(21)29-23-15-17-7-3-4-9-20(17)25-24(23)27/h3-4,7,9-11,15-16,18H,5-6,8,12-14H2,1-2H3 CBPOTCMOKVQMII-UHFFFAOYSA-N 50282769 CHEMBL4172403 Cholinesterase 24 ChEMBL 10.1016/j.ejmech.2017.07.009 10.7270/Q26H4KZR 28734245 Pluta, K; Jeleń, M; Morak-Młodawska, B; Zimecki, M; Artym, J; Kocięba, M; Zaczyńska, E The Medical University of Silesia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282769 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282769&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72197295 104124443 ZINC29341112 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991812 CN1CCCCC1CCN1c2nc3ccccc3cc2Sc2cc3ccccc3nc12 InChI=1S/C26H26N4S/c1-29-14-7-6-10-20(29)13-15-30-25-23(16-18-8-2-4-11-21(18)27-25)31-24-17-19-9-3-5-12-22(19)28-26(24)30/h2-5,8-9,11-12,16-17,20H,6-7,10,13-15H2,1H3 IGINASJHAMUYKM-UHFFFAOYSA-N 50282771 CHEMBL4169232 Cholinesterase 12 ChEMBL 10.1016/j.ejmech.2017.07.009 10.7270/Q26H4KZR 28734245 Pluta, K; Jeleń, M; Morak-Młodawska, B; Zimecki, M; Artym, J; Kocięba, M; Zaczyńska, E The Medical University of Silesia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282771 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282771&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 24858164 104124445 ZINC29340812 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991848 CN1CCCCC1CCN1c2ccc(Cl)cc2Sc2cc3ccccc3nc12 InChI=1S/C23H24ClN3S/c1-26-12-5-4-7-18(26)11-13-27-20-10-9-17(24)15-21(20)28-22-14-16-6-2-3-8-19(16)25-23(22)27/h2-3,6,8-10,14-15,18H,4-5,7,11-13H2,1H3 PTDUAULVBZRNBX-UHFFFAOYSA-N 50282946 CHEMBL4161761 Cholinesterase 122 ChEMBL 10.1016/j.ejmech.2017.07.009 10.7270/Q26H4KZR 28734245 Pluta, K; Jeleń, M; Morak-Młodawska, B; Zimecki, M; Artym, J; Kocięba, M; Zaczyńska, E The Medical University of Silesia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282946 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282946&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72197294 104124620 ZINC00837630 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991849 ClCCNC(=O)NCCCN1c2nc3ccccc3cc2Sc2cc3ccccc3nc12 InChI=1S/C24H22ClN5OS/c25-10-12-27-24(31)26-11-5-13-30-22-20(14-16-6-1-3-8-18(16)28-22)32-21-15-17-7-2-4-9-19(17)29-23(21)30/h1-4,6-9,14-15H,5,10-13H2,(H2,26,27,31) NJASXENAYFDUMK-UHFFFAOYSA-N 50282985 CHEMBL4174920 Cholinesterase 2900 ChEMBL 10.1016/j.ejmech.2017.07.009 10.7270/Q26H4KZR 28734245 Pluta, K; Jeleń, M; Morak-Młodawska, B; Zimecki, M; Artym, J; Kocięba, M; Zaczyńska, E The Medical University of Silesia http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50282985 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50282985&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 24858473 104124659 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101229 Brc1ccc(cc1)-c1cc2ccc(OCCCn3cc(CNC(=O)CCCCC4CCSS4)nn3)cc2oc1=O InChI=1S/C29H31BrN4O4S2/c30-22-9-6-20(7-10-22)26-16-21-8-11-24(17-27(21)38-29(26)36)37-14-3-13-34-19-23(32-33-34)18-31-28(35)5-2-1-4-25-12-15-39-40-25/h6-11,16-17,19,25H,1-5,12-15,18H2,(H,31,35) LLSVLNUKTFNUBA-UHFFFAOYSA-N 50406843 CHEMBL4171854 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406843 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406843&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145951782 163355867 C02051 ZINC13832414 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51030024 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 15 ChEMBL 10.1016/j.ejmech.2018.01.014 10.7270/Q2WM1GZM 29353726 Czarnecka, K; Chufarova, N; Halczuk, K; Maciejewska, K; Girek, M; Skibiński, R; Jończyk, J; Bajda, M; Kabziński, J; Majsterek, I; Szymański, P Medical University of Lodz http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51030025 Cl.Clc1cc(cnc1Cl)C(=O)NCCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C28H34Cl2N4O/c29-23-18-20(19-33-27(23)30)28(35)32-17-11-5-3-1-2-4-10-16-31-26-21-12-6-8-14-24(21)34-25-15-9-7-13-22(25)26/h6,8,12,14,18-19H,1-5,7,9-11,13,15-17H2,(H,31,34)(H,32,35) OTRGELKTLBELBY-UHFFFAOYSA-N 50292235 CHEMBL4169340 Cholinesterase 3.3 ChEMBL 10.1016/j.ejmech.2018.01.014 10.7270/Q2WM1GZM 29353726 Czarnecka, K; Chufarova, N; Halczuk, K; Maciejewska, K; Girek, M; Skibiński, R; Jończyk, J; Bajda, M; Kabziński, J; Majsterek, I; Szymański, P Medical University of Lodz http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50292235 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50292235&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search PNV 2Z71 6869 104133786 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51030026 Cl.Clc1cc(cnc1Cl)C(=O)NCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C27H32Cl2N4O/c28-22-17-19(18-32-26(22)29)27(34)31-16-10-4-2-1-3-9-15-30-25-20-11-5-7-13-23(20)33-24-14-8-6-12-21(24)25/h5,7,11,13,17-18H,1-4,6,8-10,12,14-16H2,(H,30,33)(H,31,34) IEKFWVMEVZEPBR-UHFFFAOYSA-N 50292236 CHEMBL4176521 Cholinesterase 11 ChEMBL 10.1016/j.ejmech.2018.01.014 10.7270/Q2WM1GZM 29353726 Czarnecka, K; Chufarova, N; Halczuk, K; Maciejewska, K; Girek, M; Skibiński, R; Jończyk, J; Bajda, M; Kabziński, J; Majsterek, I; Szymański, P Medical University of Lodz http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50292236 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50292236&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 38103 104133787 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51030027 Cl.Clc1cc(cnc1Cl)C(=O)NCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C26H30Cl2N4O/c27-21-16-18(17-31-25(21)28)26(33)30-15-9-3-1-2-8-14-29-24-19-10-4-6-12-22(19)32-23-13-7-5-11-20(23)24/h4,6,10,12,16-17H,1-3,5,7-9,11,13-15H2,(H,29,32)(H,30,33) UCBYMQIQQKTPKJ-UHFFFAOYSA-N 50292237 CHEMBL4165909 Cholinesterase 11 ChEMBL 10.1016/j.ejmech.2018.01.014 10.7270/Q2WM1GZM 29353726 Czarnecka, K; Chufarova, N; Halczuk, K; Maciejewska, K; Girek, M; Skibiński, R; Jończyk, J; Bajda, M; Kabziński, J; Majsterek, I; Szymański, P Medical University of Lodz http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50292237 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50292237&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5282242 104133788 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51030028 Cl.Clc1cc(cnc1Cl)C(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C25H28Cl2N4O/c26-20-15-17(16-30-24(20)27)25(32)29-14-8-2-1-7-13-28-23-18-9-3-5-11-21(18)31-22-12-6-4-10-19(22)23/h3,5,9,11,15-16H,1-2,4,6-8,10,12-14H2,(H,28,31)(H,29,32) HSWQOWSQSJBGAQ-UHFFFAOYSA-N 50292238 CHEMBL4173152 Cholinesterase 13 ChEMBL 10.1016/j.ejmech.2018.01.014 10.7270/Q2WM1GZM 29353726 Czarnecka, K; Chufarova, N; Halczuk, K; Maciejewska, K; Girek, M; Skibiński, R; Jończyk, J; Bajda, M; Kabziński, J; Majsterek, I; Szymański, P Medical University of Lodz http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50292238 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50292238&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 33255 104133789 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51030029 Cl.Clc1cc(cnc1Cl)C(=O)NCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C24H26Cl2N4O/c25-19-14-16(15-29-23(19)26)24(31)28-13-7-1-6-12-27-22-17-8-2-4-10-20(17)30-21-11-5-3-9-18(21)22/h2,4,8,10,14-15H,1,3,5-7,9,11-13H2,(H,27,30)(H,28,31) UIVSUQOFNOXYOZ-UHFFFAOYSA-N 50292239 CHEMBL4162467 Cholinesterase 13 ChEMBL 10.1016/j.ejmech.2018.01.014 10.7270/Q2WM1GZM 29353726 Czarnecka, K; Chufarova, N; Halczuk, K; Maciejewska, K; Girek, M; Skibiński, R; Jończyk, J; Bajda, M; Kabziński, J; Majsterek, I; Szymański, P Medical University of Lodz http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50292239 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50292239&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 456255 104133790 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51030030 Cl.Clc1cc(cnc1Cl)C(=O)NCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C23H24Cl2N4O/c24-18-13-15(14-28-22(18)25)23(30)27-12-6-5-11-26-21-16-7-1-3-9-19(16)29-20-10-4-2-8-17(20)21/h1,3,7,9,13-14H,2,4-6,8,10-12H2,(H,26,29)(H,27,30) FQOPHXDLWQHWEG-UHFFFAOYSA-N 50292240 CHEMBL4169737 Cholinesterase 41 ChEMBL 10.1016/j.ejmech.2018.01.014 10.7270/Q2WM1GZM 29353726 Czarnecka, K; Chufarova, N; Halczuk, K; Maciejewska, K; Girek, M; Skibiński, R; Jończyk, J; Bajda, M; Kabziński, J; Majsterek, I; Szymański, P Medical University of Lodz http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50292240 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50292240&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 22817777 104133791 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51030031 Cl.Clc1cc(cnc1Cl)C(=O)NCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C22H22Cl2N4O/c23-17-12-14(13-27-21(17)24)22(29)26-11-5-10-25-20-15-6-1-3-8-18(15)28-19-9-4-2-7-16(19)20/h1,3,6,8,12-13H,2,4-5,7,9-11H2,(H,25,28)(H,26,29) VOEPOEYGZPYGGY-UHFFFAOYSA-N 50292241 CHEMBL4159080 Cholinesterase 160 ChEMBL 10.1016/j.ejmech.2018.01.014 10.7270/Q2WM1GZM 29353726 Czarnecka, K; Chufarova, N; Halczuk, K; Maciejewska, K; Girek, M; Skibiński, R; Jończyk, J; Bajda, M; Kabziński, J; Majsterek, I; Szymański, P Medical University of Lodz http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50292241 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50292241&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5362065 104133792 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51030032 Cl.Clc1cc(cnc1Cl)C(=O)NCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C21H20Cl2N4O/c22-16-11-13(12-26-20(16)23)21(28)25-10-9-24-19-14-5-1-3-7-17(14)27-18-8-4-2-6-15(18)19/h1,3,5,7,11-12H,2,4,6,8-10H2,(H,24,27)(H,25,28) PVWBYMQPLCBVKB-UHFFFAOYSA-N 50292242 CHEMBL4166584 Cholinesterase 726 ChEMBL 10.1016/j.ejmech.2018.01.014 10.7270/Q2WM1GZM 29353726 Czarnecka, K; Chufarova, N; Halczuk, K; Maciejewska, K; Girek, M; Skibiński, R; Jończyk, J; Bajda, M; Kabziński, J; Majsterek, I; Szymański, P Medical University of Lodz http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50292242 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50292242&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 40958 104133793 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101230 O=C(CCCCC1CCSS1)NCc1cn(CCCCOc2ccc3ccc(=O)oc3c2)nn1 InChI=1S/C24H30N4O4S2/c29-23(6-2-1-5-21-11-14-33-34-21)25-16-19-17-28(27-26-19)12-3-4-13-31-20-9-7-18-8-10-24(30)32-22(18)15-20/h7-10,15,17,21H,1-6,11-14,16H2,(H,25,29) ZOWNEYCAJDYRTM-UHFFFAOYSA-N 50406844 CHEMBL4168105 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406844 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406844&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145953867 163355868 C02051 ZINC13832460 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101231 COc1ccc(cc1OC)-c1cc2ccc(OCCCCn3cc(CNC(=O)CCCCC4CCSS4)nn3)cc2oc1=O InChI=1S/C32H38N4O6S2/c1-39-28-12-10-22(18-30(28)40-2)27-17-23-9-11-25(19-29(23)42-32(27)38)41-15-6-5-14-36-21-24(34-35-36)20-33-31(37)8-4-3-7-26-13-16-43-44-26/h9-12,17-19,21,26H,3-8,13-16,20H2,1-2H3,(H,33,37) IGFJGWJFXLNUGB-UHFFFAOYSA-N 50406845 CHEMBL4170408 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406845 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406845&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145956054 163355869 C02051 ZINC13832407 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101232 Cc1cc(=O)oc2cc(OCCCCCn3cc(CNC(=O)CCCCC4CCSS4)nn3)ccc12 InChI=1S/C26H34N4O4S2/c1-19-15-26(32)34-24-16-21(9-10-23(19)24)33-13-6-2-5-12-30-18-20(28-29-30)17-27-25(31)8-4-3-7-22-11-14-35-36-22/h9-10,15-16,18,22H,2-8,11-14,17H2,1H3,(H,27,31) ILTTWMGZXYOROO-UHFFFAOYSA-N 50406846 CHEMBL4168331 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406846 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406846&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145955954 163355870 C02051 ZINC13832393 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101233 O=C(CCCCC1CCSS1)NCc1cn(CCCCCOc2ccc3cc(-c4ccccc4)c(=O)oc3c2)nn1 InChI=1S/C31H36N4O4S2/c36-30(12-6-5-11-27-15-18-40-41-27)32-21-25-22-35(34-33-25)16-7-2-8-17-38-26-14-13-24-19-28(23-9-3-1-4-10-23)31(37)39-29(24)20-26/h1,3-4,9-10,13-14,19-20,22,27H,2,5-8,11-12,15-18,21H2,(H,32,36) JXBCANBRUMIOTK-UHFFFAOYSA-N 50406847 CHEMBL4161064 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406847 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406847&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145956457 163355871 C02051 ZINC13832382 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101234 Clc1ccc(cc1Cl)-c1cc2ccc(OCCCCCn3cc(CNC(=O)CCCCC4CCSS4)nn3)cc2oc1=O InChI=1S/C31H34Cl2N4O4S2/c32-27-11-9-21(17-28(27)33)26-16-22-8-10-24(18-29(22)41-31(26)39)40-14-5-1-4-13-37-20-23(35-36-37)19-34-30(38)7-3-2-6-25-12-15-42-43-25/h8-11,16-18,20,25H,1-7,12-15,19H2,(H,34,38) KPWMSWAMMPHMOK-UHFFFAOYSA-N 50406848 CHEMBL4160630 Cholinesterase 7800 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406848 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406848&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145956926 163355872 C02051 ZINC13832387 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101235 Clc1ccc(cc1)-c1cc2ccc(OCCCCn3cc(CNC(=O)CCCCC4CCSS4)nn3)cc2oc1=O InChI=1S/C30H33ClN4O4S2/c31-23-10-7-21(8-11-23)27-17-22-9-12-25(18-28(22)39-30(27)37)38-15-4-3-14-35-20-24(33-34-35)19-32-29(36)6-2-1-5-26-13-16-40-41-26/h7-12,17-18,20,26H,1-6,13-16,19H2,(H,32,36) VJEYGDJQROXPHC-UHFFFAOYSA-N 50406849 CHEMBL4164474 Cholinesterase 52000 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406849 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406849&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145959566 163355873 C02051 ZINC13832420 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101236 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 3400 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101238 O=C(CCCCC1CCSS1)NCc1cn(CCCOc2ccc3ccc(=O)oc3c2)nn1 InChI=1S/C23H28N4O4S2/c28-22(5-2-1-4-20-10-13-32-33-20)24-15-18-16-27(26-25-18)11-3-12-30-19-8-6-17-7-9-23(29)31-21(17)14-19/h6-9,14,16,20H,1-5,10-13,15H2,(H,24,28) AJCVYRGAUVGZMJ-UHFFFAOYSA-N 50406840 CHEMBL4160205 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406840 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406840&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145959399 163355864 C02051 ZINC13832485 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101239 O=C(CCCCC1CCSS1)NCc1cn(CCCOc2ccc3cc(-c4ccccc4)c(=O)oc3c2)nn1 InChI=1S/C29H32N4O4S2/c34-28(10-5-4-9-25-13-16-38-39-25)30-19-23-20-33(32-31-23)14-6-15-36-24-12-11-22-17-26(21-7-2-1-3-8-21)29(35)37-27(22)18-24/h1-3,7-8,11-12,17-18,20,25H,4-6,9-10,13-16,19H2,(H,30,34) IYENTSQAACIYSS-UHFFFAOYSA-N 50406851 CHEMBL4164667 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406851 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406851&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145958572 163355875 C02051 ZINC13832459 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101240 Clc1ccc(cc1)-c1cc2ccc(OCCCn3cc(CNC(=O)CCCCC4CCSS4)nn3)cc2oc1=O InChI=1S/C29H31ClN4O4S2/c30-22-9-6-20(7-10-22)26-16-21-8-11-24(17-27(21)38-29(26)36)37-14-3-13-34-19-23(32-33-34)18-31-28(35)5-2-1-4-25-12-15-39-40-25/h6-11,16-17,19,25H,1-5,12-15,18H2,(H,31,35) FADJKJHHDDWRAZ-UHFFFAOYSA-N 50406841 CHEMBL4171444 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406841 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406841&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145950488 163355865 C02051 ZINC13832442 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101248 CCOC(=O)c1cc2ccc(OCCCn3cc(CNC(=O)CCCCC4CCSS4)nn3)cc2oc1=O InChI=1S/C26H32N4O6S2/c1-2-34-25(32)22-14-18-8-9-20(15-23(18)36-26(22)33)35-12-5-11-30-17-19(28-29-30)16-27-24(31)7-4-3-6-21-10-13-37-38-21/h8-9,14-15,17,21H,2-7,10-13,16H2,1H3,(H,27,31) ANIXUJWNKXQDNZ-UHFFFAOYSA-N 50406856 CHEMBL4161751 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406856 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406856&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145958202 163355880 C02051 ZINC13832416 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101249 Clc1ccc(cc1Cl)-c1cc2ccc(OCCCn3cc(CNC(=O)CCCCC4CCSS4)nn3)cc2oc1=O InChI=1S/C29H30Cl2N4O4S2/c30-25-9-7-19(15-26(25)31)24-14-20-6-8-22(16-27(20)39-29(24)37)38-12-3-11-35-18-21(33-34-35)17-32-28(36)5-2-1-4-23-10-13-40-41-23/h6-9,14-16,18,23H,1-5,10-13,17H2,(H,32,36) GKDGEBJNWWVTKW-UHFFFAOYSA-N 50406857 CHEMBL4163548 Cholinesterase 73500 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406857 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406857&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145960020 163355881 C02051 ZINC13832404 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101250 O=C(CCCCC1CCSS1)NCc1cn(CCCCOc2ccc3cc(-c4ccccc4)c(=O)oc3c2)nn1 InChI=1S/C30H34N4O4S2/c35-29(11-5-4-10-26-14-17-39-40-26)31-20-24-21-34(33-32-24)15-6-7-16-37-25-13-12-23-18-27(22-8-2-1-3-9-22)30(36)38-28(23)19-25/h1-3,8-9,12-13,18-19,21,26H,4-7,10-11,14-17,20H2,(H,31,35) IWKIVWFHFCUCFE-UHFFFAOYSA-N 50406858 CHEMBL4160188 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406858 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406858&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145958627 163355882 C02051 ZINC13832390 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101251 COc1ccc(cc1)-c1cc2ccc(OCCCCn3cc(CNC(=O)CCCCC4CCSS4)nn3)cc2oc1=O InChI=1S/C31H36N4O5S2/c1-38-25-11-8-22(9-12-25)28-18-23-10-13-26(19-29(23)40-31(28)37)39-16-5-4-15-35-21-24(33-34-35)20-32-30(36)7-3-2-6-27-14-17-41-42-27/h8-13,18-19,21,27H,2-7,14-17,20H2,1H3,(H,32,36) ZJJDCZAMSDWKAH-UHFFFAOYSA-N 50406859 CHEMBL4159768 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406859 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406859&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145957127 163355883 C02051 ZINC13832444 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101252 Brc1ccc(cc1)-c1cc2ccc(OCCCCn3cc(CNC(=O)CCCCC4CCSS4)nn3)cc2oc1=O InChI=1S/C30H33BrN4O4S2/c31-23-10-7-21(8-11-23)27-17-22-9-12-25(18-28(22)39-30(27)37)38-15-4-3-14-35-20-24(33-34-35)19-32-29(36)6-2-1-5-26-13-16-40-41-26/h7-12,17-18,20,26H,1-6,13-16,19H2,(H,32,36) FKIDUOPFESGCFP-UHFFFAOYSA-N 50406853 CHEMBL4175113 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406853 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406853&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145951088 163355877 C02051 ZINC13832397 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101253 Clc1ccc(cc1Cl)-c1cc2ccc(OCCCCn3cc(CNC(=O)CCCCC4CCSS4)nn3)cc2oc1=O InChI=1S/C30H32Cl2N4O4S2/c31-26-10-8-20(16-27(26)32)25-15-21-7-9-23(17-28(21)40-30(25)38)39-13-4-3-12-36-19-22(34-35-36)18-33-29(37)6-2-1-5-24-11-14-41-42-24/h7-10,15-17,19,24H,1-6,11-14,18H2,(H,33,37) WSAHHXJOLREDTB-UHFFFAOYSA-N 50406860 CHEMBL4159985 Cholinesterase 10300 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406860 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406860&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145957388 163355884 C02051 ZINC13832430 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101254 O=C(CCCCC1CCSS1)NCc1cn(CCCCCOc2ccc3ccc(=O)oc3c2)nn1 InChI=1S/C25H32N4O4S2/c30-24(7-3-2-6-22-12-15-34-35-22)26-17-20-18-29(28-27-20)13-4-1-5-14-32-21-10-8-19-9-11-25(31)33-23(19)16-21/h8-11,16,18,22H,1-7,12-15,17H2,(H,26,30) ISEYHNAOGCNNLK-UHFFFAOYSA-N 50406842 CHEMBL4167902 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406842 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406842&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145956178 163355866 C02051 ZINC13832469 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101255 CC(=O)c1cc2ccc(OCCCCCn3cc(CNC(=O)CCCCC4CCSS4)nn3)cc2oc1=O InChI=1S/C27H34N4O5S2/c1-19(32)24-15-20-9-10-22(16-25(20)36-27(24)34)35-13-6-2-5-12-31-18-21(29-30-31)17-28-26(33)8-4-3-7-23-11-14-37-38-23/h9-10,15-16,18,23H,2-8,11-14,17H2,1H3,(H,28,33) YSSFPEIUDLERSM-UHFFFAOYSA-N 50406854 CHEMBL4176178 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406854 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406854&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145973139 163355878 C02051 ZINC13832431 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101256 CCOC(=O)c1cc2ccc(OCCCCCn3cc(CNC(=O)CCCCC4CCSS4)nn3)cc2oc1=O InChI=1S/C28H36N4O6S2/c1-2-36-27(34)24-16-20-10-11-22(17-25(20)38-28(24)35)37-14-7-3-6-13-32-19-21(30-31-32)18-29-26(33)9-5-4-8-23-12-15-39-40-23/h10-11,16-17,19,23H,2-9,12-15,18H2,1H3,(H,29,33) HDMAYLYHDNPDSV-UHFFFAOYSA-N 50406861 CHEMBL4171674 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406861 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406861&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145949849 163355885 C02051 ZINC13832423 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101257 COc1ccc(cc1)-c1cc2ccc(OCCCCCn3cc(CNC(=O)CCCCC4CCSS4)nn3)cc2oc1=O InChI=1S/C32H38N4O5S2/c1-39-26-12-9-23(10-13-26)29-19-24-11-14-27(20-30(24)41-32(29)38)40-17-6-2-5-16-36-22-25(34-35-36)21-33-31(37)8-4-3-7-28-15-18-42-43-28/h9-14,19-20,22,28H,2-8,15-18,21H2,1H3,(H,33,37) PNZYLPXLBAEYEA-UHFFFAOYSA-N 50406862 CHEMBL4170209 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406862 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406862&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145953963 163355886 C02051 ZINC13832385 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101258 COc1ccc(cc1OC)-c1cc2ccc(OCCCCCn3cc(CNC(=O)CCCCC4CCSS4)nn3)cc2oc1=O InChI=1S/C33H40N4O6S2/c1-40-29-13-11-23(19-31(29)41-2)28-18-24-10-12-26(20-30(24)43-33(28)39)42-16-7-3-6-15-37-22-25(35-36-37)21-34-32(38)9-5-4-8-27-14-17-44-45-27/h10-13,18-20,22,27H,3-9,14-17,21H2,1-2H3,(H,34,38) GUQXLZFGZIOTDS-UHFFFAOYSA-N 50406850 CHEMBL4159579 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406850 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406850&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145956875 163355874 C02051 ZINC13832435 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101259 Brc1ccc(cc1)-c1cc2ccc(OCCCCCn3cc(CNC(=O)CCCCC4CCSS4)nn3)cc2oc1=O InChI=1S/C31H35BrN4O4S2/c32-24-11-8-22(9-12-24)28-18-23-10-13-26(19-29(23)40-31(28)38)39-16-5-1-4-15-36-21-25(34-35-36)20-33-30(37)7-3-2-6-27-14-17-41-42-27/h8-13,18-19,21,27H,1-7,14-17,20H2,(H,33,37) SYADBORNUTUMAG-UHFFFAOYSA-N 50406863 CHEMBL4168550 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406863 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406863&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145954127 163355887 C02051 ZINC13832471 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101277 Cc1cc(=O)oc2cc(OCCCn3cc(CNC(=O)CCCCC4CCSS4)nn3)ccc12 InChI=1S/C24H30N4O4S2/c1-17-13-24(30)32-22-14-19(7-8-21(17)22)31-11-4-10-28-16-18(26-27-28)15-25-23(29)6-3-2-5-20-9-12-33-34-20/h7-8,13-14,16,20H,2-6,9-12,15H2,1H3,(H,25,29) JOGJHTJZUVAOKN-UHFFFAOYSA-N 50406865 CHEMBL4171465 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406865 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406865&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145950044 163355889 C02051 ZINC13832475 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101278 CC(=O)c1cc2ccc(OCCCn3cc(CNC(=O)CCCCC4CCSS4)nn3)cc2oc1=O InChI=1S/C25H30N4O5S2/c1-17(30)22-13-18-7-8-20(14-23(18)34-25(22)32)33-11-4-10-29-16-19(27-28-29)15-26-24(31)6-3-2-5-21-9-12-35-36-21/h7-8,13-14,16,21H,2-6,9-12,15H2,1H3,(H,26,31) RHAHJQYJVZKVQT-UHFFFAOYSA-N 50406852 CHEMBL4163570 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406852 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406852&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145956816 163355876 C02051 ZINC00015436 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101279 OC(=O)c1cc2ccc(OCCCn3cc(CNC(=O)CCCCC4CCSS4)nn3)cc2oc1=O InChI=1S/C24H28N4O6S2/c29-22(5-2-1-4-19-8-11-35-36-19)25-14-17-15-28(27-26-17)9-3-10-33-18-7-6-16-12-20(23(30)31)24(32)34-21(16)13-18/h6-7,12-13,15,19H,1-5,8-11,14H2,(H,25,29)(H,30,31) QUNXAFQICVRYNI-UHFFFAOYSA-N 50406866 CHEMBL4169996 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406866 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406866&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145953505 163355890 C02051 ZINC13832405 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101280 COc1ccc(cc1)-c1cc2ccc(OCCCn3cc(CNC(=O)CCCCC4CCSS4)nn3)cc2oc1=O InChI=1S/C30H34N4O5S2/c1-37-24-10-7-21(8-11-24)27-17-22-9-12-25(18-28(22)39-30(27)36)38-15-4-14-34-20-23(32-33-34)19-31-29(35)6-3-2-5-26-13-16-40-41-26/h7-12,17-18,20,26H,2-6,13-16,19H2,1H3,(H,31,35) ZIAIQHZQKCLUEE-UHFFFAOYSA-N 50406855 CHEMBL4175303 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406855 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406855&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145952593 163355879 C02051 ZINC13832479 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51101281 COc1ccc(cc1OC)-c1cc2ccc(OCCCn3cc(CNC(=O)CCCCC4CCSS4)nn3)cc2oc1=O InChI=1S/C31H36N4O6S2/c1-38-27-11-9-21(17-29(27)39-2)26-16-22-8-10-24(18-28(22)41-31(26)37)40-14-5-13-35-20-23(33-34-35)19-32-30(36)7-4-3-6-25-12-15-42-43-25/h8-11,16-18,20,25H,3-7,12-15,19H2,1-2H3,(H,32,36) HDMGQLXNTODMRP-UHFFFAOYSA-N 50406864 CHEMBL4161244 Cholinesterase 49370 ChEMBL 10.1016/j.ejmech.2018.04.058 10.7270/Q2WW7M8B 29763808 Jalili-Baleh, L; Forootanfar, H; Küçükkılınç, TT; Nadri, H; Abdolahi, Z; Ameri, A; Jafari, M; Ayazgok, B; Baeeri, M; Rahimifard, M; Abbas Bukhari, SN; Abdollahi, M; Ganjali, MR; Emami, S; Khoobi, M; Foroumadi, A Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406864 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406864&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145956726 163355888 C02051 ZINC13832410 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038499 COc1cc(\C=C\C(=O)NCCCCNc2c3CCCCc3nc3ccccc23)cc(OC)c1OCc1nc(C)c(C)nc1C InChI=1S/C36H43N5O4/c1-23-24(2)40-31(25(3)39-23)22-45-36-32(43-4)20-26(21-33(36)44-5)16-17-34(42)37-18-10-11-19-38-35-27-12-6-8-14-29(27)41-30-15-9-7-13-28(30)35/h6,8,12,14,16-17,20-21H,7,9-11,13,15,18-19,22H2,1-5H3,(H,37,42)(H,38,41)/b17-16+ PJNLKEHEHXJBEX-WUKNDPDISA-N 50458072 CHEMBL4213550 Cholinesterase >1000 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458072 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458072&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145966051 433925337 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038500 Cc1nc(C)c(COc2ccc(\C=C\C(=O)NCCNc3c4CCCCc4nc4ccccc34)cc2)nc1C InChI=1S/C32H35N5O2/c1-21-22(2)36-30(23(3)35-21)20-39-25-15-12-24(13-16-25)14-17-31(38)33-18-19-34-32-26-8-4-6-10-28(26)37-29-11-7-5-9-27(29)32/h4,6,8,10,12-17H,5,7,9,11,18-20H2,1-3H3,(H,33,38)(H,34,37)/b17-14+ PGDMPNVKHIBOGJ-SAPNQHFASA-N 50458073 CHEMBL4202909 Cholinesterase 589 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458073 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458073&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145976013 433925338 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038506 COc1cc(\C=C\C(=O)NCCCCCCNc2c3CCCCc3nc3ccccc23)cc(OC)c1OCc1nc(C)c(C)nc1C InChI=1S/C38H47N5O4/c1-25-26(2)42-33(27(3)41-25)24-47-38-34(45-4)22-28(23-35(38)46-5)18-19-36(44)39-20-12-6-7-13-21-40-37-29-14-8-10-16-31(29)43-32-17-11-9-15-30(32)37/h8,10,14,16,18-19,22-23H,6-7,9,11-13,15,17,20-21,24H2,1-5H3,(H,39,44)(H,40,43)/b19-18+ DHEIFLNTYDIUHL-VHEBQXMUSA-N 50458077 CHEMBL4209795 Cholinesterase 29 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458077 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458077&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145965199 433925342 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038508 COc1cc(\C=C\C(=O)NCCCNc2c3CCCCc3nc3ccccc23)cc(OC)c1OCc1nc(C)c(C)nc1C InChI=1S/C35H41N5O4/c1-22-23(2)39-30(24(3)38-22)21-44-35-31(42-4)19-25(20-32(35)43-5)15-16-33(41)36-17-10-18-37-34-26-11-6-8-13-28(26)40-29-14-9-7-12-27(29)34/h6,8,11,13,15-16,19-20H,7,9-10,12,14,17-18,21H2,1-5H3,(H,36,41)(H,37,40)/b16-15+ IGJKPBYXHLKLFB-FOCLMDBBSA-N 50458078 CHEMBL4216341 Cholinesterase >1000 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458078 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458078&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145972354 433925343 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038509 COc1cc(\C=C\C(=O)NCCNc2c3CCCCc3nc3ccccc23)cc(OC)c1OCc1nc(C)c(C)nc1C InChI=1S/C34H39N5O4/c1-21-22(2)38-29(23(3)37-21)20-43-34-30(41-4)18-24(19-31(34)42-5)14-15-32(40)35-16-17-36-33-25-10-6-8-12-27(25)39-28-13-9-7-11-26(28)33/h6,8,10,12,14-15,18-19H,7,9,11,13,16-17,20H2,1-5H3,(H,35,40)(H,36,39)/b15-14+ CDHYKNOGLCUYMN-CCEZHUSRSA-N 50458079 CHEMBL4211373 Cholinesterase 613 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458079 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458079&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145964123 433925344 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038511 Cc1nc(C)c(COc2ccc(\C=C\C(=O)NCCCCCCNc3c4CCCCc4nc4ccccc34)cc2)nc1C InChI=1S/C36H43N5O2/c1-25-26(2)40-34(27(3)39-25)24-43-29-19-16-28(17-20-29)18-21-35(42)37-22-10-4-5-11-23-38-36-30-12-6-8-14-32(30)41-33-15-9-7-13-31(33)36/h6,8,12,14,16-21H,4-5,7,9-11,13,15,22-24H2,1-3H3,(H,37,42)(H,38,41)/b21-18+ SPPVNYAEVQJRRF-DYTRJAOYSA-N 50458081 CHEMBL4215360 Cholinesterase 147 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458081 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458081&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145971591 433925346 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038513 Cc1nc(C)c(COc2ccc(\C=C\C(=O)NCCCNc3c4CCCCc4nc4ccccc34)cc2)nc1C InChI=1S/C33H37N5O2/c1-22-23(2)37-31(24(3)36-22)21-40-26-16-13-25(14-17-26)15-18-32(39)34-19-8-20-35-33-27-9-4-6-11-29(27)38-30-12-7-5-10-28(30)33/h4,6,9,11,13-18H,5,7-8,10,12,19-21H2,1-3H3,(H,34,39)(H,35,38)/b18-15+ IHRNMPJNIJVEKQ-OBGWFSINSA-N 50458082 CHEMBL4211272 Cholinesterase 5.2 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458082 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458082&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145966907 433925347 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038517 COc1cc(\C=C\C(=O)NCCCCCCNc2c3CCCCc3nc3ccccc23)cc(OC)c1O InChI=1S/C30H37N3O4/c1-36-26-19-21(20-27(37-2)30(26)35)15-16-28(34)31-17-9-3-4-10-18-32-29-22-11-5-7-13-24(22)33-25-14-8-6-12-23(25)29/h5,7,11,13,15-16,19-20,35H,3-4,6,8-10,12,14,17-18H2,1-2H3,(H,31,34)(H,32,33)/b16-15+ FNEGRPYNMCMCTH-FOCLMDBBSA-N 50458083 CHEMBL4216066 Cholinesterase 24 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458083 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458083&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145971379 433925348 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038520 COc1cc(\C=C\C(=O)NCCNc2c3CCCCc3nc3ccccc23)cc(OC)c1O InChI=1S/C26H29N3O4/c1-32-22-15-17(16-23(33-2)26(22)31)11-12-24(30)27-13-14-28-25-18-7-3-5-9-20(18)29-21-10-6-4-8-19(21)25/h3,5,7,9,11-12,15-16,31H,4,6,8,10,13-14H2,1-2H3,(H,27,30)(H,28,29)/b12-11+ RBPROIIKBTZEKD-VAWYXSNFSA-N 50458076 CHEMBL4216594 Cholinesterase >1000 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458076 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458076&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145971404 433925341 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038521 Oc1ccc(\C=C\C(=O)NCCCCCCNc2c3CCCCc3nc3ccccc23)cc1 InChI=1S/C28H33N3O2/c32-22-16-13-21(14-17-22)15-18-27(33)29-19-7-1-2-8-20-30-28-23-9-3-5-11-25(23)31-26-12-6-4-10-24(26)28/h3,5,9,11,13-18,32H,1-2,4,6-8,10,12,19-20H2,(H,29,33)(H,30,31)/b18-15+ WGTXORMUWWYYTI-OBGWFSINSA-N 50458085 CHEMBL4217061 Cholinesterase 24 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458085 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458085&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145973534 433925350 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038523 Oc1ccc(\C=C\C(=O)NCCCCNc2c3CCCCc3nc3ccccc23)cc1 InChI=1S/C26H29N3O2/c30-20-14-11-19(12-15-20)13-16-25(31)27-17-5-6-18-28-26-21-7-1-3-9-23(21)29-24-10-4-2-8-22(24)26/h1,3,7,9,11-16,30H,2,4-6,8,10,17-18H2,(H,27,31)(H,28,29)/b16-13+ GZBKWLGZKVUVHB-DTQAZKPQSA-N 50458074 CHEMBL4217585 Cholinesterase 30 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458074 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458074&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145973562 433925339 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038526 COc1cc(\C=C\C(=O)NCCCCCCCCNc2c3CCCCc3nc3ccccc23)cc(OC)c1OCc1nc(C)c(C)nc1C InChI=1S/C40H51N5O4/c1-27-28(2)44-35(29(3)43-27)26-49-40-36(47-4)24-30(25-37(40)48-5)20-21-38(46)41-22-14-8-6-7-9-15-23-42-39-31-16-10-12-18-33(31)45-34-19-13-11-17-32(34)39/h10,12,16,18,20-21,24-25H,6-9,11,13-15,17,19,22-23,26H2,1-5H3,(H,41,46)(H,42,45)/b21-20+ UYTFRJCHJYGHOL-QZQOTICOSA-N 50458087 CHEMBL4202660 Cholinesterase 17 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458087 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458087&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145977245 433925352 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038528 COc1cc(\C=C\C(=O)NCCNc2c3CCCCc3nc3ccccc23)ccc1OCc1nc(C)c(C)nc1C InChI=1S/C33H37N5O3/c1-21-22(2)37-29(23(3)36-21)20-41-30-15-13-24(19-31(30)40-4)14-16-32(39)34-17-18-35-33-25-9-5-7-11-27(25)38-28-12-8-6-10-26(28)33/h5,7,9,11,13-16,19H,6,8,10,12,17-18,20H2,1-4H3,(H,34,39)(H,35,38)/b16-14+ JOIUNXXHYIVJAN-JQIJEIRASA-N 50458088 CHEMBL4207532 Cholinesterase 502 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458088 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458088&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145975457 433925353 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038529 COc1cc(\C=C\C(=O)NCCCNc2c3CCCCc3nc3ccccc23)ccc1OCc1nc(C)c(C)nc1C InChI=1S/C34H39N5O3/c1-22-23(2)38-30(24(3)37-22)21-42-31-16-14-25(20-32(31)41-4)15-17-33(40)35-18-9-19-36-34-26-10-5-7-12-28(26)39-29-13-8-6-11-27(29)34/h5,7,10,12,14-17,20H,6,8-9,11,13,18-19,21H2,1-4H3,(H,35,40)(H,36,39)/b17-15+ RAUUGOZQJINUFH-BMRADRMJSA-N 50458089 CHEMBL4214842 Cholinesterase 23 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458089 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458089&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145972756 433925354 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038531 COc1cc(\C=C\C(=O)NCCCCNc2c3CCCCc3nc3ccccc23)cc(OC)c1O InChI=1S/C28H33N3O4/c1-34-24-17-19(18-25(35-2)28(24)33)13-14-26(32)29-15-7-8-16-30-27-20-9-3-5-11-22(20)31-23-12-6-4-10-21(23)27/h3,5,9,11,13-14,17-18,33H,4,6-8,10,12,15-16H2,1-2H3,(H,29,32)(H,30,31)/b14-13+ NXYHHIQZPMUETJ-BUHFOSPRSA-N 50458091 CHEMBL4204394 Cholinesterase 241 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458091 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458091&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145970046 433925356 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038532 Oc1ccc(\C=C\C(=O)NCCNc2c3CCCCc3nc3ccccc23)cc1 InChI=1S/C24H25N3O2/c28-18-12-9-17(10-13-18)11-14-23(29)25-15-16-26-24-19-5-1-3-7-21(19)27-22-8-4-2-6-20(22)24/h1,3,5,7,9-14,28H,2,4,6,8,15-16H2,(H,25,29)(H,26,27)/b14-11+ WUQYIVUPNJNGIT-SDNWHVSQSA-N 50458092 CHEMBL4213182 Cholinesterase 302 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458092 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458092&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145965330 433925357 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038536 COc1cc(\C=C\C(=O)NCCCCCCNc2c3CCCCc3nc3ccccc23)ccc1OCc1nc(C)c(C)nc1C InChI=1S/C37H45N5O3/c1-25-26(2)41-33(27(3)40-25)24-45-34-19-17-28(23-35(34)44-4)18-20-36(43)38-21-11-5-6-12-22-39-37-29-13-7-9-15-31(29)42-32-16-10-8-14-30(32)37/h7,9,13,15,17-20,23H,5-6,8,10-12,14,16,21-22,24H2,1-4H3,(H,38,43)(H,39,42)/b20-18+ ZNZXPKBNYXGWIQ-CZIZESTLSA-N 50458094 CHEMBL4217616 Cholinesterase 28 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458094 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458094&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145974961 433925359 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038537 COc1cc(\C=C\C(=O)NCCCCCCCCNc2c3CCCCc3nc3ccccc23)ccc1OCc1nc(C)c(C)nc1C InChI=1S/C39H49N5O3/c1-27-28(2)43-35(29(3)42-27)26-47-36-21-19-30(25-37(36)46-4)20-22-38(45)40-23-13-7-5-6-8-14-24-41-39-31-15-9-11-17-33(31)44-34-18-12-10-16-32(34)39/h9,11,15,17,19-22,25H,5-8,10,12-14,16,18,23-24,26H2,1-4H3,(H,40,45)(H,41,44)/b22-20+ PVIDBKAKJIVPQR-LSDHQDQOSA-N 50458095 CHEMBL4217555 Cholinesterase 174 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458095 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458095&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145974735 433925360 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038538 Cc1nc(C)c(COc2ccc(\C=C\C(=O)NCCNc3c4CCCCc4nc4ccccc34)cc2OCc2nc(C)c(C)nc2C)nc1C InChI=1S/C40H45N7O3/c1-24-26(3)45-35(28(5)43-24)22-49-37-17-15-30(21-38(37)50-23-36-29(6)44-25(2)27(4)46-36)16-18-39(48)41-19-20-42-40-31-11-7-9-13-33(31)47-34-14-10-8-12-32(34)40/h7,9,11,13,15-18,21H,8,10,12,14,19-20,22-23H2,1-6H3,(H,41,48)(H,42,47)/b18-16+ NMKMBFYQBPRNQJ-FBMGVBCBSA-N 50458096 CHEMBL4213685 Cholinesterase >1000 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458096 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458096&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145964879 433925361 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038540 Cc1nc(C)c(COc2ccc(\C=C\C(=O)NCCCCNc3c4CCCCc4nc4ccccc34)cc2OCc2nc(C)c(C)nc2C)nc1C InChI=1S/C42H49N7O3/c1-26-28(3)47-37(30(5)45-26)24-51-39-19-17-32(23-40(39)52-25-38-31(6)46-27(2)29(4)48-38)18-20-41(50)43-21-11-12-22-44-42-33-13-7-9-15-35(33)49-36-16-10-8-14-34(36)42/h7,9,13,15,17-20,23H,8,10-12,14,16,21-22,24-25H2,1-6H3,(H,43,50)(H,44,49)/b20-18+ WPOHYZVTLFECNA-CZIZESTLSA-N 50458075 CHEMBL4209287 Cholinesterase 111 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458075 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458075&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145966341 433925340 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038542 Cc1nc(C)c(COc2ccc(\C=C\C(=O)NCCCCCCNc3c4CCCCc4nc4ccccc34)cc2OCc2nc(C)c(C)nc2C)nc1C InChI=1S/C44H53N7O3/c1-28-30(3)49-39(32(5)47-28)26-53-41-21-19-34(25-42(41)54-27-40-33(6)48-29(2)31(4)50-40)20-22-43(52)45-23-13-7-8-14-24-46-44-35-15-9-11-17-37(35)51-38-18-12-10-16-36(38)44/h9,11,15,17,19-22,25H,7-8,10,12-14,16,18,23-24,26-27H2,1-6H3,(H,45,52)(H,46,51)/b22-20+ OOSGOXWXXKQZCQ-LSDHQDQOSA-N 50458098 CHEMBL4214204 Cholinesterase 68 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458098 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458098&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145971786 433925363 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038544 Cc1nc(C)c(COc2ccc(CC(O)C(=O)NCCNc3c4CCCCc4nc4ccccc34)cc2OCc2nc(C)c(C)nc2C)nc1C InChI=1S/C40H47N7O4/c1-23-25(3)45-34(27(5)43-23)21-50-37-16-15-29(20-38(37)51-22-35-28(6)44-24(2)26(4)46-35)19-36(48)40(49)42-18-17-41-39-30-11-7-9-13-32(30)47-33-14-10-8-12-31(33)39/h7,9,11,13,15-16,20,36,48H,8,10,12,14,17-19,21-22H2,1-6H3,(H,41,47)(H,42,49) UAGJMPSKAHFKDU-UHFFFAOYSA-N 50458099 CHEMBL4209802 Cholinesterase 816 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458099 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458099&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145965437 433925364 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038545 Cc1nc(C)c(COc2ccc(CC(O)C(=O)NCCCNc3c4CCCCc4nc4ccccc34)cc2OCc2nc(C)c(C)nc2C)nc1C InChI=1S/C41H49N7O4/c1-24-26(3)46-35(28(5)44-24)22-51-38-17-16-30(21-39(38)52-23-36-29(6)45-25(2)27(4)47-36)20-37(49)41(50)43-19-11-18-42-40-31-12-7-9-14-33(31)48-34-15-10-8-13-32(34)40/h7,9,12,14,16-17,21,37,49H,8,10-11,13,15,18-20,22-23H2,1-6H3,(H,42,48)(H,43,50) CLVPUYKLVGKBAE-UHFFFAOYSA-N 50458100 CHEMBL4217135 Cholinesterase 165 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458100 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458100&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145972855 433925365 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038547 Cc1nc(C)c(COc2ccc(CC(O)C(=O)NCCCCNc3c4CCCCc4nc4ccccc34)cc2OCc2nc(C)c(C)nc2C)nc1C InChI=1S/C42H51N7O4/c1-25-27(3)47-36(29(5)45-25)23-52-39-18-17-31(22-40(39)53-24-37-30(6)46-26(2)28(4)48-37)21-38(50)42(51)44-20-12-11-19-43-41-32-13-7-9-15-34(32)49-35-16-10-8-14-33(35)41/h7,9,13,15,17-18,22,38,50H,8,10-12,14,16,19-21,23-24H2,1-6H3,(H,43,49)(H,44,51) NEUXXJGDVBPZCB-UHFFFAOYSA-N 50458101 CHEMBL4205424 Cholinesterase >1000 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458101 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458101&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145975861 433925366 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038548 Cc1nc(C)c(COc2ccc(CC(O)C(=O)NCCCCCCCCNc3c4CCCCc4nc4ccccc34)cc2OCc2nc(C)c(C)nc2C)nc1C InChI=1S/C46H59N7O4/c1-29-31(3)51-40(33(5)49-29)27-56-43-22-21-35(26-44(43)57-28-41-34(6)50-30(2)32(4)52-41)25-42(54)46(55)48-24-16-10-8-7-9-15-23-47-45-36-17-11-13-19-38(36)53-39-20-14-12-18-37(39)45/h11,13,17,19,21-22,26,42,54H,7-10,12,14-16,18,20,23-25,27-28H2,1-6H3,(H,47,53)(H,48,55) IYMATWTVAYJILB-UHFFFAOYSA-N 50458102 CHEMBL4217662 Cholinesterase 3.8 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458102 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458102&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145974503 433925367 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038550 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 7.2 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038554 COc1cc(\C=C\C(=O)NCCCCCCCCNc2c3CCCCc3nc3ccccc23)cc(OC)c1O InChI=1S/C32H41N3O4/c1-38-28-21-23(22-29(39-2)32(28)37)17-18-30(36)33-19-11-5-3-4-6-12-20-34-31-24-13-7-9-15-26(24)35-27-16-10-8-14-25(27)31/h7,9,13,15,17-18,21-22,37H,3-6,8,10-12,14,16,19-20H2,1-2H3,(H,33,36)(H,34,35)/b18-17+ HIFBSSYBGUNQLO-ISLYRVAYSA-N 50458090 CHEMBL4207798 Cholinesterase 9.3 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458090 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458090&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145978166 433925355 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038555 COc1cc(\C=C\C(=O)NCCCNc2c3CCCCc3nc3ccccc23)cc(OC)c1O InChI=1S/C27H31N3O4/c1-33-23-16-18(17-24(34-2)27(23)32)12-13-25(31)28-14-7-15-29-26-19-8-3-5-10-21(19)30-22-11-6-4-9-20(22)26/h3,5,8,10,12-13,16-17,32H,4,6-7,9,11,14-15H2,1-2H3,(H,28,31)(H,29,30)/b13-12+ KTBTWCNKPRIJNU-OUKQBFOZSA-N 50458084 CHEMBL4211615 Cholinesterase 330 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458084 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458084&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145963884 433925349 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038558 COc1cc(\C=C\C(=O)NCCCCNc2c3CCCCc3nc3ccccc23)ccc1OCc1nc(C)c(C)nc1C InChI=1S/C35H41N5O3/c1-23-24(2)39-31(25(3)38-23)22-43-32-17-15-26(21-33(32)42-4)16-18-34(41)36-19-9-10-20-37-35-27-11-5-7-13-29(27)40-30-14-8-6-12-28(30)35/h5,7,11,13,15-18,21H,6,8-10,12,14,19-20,22H2,1-4H3,(H,36,41)(H,37,40)/b18-16+ RLEKQEXZHYRQNS-FBMGVBCBSA-N 50458093 CHEMBL4203194 Cholinesterase 32 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458093 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458093&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145975052 433925358 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038560 Cc1nc(C)c(COc2ccc(\C=C\C(=O)NCCCNc3c4CCCCc4nc4ccccc34)cc2OCc2nc(C)c(C)nc2C)nc1C InChI=1S/C41H47N7O3/c1-25-27(3)46-36(29(5)44-25)23-50-38-18-16-31(22-39(38)51-24-37-30(6)45-26(2)28(4)47-37)17-19-40(49)42-20-11-21-43-41-32-12-7-9-14-34(32)48-35-15-10-8-13-33(35)41/h7,9,12,14,16-19,22H,8,10-11,13,15,20-21,23-24H2,1-6H3,(H,42,49)(H,43,48)/b19-17+ DTFUIRUIMNPBCM-HTXNQAPBSA-N 50458097 CHEMBL4218621 Cholinesterase 199 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458097 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458097&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145969174 433925362 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038564 Cc1nc(C)c(COc2ccc(CC(O)C(=O)NCCCCCCNc3c4CCCCc4nc4ccccc34)cc2OCc2nc(C)c(C)nc2C)nc1C InChI=1S/C44H55N7O4/c1-27-29(3)49-38(31(5)47-27)25-54-41-20-19-33(24-42(41)55-26-39-32(6)48-28(2)30(4)50-39)23-40(52)44(53)46-22-14-8-7-13-21-45-43-34-15-9-11-17-36(34)51-37-18-12-10-16-35(37)43/h9,11,15,17,19-20,24,40,52H,7-8,10,12-14,16,18,21-23,25-26H2,1-6H3,(H,45,51)(H,46,53) ZAZZXDSHKIQDMI-UHFFFAOYSA-N 50458104 CHEMBL4212711 Cholinesterase 1.3 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458104 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458104&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145964402 433925369 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038566 Cc1nc(C)c(COc2ccc(\C=C\C(=O)NCCCCNc3c4CCCCc4nc4ccccc34)cc2)nc1C InChI=1S/C34H39N5O2/c1-23-24(2)38-32(25(3)37-23)22-41-27-17-14-26(15-18-27)16-19-33(40)35-20-8-9-21-36-34-28-10-4-6-12-30(28)39-31-13-7-5-11-29(31)34/h4,6,10,12,14-19H,5,7-9,11,13,20-22H2,1-3H3,(H,35,40)(H,36,39)/b19-16+ LGKNSNFILURJNK-KNTRCKAVSA-N 50458105 CHEMBL4210235 Cholinesterase 2.3 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458105 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458105&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145965687 433925370 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038569 Cc1nc(C)c(COc2ccc(\C=C\C(=O)NCCCCCCCCNc3c4CCCCc4nc4ccccc34)cc2)nc1C InChI=1S/C38H47N5O2/c1-27-28(2)42-36(29(3)41-27)26-45-31-21-18-30(19-22-31)20-23-37(44)39-24-12-6-4-5-7-13-25-40-38-32-14-8-10-16-34(32)43-35-17-11-9-15-33(35)38/h8,10,14,16,18-23H,4-7,9,11-13,15,17,24-26H2,1-3H3,(H,39,44)(H,40,43)/b23-20+ ZDJNXZFYWIJHRU-BSYVCWPDSA-N 50458080 CHEMBL4202500 Cholinesterase 228 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458080 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458080&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145975027 433925345 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038572 Oc1ccc(\C=C\C(=O)NCCCCCCCCNc2c3CCCCc3nc3ccccc23)cc1 InChI=1S/C30H37N3O2/c34-24-18-15-23(16-19-24)17-20-29(35)31-21-9-3-1-2-4-10-22-32-30-25-11-5-7-13-27(25)33-28-14-8-6-12-26(28)30/h5,7,11,13,15-20,34H,1-4,6,8-10,12,14,21-22H2,(H,31,35)(H,32,33)/b20-17+ HSGSVNUPYUUXDM-LVZFUZTISA-N 50458106 CHEMBL4205345 Cholinesterase 279 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458106 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458106&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145968681 433925371 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038573 Oc1ccc(\C=C\C(=O)NCCCNc2c3CCCCc3nc3ccccc23)cc1 InChI=1S/C25H27N3O2/c29-19-13-10-18(11-14-19)12-15-24(30)26-16-5-17-27-25-20-6-1-3-8-22(20)28-23-9-4-2-7-21(23)25/h1,3,6,8,10-15,29H,2,4-5,7,9,16-17H2,(H,26,30)(H,27,28)/b15-12+ RPQDGHFXKHJVSM-NTCAYCPXSA-N 50458086 CHEMBL4212639 Cholinesterase 43 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458086 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458086&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145965311 433925351 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51038574 Cc1nc(C)c(COc2ccc(\C=C\C(=O)NCCCCCCCCNc3c4CCCCc4nc4ccccc34)cc2OCc2nc(C)c(C)nc2C)nc1C InChI=1S/C46H57N7O3/c1-30-32(3)51-41(34(5)49-30)28-55-43-23-21-36(27-44(43)56-29-42-35(6)50-31(2)33(4)52-42)22-24-45(54)47-25-15-9-7-8-10-16-26-48-46-37-17-11-13-19-39(37)53-40-20-14-12-18-38(40)46/h11,13,17,19,21-24,27H,7-10,12,14-16,18,20,25-26,28-29H2,1-6H3,(H,47,54)(H,48,53)/b24-22+ HMMRIUOKUWFYLM-ZNTNEXAZSA-N 50458103 CHEMBL4204921 Cholinesterase 62 ChEMBL 10.1016/j.ejmech.2018.01.028 10.7270/Q2CF9SQV 29466774 Li, G; Hong, G; Li, X; Zhang, Y; Xu, Z; Mao, L; Feng, X; Liu, T Chinese Academy of Medical Sciences & Peking Union Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50458103 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50458103&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145975352 433925368 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51134322 COc1nc(sc1C(=O)NCCCNc1c2CCCCc2nc2cc(Cl)ccc12)-c1ccnc(NC(=O)C2CC2)c1 InChI=1S/C30H31ClN6O3S/c1-40-29-26(41-30(37-29)18-11-14-32-24(15-18)36-27(38)17-7-8-17)28(39)34-13-4-12-33-25-20-5-2-3-6-22(20)35-23-16-19(31)9-10-21(23)25/h9-11,14-17H,2-8,12-13H2,1H3,(H,33,35)(H,34,39)(H,32,36,38) WPOYFQFVGWXOSQ-UHFFFAOYSA-N 50465096 CHEMBL4293418 Cholinesterase 290 ChEMBL 10.1021/acsmedchemlett.7b00463 10.7270/Q2MG7S5F 29541355 Jiang, XY; Chen, TK; Zhou, JT; He, SY; Yang, HY; Chen, Y; Qu, W; Feng, F; Sun, HP China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50465096 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50465096&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145988121 433932361 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51134339 COc1nc(sc1C(=O)NCCNc1c2CCCCc2nc2ccc(OC)cc12)-c1ccnc(NC(=O)C2CC2)c1 InChI=1S/C30H32N6O4S/c1-39-19-9-10-23-21(16-19)25(20-5-3-4-6-22(20)34-23)32-13-14-33-28(38)26-29(40-2)36-30(41-26)18-11-12-31-24(15-18)35-27(37)17-7-8-17/h9-12,15-17H,3-8,13-14H2,1-2H3,(H,32,34)(H,33,38)(H,31,35,37) MONBJAXTKVHFAY-UHFFFAOYSA-N 50465103 CHEMBL4285581 Cholinesterase 2100 ChEMBL 10.1021/acsmedchemlett.7b00463 10.7270/Q2MG7S5F 29541355 Jiang, XY; Chen, TK; Zhou, JT; He, SY; Yang, HY; Chen, Y; Qu, W; Feng, F; Sun, HP China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50465103 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50465103&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145992418 433932368 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51134343 COc1nc(sc1C(=O)NCCCNc1c2CCCCc2nc2ccc(OC)cc12)-c1ccnc(NC(=O)C2CC2)c1 InChI=1S/C31H34N6O4S/c1-40-20-10-11-24-22(17-20)26(21-6-3-4-7-23(21)35-24)33-13-5-14-34-29(39)27-30(41-2)37-31(42-27)19-12-15-32-25(16-19)36-28(38)18-8-9-18/h10-12,15-18H,3-9,13-14H2,1-2H3,(H,33,35)(H,34,39)(H,32,36,38) UWTPHLBHBPMCCU-UHFFFAOYSA-N 50465094 CHEMBL4278287 Cholinesterase 2300 ChEMBL 10.1021/acsmedchemlett.7b00463 10.7270/Q2MG7S5F 29541355 Jiang, XY; Chen, TK; Zhou, JT; He, SY; Yang, HY; Chen, Y; Qu, W; Feng, F; Sun, HP China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50465094 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50465094&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145980029 433932359 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51134345 COc1nc(sc1C(=O)NCCNc1c2CCCCc2nc2cc(Cl)ccc12)-c1ccnc(NC(=O)C2CC2)c1 InChI=1S/C29H29ClN6O3S/c1-39-28-25(40-29(36-28)17-10-11-31-23(14-17)35-26(37)16-6-7-16)27(38)33-13-12-32-24-19-4-2-3-5-21(19)34-22-15-18(30)8-9-20(22)24/h8-11,14-16H,2-7,12-13H2,1H3,(H,32,34)(H,33,38)(H,31,35,37) ONFMFCHPRZDMSB-UHFFFAOYSA-N 50465100 CHEMBL4282154 Cholinesterase 410 ChEMBL 10.1021/acsmedchemlett.7b00463 10.7270/Q2MG7S5F 29541355 Jiang, XY; Chen, TK; Zhou, JT; He, SY; Yang, HY; Chen, Y; Qu, W; Feng, F; Sun, HP China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50465100 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50465100&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145982001 433932365 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51131703 [Cl-].Cc1ccc(C[n+]2cccc(Cn3c4ccccc4c4ccccc34)c2)cc1 InChI=1S/C26H23N2/c1-20-12-14-21(15-13-20)17-27-16-6-7-22(18-27)19-28-25-10-4-2-8-23(25)24-9-3-5-11-26(24)28/h2-16,18H,17,19H2,1H3/q+1 FFDAGUGGXBAKRV-UHFFFAOYSA-N 50464019 CHEMBL4245106 Cholinesterase 110 ChEMBL 10.1016/j.bmc.2018.08.035 10.7270/Q2NS0XJS 30190181 Ghobadian, R; Nadri, H; Moradi, A; Bukhari, SNA; Mahdavi, M; Asadi, M; Akbarzadeh, T; Khaleghzadeh-Ahangar, H; Sharifzadeh, M; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50464019 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50464019&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145982602 433931284 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51131704 [Cl-].Cc1cccc(C[n+]2ccc(Cn3c4ccccc4c4ccccc34)cc2)c1 InChI=1S/C26H23N2/c1-20-7-6-8-22(17-20)18-27-15-13-21(14-16-27)19-28-25-11-4-2-9-23(25)24-10-3-5-12-26(24)28/h2-17H,18-19H2,1H3/q+1 VNAIWEVOYRWURX-UHFFFAOYSA-N 50464020 CHEMBL4243151 Cholinesterase 730 ChEMBL 10.1016/j.bmc.2018.08.035 10.7270/Q2NS0XJS 30190181 Ghobadian, R; Nadri, H; Moradi, A; Bukhari, SNA; Mahdavi, M; Asadi, M; Akbarzadeh, T; Khaleghzadeh-Ahangar, H; Sharifzadeh, M; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50464020 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50464020&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145983534 433931285 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51131705 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 9400 ChEMBL 10.1016/j.bmc.2018.08.035 10.7270/Q2NS0XJS 30190181 Ghobadian, R; Nadri, H; Moradi, A; Bukhari, SNA; Mahdavi, M; Asadi, M; Akbarzadeh, T; Khaleghzadeh-Ahangar, H; Sharifzadeh, M; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51131706 [Br-].Cc1ccccc1C[n+]1cccc(Cn2c3ccccc3c3ccccc23)c1 InChI=1S/C26H23N2/c1-20-9-2-3-11-22(20)19-27-16-8-10-21(17-27)18-28-25-14-6-4-12-23(25)24-13-5-7-15-26(24)28/h2-17H,18-19H2,1H3/q+1 XSXPEPVQYSKETF-UHFFFAOYSA-N 50464021 CHEMBL4241338 Cholinesterase 220 ChEMBL 10.1016/j.bmc.2018.08.035 10.7270/Q2NS0XJS 30190181 Ghobadian, R; Nadri, H; Moradi, A; Bukhari, SNA; Mahdavi, M; Asadi, M; Akbarzadeh, T; Khaleghzadeh-Ahangar, H; Sharifzadeh, M; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50464021 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50464021&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145985720 433931286 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51131707 [Cl-].Clc1ccccc1C[n+]1cccc(Cn2c3ccccc3c3ccccc23)c1 InChI=1S/C25H20ClN2/c26-23-12-4-1-9-20(23)18-27-15-7-8-19(16-27)17-28-24-13-5-2-10-21(24)22-11-3-6-14-25(22)28/h1-16H,17-18H2/q+1 CQVQCOJKDZJHNA-UHFFFAOYSA-N 50464022 CHEMBL4244767 Cholinesterase 380 ChEMBL 10.1016/j.bmc.2018.08.035 10.7270/Q2NS0XJS 30190181 Ghobadian, R; Nadri, H; Moradi, A; Bukhari, SNA; Mahdavi, M; Asadi, M; Akbarzadeh, T; Khaleghzadeh-Ahangar, H; Sharifzadeh, M; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50464022 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50464022&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145986209 433931287 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51131708 [Cl-].Clc1ccc(C[n+]2ccc(Cn3c4ccccc4c4ccccc34)cc2)cc1 InChI=1S/C25H20ClN2/c26-21-11-9-19(10-12-21)17-27-15-13-20(14-16-27)18-28-24-7-3-1-5-22(24)23-6-2-4-8-25(23)28/h1-16H,17-18H2/q+1 OHSLIVCOAFQSSB-UHFFFAOYSA-N 50464023 CHEMBL4239383 Cholinesterase 1600 ChEMBL 10.1016/j.bmc.2018.08.035 10.7270/Q2NS0XJS 30190181 Ghobadian, R; Nadri, H; Moradi, A; Bukhari, SNA; Mahdavi, M; Asadi, M; Akbarzadeh, T; Khaleghzadeh-Ahangar, H; Sharifzadeh, M; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50464023 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50464023&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145985907 433931288 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51131709 [Cl-].Fc1ccc(C[n+]2ccc(Cn3c4ccccc4c4ccccc34)cc2)cc1 InChI=1S/C25H20FN2/c26-21-11-9-19(10-12-21)17-27-15-13-20(14-16-27)18-28-24-7-3-1-5-22(24)23-6-2-4-8-25(23)28/h1-16H,17-18H2/q+1 KYGCSLVFRRPCMO-UHFFFAOYSA-N 50464024 CHEMBL4246944 Cholinesterase 890 ChEMBL 10.1016/j.bmc.2018.08.035 10.7270/Q2NS0XJS 30190181 Ghobadian, R; Nadri, H; Moradi, A; Bukhari, SNA; Mahdavi, M; Asadi, M; Akbarzadeh, T; Khaleghzadeh-Ahangar, H; Sharifzadeh, M; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50464024 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50464024&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145984068 433931289 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51131714 [Br-].Cc1ccccc1C[n+]1ccc(Cn2c3ccccc3c3ccccc23)cc1 InChI=1S/C26H23N2/c1-20-8-2-3-9-22(20)19-27-16-14-21(15-17-27)18-28-25-12-6-4-10-23(25)24-11-5-7-13-26(24)28/h2-17H,18-19H2,1H3/q+1 CSMNOBOEDLSCBJ-UHFFFAOYSA-N 50464027 CHEMBL4243615 Cholinesterase 350 ChEMBL 10.1016/j.bmc.2018.08.035 10.7270/Q2NS0XJS 30190181 Ghobadian, R; Nadri, H; Moradi, A; Bukhari, SNA; Mahdavi, M; Asadi, M; Akbarzadeh, T; Khaleghzadeh-Ahangar, H; Sharifzadeh, M; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50464027 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50464027&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145986193 433931292 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51131716 [Cl-].Clc1ccc(C[n+]2cccc(Cn3c4ccccc4c4ccccc34)c2)cc1 InChI=1S/C25H20ClN2/c26-21-13-11-19(12-14-21)16-27-15-5-6-20(17-27)18-28-24-9-3-1-7-22(24)23-8-2-4-10-25(23)28/h1-15,17H,16,18H2/q+1 KCVJBYOZVXQRQB-UHFFFAOYSA-N 50464028 CHEMBL4241164 Cholinesterase 90 ChEMBL 10.1016/j.bmc.2018.08.035 10.7270/Q2NS0XJS 30190181 Ghobadian, R; Nadri, H; Moradi, A; Bukhari, SNA; Mahdavi, M; Asadi, M; Akbarzadeh, T; Khaleghzadeh-Ahangar, H; Sharifzadeh, M; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50464028 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50464028&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145983263 433931293 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51131717 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 350 ChEMBL 10.1016/j.bmc.2018.08.035 10.7270/Q2NS0XJS 30190181 Ghobadian, R; Nadri, H; Moradi, A; Bukhari, SNA; Mahdavi, M; Asadi, M; Akbarzadeh, T; Khaleghzadeh-Ahangar, H; Sharifzadeh, M; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51131718 [Br-].C(c1ccc[n+](Cc2ccccc2)c1)n1c2ccccc2c2ccccc12 InChI=1S/C25H21N2/c1-2-9-20(10-3-1)17-26-16-8-11-21(18-26)19-27-24-14-6-4-12-22(24)23-13-5-7-15-25(23)27/h1-16,18H,17,19H2/q+1 XNQMDXWDOYSBMU-UHFFFAOYSA-N 50464029 CHEMBL4242583 Cholinesterase 270 ChEMBL 10.1016/j.bmc.2018.08.035 10.7270/Q2NS0XJS 30190181 Ghobadian, R; Nadri, H; Moradi, A; Bukhari, SNA; Mahdavi, M; Asadi, M; Akbarzadeh, T; Khaleghzadeh-Ahangar, H; Sharifzadeh, M; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50464029 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50464029&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145983773 433931294 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51131719 [Cl-].Cc1cccc(C[n+]2cccc(Cn3c4ccccc4c4ccccc34)c2)c1 InChI=1S/C26H23N2/c1-20-8-6-9-21(16-20)17-27-15-7-10-22(18-27)19-28-25-13-4-2-11-23(25)24-12-3-5-14-26(24)28/h2-16,18H,17,19H2,1H3/q+1 WWZJSDNLWMILGU-UHFFFAOYSA-N 50464030 CHEMBL4244620 Cholinesterase 280 ChEMBL 10.1016/j.bmc.2018.08.035 10.7270/Q2NS0XJS 30190181 Ghobadian, R; Nadri, H; Moradi, A; Bukhari, SNA; Mahdavi, M; Asadi, M; Akbarzadeh, T; Khaleghzadeh-Ahangar, H; Sharifzadeh, M; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50464030 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50464030&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145984276 433931295 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51131720 [Cl-].Clc1ccc(C[n+]2cccc(Cn3c4ccccc4c4ccccc34)c2)cc1 InChI=1S/C25H20ClN2/c26-21-13-11-19(12-14-21)16-27-15-5-6-20(17-27)18-28-24-9-3-1-7-22(24)23-8-2-4-10-25(23)28/h1-15,17H,16,18H2/q+1 KCVJBYOZVXQRQB-UHFFFAOYSA-N 50464028 CHEMBL4241164 Cholinesterase 73 ChEMBL 10.1016/j.bmc.2018.08.035 10.7270/Q2NS0XJS 30190181 Ghobadian, R; Nadri, H; Moradi, A; Bukhari, SNA; Mahdavi, M; Asadi, M; Akbarzadeh, T; Khaleghzadeh-Ahangar, H; Sharifzadeh, M; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50464028 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50464028&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145983263 433931293 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51131721 [Br-].Clc1cccc(C[n+]2cccc(Cn3c4ccccc4c4ccccc34)c2)c1 InChI=1S/C25H20ClN2/c26-21-9-5-7-19(15-21)16-27-14-6-8-20(17-27)18-28-24-12-3-1-10-22(24)23-11-2-4-13-25(23)28/h1-15,17H,16,18H2/q+1 RVHXNBJTTLLBSP-UHFFFAOYSA-N 50464025 CHEMBL4244170 Cholinesterase 160 ChEMBL 10.1016/j.bmc.2018.08.035 10.7270/Q2NS0XJS 30190181 Ghobadian, R; Nadri, H; Moradi, A; Bukhari, SNA; Mahdavi, M; Asadi, M; Akbarzadeh, T; Khaleghzadeh-Ahangar, H; Sharifzadeh, M; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50464025 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50464025&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145986201 433931290 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51131722 [Br-].Fc1ccc(C[n+]2cccc(Cn3c4ccccc4c4ccccc34)c2)cc1 InChI=1S/C25H20FN2/c26-21-13-11-19(12-14-21)16-27-15-5-6-20(17-27)18-28-24-9-3-1-7-22(24)23-8-2-4-10-25(23)28/h1-15,17H,16,18H2/q+1 PEDACAOWLSQRGN-UHFFFAOYSA-N 50464031 CHEMBL4248896 Cholinesterase 130 ChEMBL 10.1016/j.bmc.2018.08.035 10.7270/Q2NS0XJS 30190181 Ghobadian, R; Nadri, H; Moradi, A; Bukhari, SNA; Mahdavi, M; Asadi, M; Akbarzadeh, T; Khaleghzadeh-Ahangar, H; Sharifzadeh, M; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50464031 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50464031&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145983134 433931296 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51131723 [Cl-].Fc1ccccc1C[n+]1cccc(Cn2c3ccccc3c3ccccc23)c1 InChI=1S/C25H20FN2/c26-23-12-4-1-9-20(23)18-27-15-7-8-19(16-27)17-28-24-13-5-2-10-21(24)22-11-3-6-14-25(22)28/h1-16H,17-18H2/q+1 DCPNANXTBLQSHG-UHFFFAOYSA-N 50464017 CHEMBL4247756 Cholinesterase 370 ChEMBL 10.1016/j.bmc.2018.08.035 10.7270/Q2NS0XJS 30190181 Ghobadian, R; Nadri, H; Moradi, A; Bukhari, SNA; Mahdavi, M; Asadi, M; Akbarzadeh, T; Khaleghzadeh-Ahangar, H; Sharifzadeh, M; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50464017 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50464017&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145986250 433931282 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51131724 [Cl-].Cc1ccc(C[n+]2ccc(Cn3c4ccccc4c4ccccc34)cc2)cc1 InChI=1S/C26H23N2/c1-20-10-12-21(13-11-20)18-27-16-14-22(15-17-27)19-28-25-8-4-2-6-23(25)24-7-3-5-9-26(24)28/h2-17H,18-19H2,1H3/q+1 GAPZJIDCDUJHOF-UHFFFAOYSA-N 50464032 CHEMBL4247394 Cholinesterase 810 ChEMBL 10.1016/j.bmc.2018.08.035 10.7270/Q2NS0XJS 30190181 Ghobadian, R; Nadri, H; Moradi, A; Bukhari, SNA; Mahdavi, M; Asadi, M; Akbarzadeh, T; Khaleghzadeh-Ahangar, H; Sharifzadeh, M; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50464032 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50464032&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145986242 433931297 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51131725 [Br-].Clc1cccc(C[n+]2ccc(Cn3c4ccccc4c4ccccc34)cc2)c1 InChI=1S/C25H20ClN2/c26-21-7-5-6-20(16-21)17-27-14-12-19(13-15-27)18-28-24-10-3-1-8-22(24)23-9-2-4-11-25(23)28/h1-16H,17-18H2/q+1 XXSVKGKBMOOTEJ-UHFFFAOYSA-N 50464026 CHEMBL4240662 Cholinesterase 350 ChEMBL 10.1016/j.bmc.2018.08.035 10.7270/Q2NS0XJS 30190181 Ghobadian, R; Nadri, H; Moradi, A; Bukhari, SNA; Mahdavi, M; Asadi, M; Akbarzadeh, T; Khaleghzadeh-Ahangar, H; Sharifzadeh, M; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50464026 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50464026&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145983988 433931291 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51131726 [Cl-].Clc1ccccc1C[n+]1ccc(Cn2c3ccccc3c3ccccc23)cc1 InChI=1S/C25H20ClN2/c26-23-10-4-1-7-20(23)18-27-15-13-19(14-16-27)17-28-24-11-5-2-8-21(24)22-9-3-6-12-25(22)28/h1-16H,17-18H2/q+1 HBSSYAZJEBYXLS-UHFFFAOYSA-N 50464033 CHEMBL4250760 Cholinesterase 590 ChEMBL 10.1016/j.bmc.2018.08.035 10.7270/Q2NS0XJS 30190181 Ghobadian, R; Nadri, H; Moradi, A; Bukhari, SNA; Mahdavi, M; Asadi, M; Akbarzadeh, T; Khaleghzadeh-Ahangar, H; Sharifzadeh, M; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50464033 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50464033&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145985601 433931298 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51131727 [Br-].C(c1cc[n+](Cc2ccccc2)cc1)n1c2ccccc2c2ccccc12 InChI=1S/C25H21N2/c1-2-8-20(9-3-1)18-26-16-14-21(15-17-26)19-27-24-12-6-4-10-22(24)23-11-5-7-13-25(23)27/h1-17H,18-19H2/q+1 AJSSDVOBENTWGF-UHFFFAOYSA-N 50464034 CHEMBL4251230 Cholinesterase 580 ChEMBL 10.1016/j.bmc.2018.08.035 10.7270/Q2NS0XJS 30190181 Ghobadian, R; Nadri, H; Moradi, A; Bukhari, SNA; Mahdavi, M; Asadi, M; Akbarzadeh, T; Khaleghzadeh-Ahangar, H; Sharifzadeh, M; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50464034 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50464034&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145983396 433931299 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51131728 [Cl-].Fc1cccc(C[n+]2ccc(Cn3c4ccccc4c4ccccc34)cc2)c1 InChI=1S/C25H20FN2/c26-21-7-5-6-20(16-21)17-27-14-12-19(13-15-27)18-28-24-10-3-1-8-22(24)23-9-2-4-11-25(23)28/h1-16H,17-18H2/q+1 BQWFRMVFAFIWNL-UHFFFAOYSA-N 50464035 CHEMBL4249779 Cholinesterase 1100 ChEMBL 10.1016/j.bmc.2018.08.035 10.7270/Q2NS0XJS 30190181 Ghobadian, R; Nadri, H; Moradi, A; Bukhari, SNA; Mahdavi, M; Asadi, M; Akbarzadeh, T; Khaleghzadeh-Ahangar, H; Sharifzadeh, M; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50464035 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50464035&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145983870 433931300 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51131729 [Cl-].Fc1ccccc1C[n+]1ccc(Cn2c3ccccc3c3ccccc23)cc1 InChI=1S/C25H20FN2/c26-23-10-4-1-7-20(23)18-27-15-13-19(14-16-27)17-28-24-11-5-2-8-21(24)22-9-3-6-12-25(22)28/h1-16H,17-18H2/q+1 JNWYEEZWKOJXQJ-UHFFFAOYSA-N 50464018 CHEMBL4239674 Cholinesterase 670 ChEMBL 10.1016/j.bmc.2018.08.035 10.7270/Q2NS0XJS 30190181 Ghobadian, R; Nadri, H; Moradi, A; Bukhari, SNA; Mahdavi, M; Asadi, M; Akbarzadeh, T; Khaleghzadeh-Ahangar, H; Sharifzadeh, M; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50464018 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50464018&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145985908 433931283 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51131742 [Br-].Fc1cccc(C[n+]2cccc(Cn3c4ccccc4c4ccccc34)c2)c1 InChI=1S/C25H20FN2/c26-21-9-5-7-19(15-21)16-27-14-6-8-20(17-27)18-28-24-12-3-1-10-22(24)23-11-2-4-13-25(23)28/h1-15,17H,16,18H2/q+1 LIVIRMOYPQJEDC-UHFFFAOYSA-N 50464036 CHEMBL4240265 Cholinesterase 750 ChEMBL 10.1016/j.bmc.2018.08.035 10.7270/Q2NS0XJS 30190181 Ghobadian, R; Nadri, H; Moradi, A; Bukhari, SNA; Mahdavi, M; Asadi, M; Akbarzadeh, T; Khaleghzadeh-Ahangar, H; Sharifzadeh, M; Amini, M Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50464036 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50464036&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145982761 433931301 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51130767 CC(=O)\C=C\N(Cc1ccccc1)Cc1c(C=C)oc2ccc(Br)cc2c1=O InChI=1S/C23H20BrNO3/c1-3-21-20(23(27)19-13-18(24)9-10-22(19)28-21)15-25(12-11-16(2)26)14-17-7-5-4-6-8-17/h3-13H,1,14-15H2,2H3/b12-11+ FJKQIIDZZAPLQB-VAWYXSNFSA-N 50463656 CHEMBL4250287 Cholinesterase 13500 ChEMBL 10.1016/j.bmc.2018.08.010 10.7270/Q2RR21X9 30104121 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Rudakova, EV; Serebryakova, OG; Kulikova, LN; Beloglazkin, AA; Borisov, RS; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50463656 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50463656&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145983635 433930921 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51130768 O=c1c2CN(Cc3ccccc3)CCc2oc2ccccc12 InChI=1S/C19H17NO2/c21-19-15-8-4-5-9-17(15)22-18-10-11-20(13-16(18)19)12-14-6-2-1-3-7-14/h1-9H,10-13H2 MBCDTAMAJUIOEG-UHFFFAOYSA-N 50463657 CHEMBL4244773 Cholinesterase >20000 ChEMBL 10.1016/j.bmc.2018.08.010 10.7270/Q2RR21X9 30104121 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Rudakova, EV; Serebryakova, OG; Kulikova, LN; Beloglazkin, AA; Borisov, RS; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50463657 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50463657&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12327577 433930922 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51130775 COC(=O)\C=C(\N(Cc1ccccc1)Cc1c(C=C)oc2ccc(Br)cc2c1=O)C(=O)OC InChI=1S/C25H22BrNO6/c1-4-21-19(24(29)18-12-17(26)10-11-22(18)33-21)15-27(14-16-8-6-5-7-9-16)20(25(30)32-3)13-23(28)31-2/h4-13H,1,14-15H2,2-3H3/b20-13+ XAUCSYSMRFHFDP-DEDYPNTBSA-N 50463661 CHEMBL4238512 Cholinesterase >20000 ChEMBL 10.1016/j.bmc.2018.08.010 10.7270/Q2RR21X9 30104121 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Rudakova, EV; Serebryakova, OG; Kulikova, LN; Beloglazkin, AA; Borisov, RS; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50463661 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50463661&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145985684 433930926 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51130776 CC(=O)\C=C\N(Cc1ccccc1)Cc1c(C=C)oc2ccccc2c1=O InChI=1S/C23H21NO3/c1-3-21-20(23(26)19-11-7-8-12-22(19)27-21)16-24(14-13-17(2)25)15-18-9-5-4-6-10-18/h3-14H,1,15-16H2,2H3/b14-13+ NNPFZEIZCRKSIS-BUHFOSPRSA-N 50463658 CHEMBL4246032 Cholinesterase 4750 ChEMBL 10.1016/j.bmc.2018.08.010 10.7270/Q2RR21X9 30104121 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Rudakova, EV; Serebryakova, OG; Kulikova, LN; Beloglazkin, AA; Borisov, RS; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50463658 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50463658&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145983572 433930923 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51130777 COC(=O)\C=C\N(Cc1ccccc1)Cc1c(C=C)oc2ccccc2c1=O InChI=1S/C23H21NO4/c1-3-20-19(23(26)18-11-7-8-12-21(18)28-20)16-24(14-13-22(25)27-2)15-17-9-5-4-6-10-17/h3-14H,1,15-16H2,2H3/b14-13+ ASFSQPGZJGJDBV-BUHFOSPRSA-N 50463663 CHEMBL4244573 Cholinesterase 6310 ChEMBL 10.1016/j.bmc.2018.08.010 10.7270/Q2RR21X9 30104121 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Rudakova, EV; Serebryakova, OG; Kulikova, LN; Beloglazkin, AA; Borisov, RS; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50463663 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50463663&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 142762241 433930928 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51130779 COC(=O)\C=C\N(Cc1ccccc1)Cc1c(C=C)oc2ccc(Br)cc2c1=O InChI=1S/C23H20BrNO4/c1-3-20-19(23(27)18-13-17(24)9-10-21(18)29-20)15-25(12-11-22(26)28-2)14-16-7-5-4-6-8-16/h3-13H,1,14-15H2,2H3/b12-11+ RYHDVPSSHXBNML-VAWYXSNFSA-N 50463665 CHEMBL4240365 Cholinesterase 1550 ChEMBL 10.1016/j.bmc.2018.08.010 10.7270/Q2RR21X9 30104121 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Rudakova, EV; Serebryakova, OG; Kulikova, LN; Beloglazkin, AA; Borisov, RS; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50463665 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50463665&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145983982 433930930 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51130783 COC(=O)\C=C(\N1CCc2oc3ccc(Br)cc3c(=O)c2C1)C(=O)OC InChI=1S/C18H16BrNO6/c1-24-16(21)8-13(18(23)25-2)20-6-5-15-12(9-20)17(22)11-7-10(19)3-4-14(11)26-15/h3-4,7-8H,5-6,9H2,1-2H3/b13-8+ YTQJZHJJHBGHAW-MDWZMJQESA-N 50463666 CHEMBL4238937 Cholinesterase >20000 ChEMBL 10.1016/j.bmc.2018.08.010 10.7270/Q2RR21X9 30104121 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Rudakova, EV; Serebryakova, OG; Kulikova, LN; Beloglazkin, AA; Borisov, RS; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50463666 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50463666&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145983966 433930931 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51130784 CN1CCc2oc3ccc(Br)cc3c(=O)c2C1 InChI=1S/C13H12BrNO2/c1-15-5-4-12-10(7-15)13(16)9-6-8(14)2-3-11(9)17-12/h2-3,6H,4-5,7H2,1H3 RHJVOVPFZIKCMT-UHFFFAOYSA-N 50463667 CHEMBL4248378 Cholinesterase >20000 ChEMBL 10.1016/j.bmc.2018.08.010 10.7270/Q2RR21X9 30104121 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Rudakova, EV; Serebryakova, OG; Kulikova, LN; Beloglazkin, AA; Borisov, RS; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50463667 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50463667&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145983847 433930932 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51130785 CCOc1cccc2c1oc(C=C)c(CN(Cc1ccccc1)C(=C\C(=O)OC)\C(=O)OC)c2=O InChI=1S/C27H27NO7/c1-5-22-20(25(30)19-13-10-14-23(34-6-2)26(19)35-22)17-28(16-18-11-8-7-9-12-18)21(27(31)33-4)15-24(29)32-3/h5,7-15H,1,6,16-17H2,2-4H3/b21-15+ JFVWFYAVOKOIOJ-RCCKNPSSSA-N 50463668 CHEMBL4242675 Cholinesterase >20000 ChEMBL 10.1016/j.bmc.2018.08.010 10.7270/Q2RR21X9 30104121 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Rudakova, EV; Serebryakova, OG; Kulikova, LN; Beloglazkin, AA; Borisov, RS; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50463668 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50463668&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145985253 433930933 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51130806 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 29 ChEMBL 10.1016/j.bmc.2018.08.010 10.7270/Q2RR21X9 30104121 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Rudakova, EV; Serebryakova, OG; Kulikova, LN; Beloglazkin, AA; Borisov, RS; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51130807 CCOc1cccc2c1oc1CCN(Cc1c2=O)C(=C\C(=O)OC)\C(=O)OC InChI=1S/C20H21NO7/c1-4-27-16-7-5-6-12-18(23)13-11-21(9-8-15(13)28-19(12)16)14(20(24)26-3)10-17(22)25-2/h5-7,10H,4,8-9,11H2,1-3H3/b14-10+ PXFJLZASHUNCAM-GXDHUFHOSA-N 50463660 CHEMBL4250314 Cholinesterase >20000 ChEMBL 10.1016/j.bmc.2018.08.010 10.7270/Q2RR21X9 30104121 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Rudakova, EV; Serebryakova, OG; Kulikova, LN; Beloglazkin, AA; Borisov, RS; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50463660 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50463660&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145983881 433930925 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51130808 COC(=O)\C=C(\N1CCc2oc3ccccc3c(=O)c2C1)C(=O)OC InChI=1S/C18H17NO6/c1-23-16(20)9-13(18(22)24-2)19-8-7-15-12(10-19)17(21)11-5-3-4-6-14(11)25-15/h3-6,9H,7-8,10H2,1-2H3/b13-9+ CBHGZRUZTWJBPP-UKTHLTGXSA-N 50463670 CHEMBL4248994 Cholinesterase >20000 ChEMBL 10.1016/j.bmc.2018.08.010 10.7270/Q2RR21X9 30104121 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Rudakova, EV; Serebryakova, OG; Kulikova, LN; Beloglazkin, AA; Borisov, RS; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50463670 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50463670&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145984835 433930935 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51130809 COC(=O)\C=C(\N(Cc1ccccc1)Cc1c(C=C)oc2ccccc2c1=O)C(=O)OC InChI=1S/C25H23NO6/c1-4-21-19(24(28)18-12-8-9-13-22(18)32-21)16-26(15-17-10-6-5-7-11-17)20(25(29)31-3)14-23(27)30-2/h4-14H,1,15-16H2,2-3H3/b20-14+ QDXJQZJQJKTBLI-XSFVSMFZSA-N 50463664 CHEMBL4250143 Cholinesterase 13800 ChEMBL 10.1016/j.bmc.2018.08.010 10.7270/Q2RR21X9 30104121 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Rudakova, EV; Serebryakova, OG; Kulikova, LN; Beloglazkin, AA; Borisov, RS; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50463664 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50463664&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 142762240 433930929 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51130810 CCOc1cccc2c1oc(C=C)c(CN(Cc1ccccc1)\C=C\C(C)=O)c2=O InChI=1S/C25H25NO4/c1-4-22-21(24(28)20-12-9-13-23(29-5-2)25(20)30-22)17-26(15-14-18(3)27)16-19-10-7-6-8-11-19/h4,6-15H,1,5,16-17H2,2-3H3/b15-14+ DZNRHBTZBCNVTA-CCEZHUSRSA-N 50463676 CHEMBL4242210 Cholinesterase 50100 ChEMBL 10.1016/j.bmc.2018.08.010 10.7270/Q2RR21X9 30104121 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Rudakova, EV; Serebryakova, OG; Kulikova, LN; Beloglazkin, AA; Borisov, RS; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50463676 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50463676&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145982559 433930941 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51130811 COC(=O)\C=C\N(C)Cc1c(C=C)oc2ccc(Br)cc2c1=O InChI=1S/C17H16BrNO4/c1-4-14-13(10-19(2)8-7-16(20)22-3)17(21)12-9-11(18)5-6-15(12)23-14/h4-9H,1,10H2,2-3H3/b8-7+ KMUDFIMFLWWCRF-BQYQJAHWSA-N 50463672 CHEMBL4249829 Cholinesterase >20000 ChEMBL 10.1016/j.bmc.2018.08.010 10.7270/Q2RR21X9 30104121 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Rudakova, EV; Serebryakova, OG; Kulikova, LN; Beloglazkin, AA; Borisov, RS; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50463672 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50463672&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145984586 433930937 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51130812 CCOc1cccc2c1oc(C=C)c(CN(Cc1ccccc1)\C=C\C(=O)OC)c2=O InChI=1S/C25H25NO5/c1-4-21-20(24(28)19-12-9-13-22(30-5-2)25(19)31-21)17-26(15-14-23(27)29-3)16-18-10-7-6-8-11-18/h4,6-15H,1,5,16-17H2,2-3H3/b15-14+ SWQLJEIFMWGQNJ-CCEZHUSRSA-N 50463673 CHEMBL4241628 Cholinesterase >20000 ChEMBL 10.1016/j.bmc.2018.08.010 10.7270/Q2RR21X9 30104121 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Rudakova, EV; Serebryakova, OG; Kulikova, LN; Beloglazkin, AA; Borisov, RS; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50463673 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50463673&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145985475 433930938 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51130813 COC(=O)\C=C\N(Cc1ccccc1)Cc1c(C=C)oc2ccc(Br)cc2c1=O InChI=1S/C23H20BrNO4/c1-3-20-19(23(27)18-13-17(24)9-10-21(18)29-20)15-25(12-11-22(26)28-2)14-16-7-5-4-6-8-16/h3-13H,1,14-15H2,2H3/b12-11+ RYHDVPSSHXBNML-VAWYXSNFSA-N 50463665 CHEMBL4240365 Cholinesterase 2270 ChEMBL 10.1016/j.bmc.2018.08.010 10.7270/Q2RR21X9 30104121 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Rudakova, EV; Serebryakova, OG; Kulikova, LN; Beloglazkin, AA; Borisov, RS; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50463665 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50463665&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145983982 433930930 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51130814 CCOc1cccc2c1oc1CCN(Cc3ccccc3)Cc1c2=O InChI=1S/C21H21NO3/c1-2-24-19-10-6-9-16-20(23)17-14-22(12-11-18(17)25-21(16)19)13-15-7-4-3-5-8-15/h3-10H,2,11-14H2,1H3 KUGALMXCRGARKJ-UHFFFAOYSA-N 50463675 CHEMBL4241100 Cholinesterase >20000 ChEMBL 10.1016/j.bmc.2018.08.010 10.7270/Q2RR21X9 30104121 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Rudakova, EV; Serebryakova, OG; Kulikova, LN; Beloglazkin, AA; Borisov, RS; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50463675 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50463675&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145986161 433930940 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51130815 Brc1ccc2oc3CCN(Cc4ccccc4)Cc3c(=O)c2c1 InChI=1S/C19H16BrNO2/c20-14-6-7-17-15(10-14)19(22)16-12-21(9-8-18(16)23-17)11-13-4-2-1-3-5-13/h1-7,10H,8-9,11-12H2 WRGPWRBWCYJJDO-UHFFFAOYSA-N 50463674 CHEMBL4250950 Cholinesterase >20000 ChEMBL 10.1016/j.bmc.2018.08.010 10.7270/Q2RR21X9 30104121 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Rudakova, EV; Serebryakova, OG; Kulikova, LN; Beloglazkin, AA; Borisov, RS; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50463674 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50463674&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145983888 433930939 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51130817 COC(=O)\C=C\N(C)Cc1c(C=C)oc2ccccc2c1=O InChI=1S/C17H17NO4/c1-4-14-13(11-18(2)10-9-16(19)21-3)17(20)12-7-5-6-8-15(12)22-14/h4-10H,1,11H2,2-3H3/b10-9+ XXGUTUFLGHMCMA-MDZDMXLPSA-N 50463662 CHEMBL4237467 Cholinesterase >20000 ChEMBL 10.1016/j.bmc.2018.08.010 10.7270/Q2RR21X9 30104121 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Rudakova, EV; Serebryakova, OG; Kulikova, LN; Beloglazkin, AA; Borisov, RS; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50463662 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50463662&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 142762242 433930927 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51130819 COC(=O)\C=C\N(Cc1ccccc1)Cc1c(C=C)oc2ccccc2c1=O InChI=1S/C23H21NO4/c1-3-20-19(23(26)18-11-7-8-12-21(18)28-20)16-24(14-13-22(25)27-2)15-17-9-5-4-6-10-17/h3-14H,1,15-16H2,2H3/b14-13+ ASFSQPGZJGJDBV-BUHFOSPRSA-N 50463663 CHEMBL4244573 Cholinesterase 1790 ChEMBL 10.1016/j.bmc.2018.08.010 10.7270/Q2RR21X9 30104121 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Rudakova, EV; Serebryakova, OG; Kulikova, LN; Beloglazkin, AA; Borisov, RS; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50463663 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50463663&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 142762241 433930928 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51130820 CC(=O)\C=C\N(Cc1ccccc1)Cc1c(C=C)oc2ccccc2c1=O InChI=1S/C23H21NO3/c1-3-21-20(23(26)19-11-7-8-12-22(19)27-21)16-24(14-13-17(2)25)15-18-9-5-4-6-10-18/h3-14H,1,15-16H2,2H3/b14-13+ NNPFZEIZCRKSIS-BUHFOSPRSA-N 50463658 CHEMBL4246032 Cholinesterase 2120 ChEMBL 10.1016/j.bmc.2018.08.010 10.7270/Q2RR21X9 30104121 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Rudakova, EV; Serebryakova, OG; Kulikova, LN; Beloglazkin, AA; Borisov, RS; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50463658 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50463658&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145983572 433930923 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51128794 C[C@@H](NC(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CC1)N(C)S(C)(=O)=O)c1ccccc1 InChI=1S/C31H38N4O5S/c1-21(23-12-8-5-9-13-23)33-30(37)24-17-25(19-27(18-24)35(2)41(3,39)40)31(38)34-28(16-22-10-6-4-7-11-22)29(36)20-32-26-14-15-26/h4-13,17-19,21,26,28-29,32,36H,14-16,20H2,1-3H3,(H,33,37)(H,34,38)/t21-,28+,29-/m1/s1 VPNIQGRFZCTBEZ-SPTGULJVSA-N 16034 1-N-[(2S,3R)-4-(cyclopropylamino)-3-hydroxy-1-phenylbutan-2-yl]-5-(N-methylmethanesulfonamido)-3-N-[(1R)-1-phenylethyl]benzene-1,3-dicarboxamide::5-Substituted isophthalamide, 1::CHEMBL378225::Isophthalamide Derivative 24::L-000384950::N-[(1S,2R)-1-benzyl-3-(cyclopropylamino)-2-hydroxypropyl]-5-[methyl(methylsulfonyl)amino]-N-[(1R)-1-phenylethyl]benzene-1,3-dicarboxamide::hydroxyethylamine (HEA) derived inhibitor 1 Cholinesterase 15 ChEMBL 10.1016/j.bmcl.2018.07.019 10.7270/Q2R21422 30017317 Gabr, MT; Abdel-Raziq, MS Mansoura University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=16034 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=16034&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5HA 3TPP,3TPR,2B8L 5287532 46516301 CHEMBL378225 ZINC14960423 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51128797 COc1ccc2C(=O)\C(Cc2c1)=C/c1ccccc1-c1ccc2nc(N)ccc2c1 InChI=1S/C26H20N2O2/c1-30-21-8-9-23-19(15-21)14-20(26(23)29)13-16-4-2-3-5-22(16)17-6-10-24-18(12-17)7-11-25(27)28-24/h2-13,15H,14H2,1H3,(H2,27,28)/b20-13- JRVMVHDNABIRIF-MOSHPQCFSA-N 50462968 CHEMBL4240861 Cholinesterase 13 ChEMBL 10.1016/j.bmcl.2018.07.019 10.7270/Q2R21422 30017317 Gabr, MT; Abdel-Raziq, MS Mansoura University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50462968 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50462968&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145982543 433930233 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51128798 COc1ccc2C(=O)\C(Cc2c1)=C/c1ccccc1-c1ccc2nc(N)ccc2c1 InChI=1S/C26H20N2O2/c1-30-21-8-9-23-19(15-21)14-20(26(23)29)13-16-4-2-3-5-22(16)17-6-10-24-18(12-17)7-11-25(27)28-24/h2-13,15H,14H2,1H3,(H2,27,28)/b20-13- JRVMVHDNABIRIF-MOSHPQCFSA-N 50462968 CHEMBL4240861 Cholinesterase 1780 ChEMBL 10.1016/j.bmcl.2018.07.019 10.7270/Q2R21422 30017317 Gabr, MT; Abdel-Raziq, MS Mansoura University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50462968 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50462968&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145982543 433930233 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51128799 COc1ccc2C(=O)\C(Cc2c1)=C/c1ccccc1-c1ccc2ccccc2c1 InChI=1S/C27H20O2/c1-29-24-12-13-26-22(17-24)16-23(27(26)28)15-20-8-4-5-9-25(20)21-11-10-18-6-2-3-7-19(18)14-21/h2-15,17H,16H2,1H3/b23-15- YPSKYNKEQAAUJV-HAHDFKILSA-N 50462969 CHEMBL4242359 Cholinesterase 101 ChEMBL 10.1016/j.bmcl.2018.07.019 10.7270/Q2R21422 30017317 Gabr, MT; Abdel-Raziq, MS Mansoura University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50462969 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50462969&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145984734 433930234 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51128803 COc1ccc2C(=O)\C(Cc2c1)=C/C1CCN(Cc2ccccc2)CC1 InChI=1S/C23H25NO2/c1-26-21-7-8-22-19(15-21)14-20(23(22)25)13-17-9-11-24(12-10-17)16-18-5-3-2-4-6-18/h2-8,13,15,17H,9-12,14,16H2,1H3/b20-13- CNIWTTNRVIMZIP-MOSHPQCFSA-N 50462970 CHEMBL4241840 Cholinesterase 341 ChEMBL 10.1016/j.bmcl.2018.07.019 10.7270/Q2R21422 30017317 Gabr, MT; Abdel-Raziq, MS Mansoura University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50462970 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50462970&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145984482 433930235 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51128804 COc1ccc2C(=O)\C(Cc2c1)=C/c1ccccc1-c1ccccc1 InChI=1S/C23H18O2/c1-25-20-11-12-22-18(15-20)14-19(23(22)24)13-17-9-5-6-10-21(17)16-7-3-2-4-8-16/h2-13,15H,14H2,1H3/b19-13- YKOCNDOHGCGTRO-UYRXBGFRSA-N 50462967 CHEMBL4243474 Cholinesterase 125 ChEMBL 10.1016/j.bmcl.2018.07.019 10.7270/Q2R21422 30017317 Gabr, MT; Abdel-Raziq, MS Mansoura University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50462967 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50462967&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145984259 433930232 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51128805 COc1ccc(cc1)-c1ccccc1\C=C1\Cc2cc(OC)ccc2C1=O InChI=1S/C24H20O3/c1-26-20-9-7-16(8-10-20)22-6-4-3-5-17(22)13-19-14-18-15-21(27-2)11-12-23(18)24(19)25/h3-13,15H,14H2,1-2H3/b19-13- XRCNYIUXDHNUNU-UYRXBGFRSA-N 50462971 CHEMBL4244803 Cholinesterase 99 ChEMBL 10.1016/j.bmcl.2018.07.019 10.7270/Q2R21422 30017317 Gabr, MT; Abdel-Raziq, MS Mansoura University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50462971 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50462971&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145982814 433930236 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51128806 COc1ccc2C(=O)\C(Cc2c1)=C/c1ccccc1-c1ccccc1 InChI=1S/C23H18O2/c1-25-20-11-12-22-18(15-20)14-19(23(22)24)13-17-9-5-6-10-21(17)16-7-3-2-4-8-16/h2-13,15H,14H2,1H3/b19-13- YKOCNDOHGCGTRO-UYRXBGFRSA-N 50462967 CHEMBL4243474 Cholinesterase 3310 ChEMBL 10.1016/j.bmcl.2018.07.019 10.7270/Q2R21422 30017317 Gabr, MT; Abdel-Raziq, MS Mansoura University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50462967 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50462967&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145984259 433930232 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51128807 COc1ccc(cc1)-c1ccccc1\C=C1\Cc2cc(OC)ccc2C1=O InChI=1S/C24H20O3/c1-26-20-9-7-16(8-10-20)22-6-4-3-5-17(22)13-19-14-18-15-21(27-2)11-12-23(18)24(19)25/h3-13,15H,14H2,1-2H3/b19-13- XRCNYIUXDHNUNU-UYRXBGFRSA-N 50462971 CHEMBL4244803 Cholinesterase 2150 ChEMBL 10.1016/j.bmcl.2018.07.019 10.7270/Q2R21422 30017317 Gabr, MT; Abdel-Raziq, MS Mansoura University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50462971 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50462971&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145982814 433930236 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51128808 COc1ccc2C(=O)\C(Cc2c1)=C/c1ccccc1-c1ccc2ccccc2c1 InChI=1S/C27H20O2/c1-29-24-12-13-26-22(17-24)16-23(27(26)28)15-20-8-4-5-9-25(20)21-11-10-18-6-2-3-7-19(18)14-21/h2-15,17H,16H2,1H3/b23-15- YPSKYNKEQAAUJV-HAHDFKILSA-N 50462969 CHEMBL4242359 Cholinesterase 3970 ChEMBL 10.1016/j.bmcl.2018.07.019 10.7270/Q2R21422 30017317 Gabr, MT; Abdel-Raziq, MS Mansoura University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50462969 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50462969&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145984734 433930234 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51128809 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 1340 ChEMBL 10.1016/j.bmcl.2018.07.019 10.7270/Q2R21422 30017317 Gabr, MT; Abdel-Raziq, MS Mansoura University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51128811 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 231 ChEMBL 10.1016/j.bmcl.2018.07.019 10.7270/Q2R21422 30017317 Gabr, MT; Abdel-Raziq, MS Mansoura University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50826733 COc1ccc(Cn2cc(CNc3c4CCCCc4nc4ccccc34)nn2)cc1 InChI=1S/C24H25N5O/c1-30-19-12-10-17(11-13-19)15-29-16-18(27-28-29)14-25-24-20-6-2-4-8-22(20)26-23-9-5-3-7-21(23)24/h2,4,6,8,10-13,16H,3,5,7,9,14-15H2,1H3,(H,25,26) PORMFFYKJHDMRT-UHFFFAOYSA-N 50245727 CHEMBL4063321 Cholinesterase 55 ChEMBL 10.1016/j.ejmech.2016.11.008 10.7270/Q25X2CCQ 27863370 Najafi, Z; Mahdavi, M; Saeedi, M; Karimpour-Razkenari, E; Asatouri, R; Vafadarnejad, F; Moghadam, FH; Khanavi, M; Sharifzadeh, M; Akbarzadeh, T Tehran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50245727 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50245727&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137637856 386403569 CHEMBL4063321 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50856196 CN1c2ccccc2C(N2CCOCC2)c2ccccc12 InChI=1S/C18H20N2O/c1-19-16-8-4-2-6-14(16)18(20-10-12-21-13-11-20)15-7-3-5-9-17(15)19/h2-9,18H,10-13H2,1H3 LYLYGAKMNMVFHZ-UHFFFAOYSA-N 50262687 CHEMBL4077169 Cholinesterase 460 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262687 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262687&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137649760 404341242 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50856214 CN1c2ccccc2C(c2ccccc12)n1nnc2ccccc12 InChI=1S/C20H16N4/c1-23-17-11-5-2-8-14(17)20(15-9-3-6-12-18(15)23)24-19-13-7-4-10-16(19)21-22-24/h2-13,20H,1H3 FMPYUZLCKYTCDZ-UHFFFAOYSA-N 50262637 CHEMBL4088659 Cholinesterase 1080 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262637 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262637&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3537759 404341217 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50856225 CN1c2ccccc2C(c2ccccc12)n1cncn1 InChI=1S/C16H14N4/c1-19-14-8-4-2-6-12(14)16(20-11-17-10-18-20)13-7-3-5-9-15(13)19/h2-11,16H,1H3 HAFYMZVHLNXUIY-UHFFFAOYSA-N 50262661 CHEMBL4075825 Cholinesterase 810 ChEMBL 10.1016/j.bmc.2017.09.028 10.7270/Q2FT8PHZ 28986116 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Rudakova, EV; Ustyugov, AA; Bachurin, SO; Shchepochkin, AV; Chupakhin, ON; Charushin, VN; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50262661 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50262661&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137650681 404341238 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51140363 Clc1ccc(nc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1 InChI=1S/C20H24ClN3O/c21-18-6-7-19(23-14-18)20(25)22-11-8-16-9-12-24(13-10-16)15-17-4-2-1-3-5-17/h1-7,14,16H,8-13,15H2,(H,22,25) XVVSLWXSZDRWJO-UHFFFAOYSA-N 50467390 CHEMBL4285331 Cholinesterase 1230 ChEMBL 10.1016/j.ejmech.2018.09.031 10.7270/Q26H4M3Z 30243151 Li, Q; He, S; Chen, Y; Feng, F; Qu, W; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50467390 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50467390&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145993065 433934655 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51140367 COc1cc(\C=C\C(=O)N(CCCC2CCN(Cc3ccccc3)CC2)CC(=O)Nc2c(C)cccc2Cl)ccc1O InChI=1S/C34H40ClN3O4/c1-25-8-6-12-29(35)34(25)36-32(40)24-38(33(41)16-14-27-13-15-30(39)31(22-27)42-2)19-7-11-26-17-20-37(21-18-26)23-28-9-4-3-5-10-28/h3-6,8-10,12-16,22,26,39H,7,11,17-21,23-24H2,1-2H3,(H,36,40)/b16-14+ KDXWEQCJNQHHIW-JQIJEIRASA-N 50467388 CHEMBL4281075 Cholinesterase 52 ChEMBL 10.1016/j.ejmech.2018.09.031 10.7270/Q26H4M3Z 30243151 Li, Q; He, S; Chen, Y; Feng, F; Qu, W; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50467388 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50467388&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145981038 433934653 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51140369 CN(CC#C)Cc1cc2cc(OCCCC3CCN(Cc4ccccc4)CC3)ccc2n1C InChI=1S/C29H37N3O/c1-4-16-30(2)23-27-20-26-21-28(12-13-29(26)31(27)3)33-19-8-11-24-14-17-32(18-15-24)22-25-9-6-5-7-10-25/h1,5-7,9-10,12-13,20-21,24H,8,11,14-19,22-23H2,2-3H3 ADCBAOTWERXLAP-UHFFFAOYSA-N 50359391 CHEMBL1929421 Cholinesterase 460 ChEMBL 10.1016/j.ejmech.2018.09.031 10.7270/Q26H4M3Z 30243151 Li, Q; He, S; Chen, Y; Feng, F; Qu, W; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50359391 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50359391&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53378764 136963415 CHEMBL1929421 ZINC72316998 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51140371 C#CCNc1nc(NCCCC2CCN(Cc3ccccc3)CC2)c(cc1C#N)C#N InChI=1S/C25H28N6/c1-2-12-28-24-22(17-26)16-23(18-27)25(30-24)29-13-6-9-20-10-14-31(15-11-20)19-21-7-4-3-5-8-21/h1,3-5,7-8,16,20H,6,9-15,19H2,(H2,28,29,30) QDTPLCGSZPKZME-UHFFFAOYSA-N 50467389 CHEMBL4295113 Cholinesterase 600 ChEMBL 10.1016/j.ejmech.2018.09.031 10.7270/Q26H4M3Z 30243151 Li, Q; He, S; Chen, Y; Feng, F; Qu, W; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50467389 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50467389&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145994134 433934654 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51140377 Cn1c2ccc(cc2n(C)c1=O)S(=O)(=O)NCC1CCN(Cc2ccc(F)cc2)CC1 InChI=1S/C22H27FN4O3S/c1-25-20-8-7-19(13-21(20)26(2)22(25)28)31(29,30)24-14-16-9-11-27(12-10-16)15-17-3-5-18(23)6-4-17/h3-8,13,16,24H,9-12,14-15H2,1-2H3 PYBJWQWRGHLQAE-UHFFFAOYSA-N 50467391 CHEMBL4281899 Cholinesterase 31 ChEMBL 10.1016/j.ejmech.2018.09.031 10.7270/Q26H4M3Z 30243151 Li, Q; He, S; Chen, Y; Feng, F; Qu, W; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50467391 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50467391&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 39886452 433934656 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51144737 CC(C)(C)c1cc(cc(c1O)C(C)(C)C)C(=O)CNCCC1CCN(Cc2ccccc2)CC1 InChI=1S/C30H44N2O2/c1-29(2,3)25-18-24(19-26(28(25)34)30(4,5)6)27(33)20-31-15-12-22-13-16-32(17-14-22)21-23-10-8-7-9-11-23/h7-11,18-19,22,31,34H,12-17,20-21H2,1-6H3 SRMMNLDVKTUNCR-UHFFFAOYSA-N 50469007 CHEMBL4279488 Cholinesterase 48510 ChEMBL 10.1016/j.ejmech.2018.08.005 10.7270/Q29P34C1 30096650 Cai, P; Fang, SQ; Yang, HL; Yang, XL; Liu, QH; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50469007 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50469007&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145979866 433936272 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51144753 CC(C)(C)c1cc(cc(c1O)C(C)(C)C)C(=O)CNCC1CCN(Cc2ccccc2)CC1 InChI=1S/C29H42N2O2/c1-28(2,3)24-16-23(17-25(27(24)33)29(4,5)6)26(32)19-30-18-21-12-14-31(15-13-21)20-22-10-8-7-9-11-22/h7-11,16-17,21,30,33H,12-15,18-20H2,1-6H3 BAJOYHCPUXVMBH-UHFFFAOYSA-N 50469016 CHEMBL4286736 Cholinesterase 5380 ChEMBL 10.1016/j.ejmech.2018.08.005 10.7270/Q29P34C1 30096650 Cai, P; Fang, SQ; Yang, HL; Yang, XL; Liu, QH; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50469016 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50469016&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145990442 433936281 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51144754 Oc1ccc(\C=C\C(=O)NCCC2CCN(Cc3ccccc3)CC2)cc1 InChI=1S/C23H28N2O2/c26-22-9-6-19(7-10-22)8-11-23(27)24-15-12-20-13-16-25(17-14-20)18-21-4-2-1-3-5-21/h1-11,20,26H,12-18H2,(H,24,27)/b11-8+ UHIDUYIMHIAFLH-DHZHZOJOSA-N 50195836 CHEMBL3819320 Cholinesterase 1260 ChEMBL 10.1016/j.ejmech.2018.08.005 10.7270/Q29P34C1 30096650 Cai, P; Fang, SQ; Yang, HL; Yang, XL; Liu, QH; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50195836 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50195836&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127048716 375977262 CHEMBL3819320 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51144812 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 2480 ChEMBL 10.1016/j.ejmech.2018.08.005 10.7270/Q29P34C1 30096650 Cai, P; Fang, SQ; Yang, HL; Yang, XL; Liu, QH; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51144829 O=C(NCCC1CCN(Cc2ccccc2)CC1)\C=C\c1ccccc1 InChI=1S/C23H28N2O/c26-23(12-11-20-7-3-1-4-8-20)24-16-13-21-14-17-25(18-15-21)19-22-9-5-2-6-10-22/h1-12,21H,13-19H2,(H,24,26)/b12-11+ IPNCANNCIDZOHY-VAWYXSNFSA-N 50469020 CHEMBL3819548 Cholinesterase 390 ChEMBL 10.1016/j.ejmech.2018.08.005 10.7270/Q29P34C1 30096650 Cai, P; Fang, SQ; Yang, HL; Yang, XL; Liu, QH; Kong, LY; Wang, XB China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50469020 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50469020&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14553493 433936285 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51185297 NNc1nncc2ccccc12 InChI=1S/C8H8N4/c9-11-8-7-4-2-1-3-6(7)5-10-12-8/h1-5H,9H2,(H,11,12) RPTUSVTUFVMDQK-UHFFFAOYSA-N 81461 CAS_86-54-4::Hydralazine::Hydralazine (HZN)::NSC_3637 Cholinesterase 1900 ChEMBL 10.1007/s00044-005-0140-0 10.7270/Q2CJ8HD5 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=81461 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=81461&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search HLZ 3LTW 3637 131342035 5775 DB01275 7326 ZINC12360535 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51185298 CC[C@H](C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12 InChI=1S/C24H36O5/c1-5-15(3)24(27)29-21-11-14(2)10-17-7-6-16(4)20(23(17)21)9-8-19-12-18(25)13-22(26)28-19/h6-7,10,14-16,18-21,23,25H,5,8-9,11-13H2,1-4H3/t14-,15-,16-,18+,19+,20-,21-,23-/m0/s1 PCZOHLXUXFIOCF-BXMDZJJMSA-N 34168 LOVASTATIN::MLS000069585::SMR000058779::US9115116, lovastatin::US9353061, Lovastatina::cid_53232 Cholinesterase 1100 ChEMBL 10.1007/s00044-005-0140-0 10.7270/Q2CJ8HD5 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=34168 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=34168&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 803 1CQP,7KC6 53232 252616855 40303 DB00227 2739 C07074 ZINC03812841 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51185304 CC[C@H](C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12 InChI=1S/C24H36O5/c1-5-15(3)24(27)29-21-11-14(2)10-17-7-6-16(4)20(23(17)21)9-8-19-12-18(25)13-22(26)28-19/h6-7,10,14-16,18-21,23,25H,5,8-9,11-13H2,1-4H3/t14-,15-,16-,18+,19+,20-,21-,23-/m0/s1 PCZOHLXUXFIOCF-BXMDZJJMSA-N 34168 LOVASTATIN::MLS000069585::SMR000058779::US9115116, lovastatin::US9353061, Lovastatina::cid_53232 Cholinesterase 1100 ChEMBL 10.1007/s00044-005-0140-0 10.7270/Q2CJ8HD5 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=34168 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=34168&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 803 1CQP,7KC6 53232 252616855 40303 DB00227 2739 C07074 ZINC03812841 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51185305 CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12 InChI=1S/C25H38O5/c1-6-25(4,5)24(28)30-21-12-15(2)11-17-8-7-16(3)20(23(17)21)10-9-19-13-18(26)14-22(27)29-19/h7-8,11,15-16,18-21,23,26H,6,9-10,12-14H2,1-5H3/t15-,16-,18+,19+,20-,21-,23-/m0/s1 RYMZZMVNJRMUDD-HGQWONQESA-N 50139181 (1S,3R,7S,8S,8aR)-8-{2-[(2R,4R)-4-hydroxy-6-oxotetrahydro-2H-pyran-2-yl]ethyl}-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2,2-dimethylbutanoate::2,2-dimethylbutyric acid, 8-ester with (4R,6R)-6-(2-((1S,2S,6R,8S,8aR)-1,2,6,7,8,8a-hexahydro-8-hydroxy-2,6-dimethyl-1-naphthyl)ethyl)tetrahydro-4-hydroxy-2H-pyran-2-one::MK-733::SIMVASTATIN LACTONE::Simvastatin::Zocor::cid_54454 Cholinesterase 750 ChEMBL 10.1007/s00044-005-0140-0 10.7270/Q2CJ8HD5 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50139181 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50139181&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54454 104029076 9150 DB00641 2955 ZINC03780893 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51185306 CNC1=Nc2ccc(Cl)cc2C(c2ccccc2)=[N+]([O-])C1 InChI=1S/C16H14ClN3O/c1-18-15-10-20(21)16(11-5-3-2-4-6-11)13-9-12(17)7-8-14(13)19-15/h2-9H,10H2,1H3,(H,18,19) ANTSCNMPPGJYLG-UHFFFAOYSA-N 50007664 7-chloro-2-methylamino-5-phenyl-3H-1,4-benzodiazepin-4-oxide::7-chloro-N-methyl-5-phenyl-3H-1,4-benzodiazepin-2-amine 4-oxide::CDP::CHEMBL451::CHLORDIAZEPOXIDE::clopoxide::methaminodiazepoxide Cholinesterase 300 ChEMBL 10.1007/s00044-005-0140-0 10.7270/Q2CJ8HD5 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50007664 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50007664&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 2712 103920934 CHEMBL451 ZINC19632917 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51185309 CN1c2ccc(Cl)cc2C(=NCC1=O)c1ccccc1 InChI=1S/C16H13ClN2O/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11/h2-9H,10H2,1H3 AAOVKJBEBIDNHE-UHFFFAOYSA-N 50000766 CHEMBL12::DIAZEPAM::US9271961, Diazepam Cholinesterase 43.0 ChEMBL 10.1007/s00044-005-0140-0 10.7270/Q2CJ8HD5 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50000766 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50000766&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search DZP 6HUP,2BXF,6X3X 3016 103915310 49575 CHEMBL12 DB00829 3364 C06948 ZINC00006427 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51185310 COC(=O)C1=C(C)NC(C)=C(C1c1ccccc1[N+]([O-])=O)C(=O)OC InChI=1S/C17H18N2O6/c1-9-13(16(20)24-3)15(14(10(2)18-9)17(21)25-4)11-7-5-6-8-12(11)19(22)23/h5-8,15,18H,1-4H3 HYIMSNHJOBLJNT-UHFFFAOYSA-N 50101817 Adalat::Adalat Cc::Afeditab Cr::BAY-A-1040::CHEBI:7565::Nifedipine::Procardia::Procardia Xl Cholinesterase 1200 ChEMBL 10.1007/s00044-005-0140-0 10.7270/Q2CJ8HD5 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50101817 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50101817&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 4485 318490909 DB01115 C07266 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51185312 CNC1=Nc2ccc(Cl)cc2C(c2ccccc2)=[N+]([O-])C1 InChI=1S/C16H14ClN3O/c1-18-15-10-20(21)16(11-5-3-2-4-6-11)13-9-12(17)7-8-14(13)19-15/h2-9H,10H2,1H3,(H,18,19) ANTSCNMPPGJYLG-UHFFFAOYSA-N 50007664 7-chloro-2-methylamino-5-phenyl-3H-1,4-benzodiazepin-4-oxide::7-chloro-N-methyl-5-phenyl-3H-1,4-benzodiazepin-2-amine 4-oxide::CDP::CHEMBL451::CHLORDIAZEPOXIDE::clopoxide::methaminodiazepoxide Cholinesterase 300 ChEMBL 10.1007/s00044-005-0140-0 10.7270/Q2CJ8HD5 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50007664 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50007664&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 2712 103920934 CHEMBL451 ZINC19632917 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51185314 COC(=O)C1=C(C)NC(C)=C(C1c1ccccc1[N+]([O-])=O)C(=O)OC InChI=1S/C17H18N2O6/c1-9-13(16(20)24-3)15(14(10(2)18-9)17(21)25-4)11-7-5-6-8-12(11)19(22)23/h5-8,15,18H,1-4H3 HYIMSNHJOBLJNT-UHFFFAOYSA-N 50101817 Adalat::Adalat Cc::Afeditab Cr::BAY-A-1040::CHEBI:7565::Nifedipine::Procardia::Procardia Xl Cholinesterase 1200 ChEMBL 10.1007/s00044-005-0140-0 10.7270/Q2CJ8HD5 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50101817 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50101817&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 4485 318490909 DB01115 C07266 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51185316 CN1c2ccc(Cl)cc2C(=NCC1=O)c1ccccc1 InChI=1S/C16H13ClN2O/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11/h2-9H,10H2,1H3 AAOVKJBEBIDNHE-UHFFFAOYSA-N 50000766 CHEMBL12::DIAZEPAM::US9271961, Diazepam Cholinesterase 43 ChEMBL 10.1007/s00044-005-0140-0 10.7270/Q2CJ8HD5 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50000766 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50000766&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search DZP 6HUP,2BXF,6X3X 3016 103915310 49575 CHEMBL12 DB00829 3364 C06948 ZINC00006427 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51185318 NNc1nncc2ccccc12 InChI=1S/C8H8N4/c9-11-8-7-4-2-1-3-6(7)5-10-12-8/h1-5H,9H2,(H,11,12) RPTUSVTUFVMDQK-UHFFFAOYSA-N 81461 CAS_86-54-4::Hydralazine::Hydralazine (HZN)::NSC_3637 Cholinesterase 1900 ChEMBL 10.1007/s00044-005-0140-0 10.7270/Q2CJ8HD5 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=81461 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=81461&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search HLZ 3LTW 3637 131342035 5775 DB01275 7326 ZINC12360535 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51185319 CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12 InChI=1S/C25H38O5/c1-6-25(4,5)24(28)30-21-12-15(2)11-17-8-7-16(3)20(23(17)21)10-9-19-13-18(26)14-22(27)29-19/h7-8,11,15-16,18-21,23,26H,6,9-10,12-14H2,1-5H3/t15-,16-,18+,19+,20-,21-,23-/m0/s1 RYMZZMVNJRMUDD-HGQWONQESA-N 50139181 (1S,3R,7S,8S,8aR)-8-{2-[(2R,4R)-4-hydroxy-6-oxotetrahydro-2H-pyran-2-yl]ethyl}-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2,2-dimethylbutanoate::2,2-dimethylbutyric acid, 8-ester with (4R,6R)-6-(2-((1S,2S,6R,8S,8aR)-1,2,6,7,8,8a-hexahydro-8-hydroxy-2,6-dimethyl-1-naphthyl)ethyl)tetrahydro-4-hydroxy-2H-pyran-2-one::MK-733::SIMVASTATIN LACTONE::Simvastatin::Zocor::cid_54454 Cholinesterase 750 ChEMBL 10.1007/s00044-005-0140-0 10.7270/Q2CJ8HD5 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50139181 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50139181&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 54454 104029076 9150 DB00641 2955 ZINC03780893 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51187217 CCOP(=S)(OCC)SCc1cccc(CSP(=S)(OCC)OCC)n1 InChI=1S/C15H27NO4P2S4/c1-5-17-21(23,18-6-2)25-12-14-10-9-11-15(16-14)13-26-22(24,19-7-3)20-8-4/h9-11H,5-8,12-13H2,1-4H3 RMYLUVWFLAZSNS-UHFFFAOYSA-N 50488041 CHEMBL2270695 Cholinesterase 56840 ChEMBL 10.1016/j.bioorg.2009.05.002 10.7270/Q22R3VJG 19481235 Kaboudin, B; Emadi, S; Hadizadeh, A Institute for Advanced Studies in Basic Sciences (IASBS) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50488041 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50488041&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76326882 433955306 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51187218 CCOP(=O)(OCC)SCc1ccncc1 InChI=1S/C10H16NO3PS/c1-3-13-15(12,14-4-2)16-9-10-5-7-11-8-6-10/h5-8H,3-4,9H2,1-2H3 YPBUJSPCAGICDV-UHFFFAOYSA-N 50488042 CHEMBL2270702 Cholinesterase 1280 ChEMBL 10.1016/j.bioorg.2009.05.002 10.7270/Q22R3VJG 19481235 Kaboudin, B; Emadi, S; Hadizadeh, A Institute for Advanced Studies in Basic Sciences (IASBS) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50488042 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50488042&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76319702 433955307 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51187219 CCOP(=O)(OCC)SCc1ccc2ccccc2n1 InChI=1S/C14H18NO3PS/c1-3-17-19(16,18-4-2)20-11-13-10-9-12-7-5-6-8-14(12)15-13/h5-10H,3-4,11H2,1-2H3 WSKJULADDGQUJV-UHFFFAOYSA-N 50488043 CHEMBL2270700 Cholinesterase 470 ChEMBL 10.1016/j.bioorg.2009.05.002 10.7270/Q22R3VJG 19481235 Kaboudin, B; Emadi, S; Hadizadeh, A Institute for Advanced Studies in Basic Sciences (IASBS) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50488043 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50488043&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76326883 433955308 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51187220 CCOP(=O)(OCC)SCc1ccccn1 InChI=1S/C10H16NO3PS/c1-3-13-15(12,14-4-2)16-9-10-7-5-6-8-11-10/h5-8H,3-4,9H2,1-2H3 WERMETBCUODLSR-UHFFFAOYSA-N 50488044 CHEMBL2270699 Cholinesterase 740 ChEMBL 10.1016/j.bioorg.2009.05.002 10.7270/Q22R3VJG 19481235 Kaboudin, B; Emadi, S; Hadizadeh, A Institute for Advanced Studies in Basic Sciences (IASBS) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50488044 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50488044&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76323309 433955309 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51187226 CCOP(=S)(OCC)SCc1ccncc1 InChI=1S/C10H16NO2PS2/c1-3-12-14(15,13-4-2)16-9-10-5-7-11-8-6-10/h5-8H,3-4,9H2,1-2H3 NPPOFJFMUPHIHN-UHFFFAOYSA-N 50488046 CHEMBL2270697 Cholinesterase 17820 ChEMBL 10.1016/j.bioorg.2009.05.002 10.7270/Q22R3VJG 19481235 Kaboudin, B; Emadi, S; Hadizadeh, A Institute for Advanced Studies in Basic Sciences (IASBS) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50488046 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50488046&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76334140 433955311 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51187227 CCOP(=S)(OCC)SCCN1C(=O)c2ccccc2C1=O InChI=1S/C14H18NO4PS2/c1-3-18-20(21,19-4-2)22-10-9-15-13(16)11-7-5-6-8-12(11)14(15)17/h5-8H,3-4,9-10H2,1-2H3 JYIPCLKPALTXLQ-UHFFFAOYSA-N 50488048 CHEMBL2270694 Cholinesterase 3370 ChEMBL 10.1016/j.bioorg.2009.05.002 10.7270/Q22R3VJG 19481235 Kaboudin, B; Emadi, S; Hadizadeh, A Institute for Advanced Studies in Basic Sciences (IASBS) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50488048 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50488048&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76308755 433955313 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51187228 CCOP(=S)(OCC)SCc1ccc2ccccc2n1 InChI=1S/C14H18NO2PS2/c1-3-16-18(19,17-4-2)20-11-13-10-9-12-7-5-6-8-14(12)15-13/h5-10H,3-4,11H2,1-2H3 GFZRAVDQCBNJMW-UHFFFAOYSA-N 50488045 CHEMBL2268507 Cholinesterase 12010 ChEMBL 10.1016/j.bioorg.2009.05.002 10.7270/Q22R3VJG 19481235 Kaboudin, B; Emadi, S; Hadizadeh, A Institute for Advanced Studies in Basic Sciences (IASBS) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50488045 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50488045&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76326881 433955310 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51187229 CCOP(=S)(OCC)SCc1ccccn1 InChI=1S/C10H16NO2PS2/c1-3-12-14(15,13-4-2)16-9-10-7-5-6-8-11-10/h5-8H,3-4,9H2,1-2H3 QFUXDLNVRZHSCE-UHFFFAOYSA-N 50488049 CHEMBL2270696 Cholinesterase 16860 ChEMBL 10.1016/j.bioorg.2009.05.002 10.7270/Q22R3VJG 19481235 Kaboudin, B; Emadi, S; Hadizadeh, A Institute for Advanced Studies in Basic Sciences (IASBS) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50488049 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50488049&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76334139 433955314 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51187230 CCOP(=O)(OCC)SCCN1C(=O)c2ccccc2C1=O InChI=1S/C14H18NO5PS/c1-3-19-21(18,20-4-2)22-10-9-15-13(16)11-7-5-6-8-12(11)14(15)17/h5-8H,3-4,9-10H2,1-2H3 OAQMLOVYIRDHFX-UHFFFAOYSA-N 50488047 CHEMBL2270698 Cholinesterase 220 ChEMBL 10.1016/j.bioorg.2009.05.002 10.7270/Q22R3VJG 19481235 Kaboudin, B; Emadi, S; Hadizadeh, A Institute for Advanced Studies in Basic Sciences (IASBS) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50488047 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50488047&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76308756 433955312 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51187231 CCOP(=O)(OCC)SCc1cccc(CSP(=O)(OCC)OCC)n1 InChI=1S/C15H27NO6P2S2/c1-5-19-23(17,20-6-2)25-12-14-10-9-11-15(16-14)13-26-24(18,21-7-3)22-8-4/h9-11H,5-8,12-13H2,1-4H3 REXCURJTWGGHNJ-UHFFFAOYSA-N 50488050 CHEMBL2270701 Cholinesterase 22860 ChEMBL 10.1016/j.bioorg.2009.05.002 10.7270/Q22R3VJG 19481235 Kaboudin, B; Emadi, S; Hadizadeh, A Institute for Advanced Studies in Basic Sciences (IASBS) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50488050 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50488050&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76323310 433955315 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189664 CCOc1ccc(cc1)N(Cc1ccc(C)cc1)C(=O)\C=C\C(=O)N(Cc1ccc(C)cc1)c1ccc(OCC)cc1 InChI=1S/C36H38N2O4/c1-5-41-33-19-15-31(16-20-33)37(25-29-11-7-27(3)8-12-29)35(39)23-24-36(40)38(26-30-13-9-28(4)10-14-30)32-17-21-34(22-18-32)42-6-2/h7-24H,5-6,25-26H2,1-4H3/b24-23+ WEVMEDTWOLADBC-WCWDXBQESA-N 50489064 CHEMBL2296116 Cholinesterase >100000 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489064 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489064&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76309414 433956329 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189665 Cc1ccc(CNc2ccc(I)cc2)cc1 InChI=1S/C14H14IN/c1-11-2-4-12(5-3-11)10-16-14-8-6-13(15)7-9-14/h2-9,16H,10H2,1H3 MYCDMONPQLQBSA-UHFFFAOYSA-N 50489065 CHEMBL2296109 Cholinesterase >100000 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489065 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489065&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 292891 433956330 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189666 CCc1ccc(NCc2ccc(C)cc2)cc1 InChI=1S/C16H19N/c1-3-14-8-10-16(11-9-14)17-12-15-6-4-13(2)5-7-15/h4-11,17H,3,12H2,1-2H3 RANBQUSKDOSQIN-UHFFFAOYSA-N 50489066 CHEMBL2296099 Cholinesterase >100000 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489066 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489066&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 7939482 433956331 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189670 Fc1ccc(cc1)N(Cc1ccccc1)C(=O)\C=C\C(=O)N(Cc1ccccc1)c1ccc(F)cc1 InChI=1S/C30H24F2N2O2/c31-25-11-15-27(16-12-25)33(21-23-7-3-1-4-8-23)29(35)19-20-30(36)34(22-24-9-5-2-6-10-24)28-17-13-26(32)14-18-28/h1-20H,21-22H2/b20-19+ AJUDYRZNTVYIGA-FMQUCBEESA-N 50489070 CHEMBL2295846 Cholinesterase 89500 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489070 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489070&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76320356 433956335 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189671 Cc1ccc(CNc2ccc(F)cc2)cc1 InChI=1S/C14H14FN/c1-11-2-4-12(5-3-11)10-16-14-8-6-13(15)7-9-14/h2-9,16H,10H2,1H3 OCGKEBAELVFTEG-UHFFFAOYSA-N 50489071 CHEMBL2296107 Cholinesterase >100000 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489071 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489071&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 292877 433956336 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189674 CCOc1ccc(cc1)N(Cc1ccccc1)C(=O)\C=C\C(=O)N(Cc1ccccc1)c1ccc(OCC)cc1 InChI=1S/C34H34N2O4/c1-3-39-31-19-15-29(16-20-31)35(25-27-11-7-5-8-12-27)33(37)23-24-34(38)36(26-28-13-9-6-10-14-28)30-17-21-32(22-18-30)40-4-2/h5-24H,3-4,25-26H2,1-2H3/b24-23+ ZWDVATNLINUDEM-WCWDXBQESA-N 50489074 CHEMBL2296117 Cholinesterase 44030 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489074 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489074&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76331215 433956339 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189675 Clc1ccc(NCc2ccccc2)cc1 InChI=1S/C13H12ClN/c14-12-6-8-13(9-7-12)15-10-11-4-2-1-3-5-11/h1-9,15H,10H2 MMEIYVXPSXIGET-UHFFFAOYSA-N 50489075 CHEMBL2296105 Cholinesterase >100000 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489075 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489075&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76281 433956340 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189679 Clc1ccc(cc1)N(Cc1ccccc1)C(=O)\C=C\C(=O)N(Cc1ccccc1)c1ccc(Cl)cc1 InChI=1S/C30H24Cl2N2O2/c31-25-11-15-27(16-12-25)33(21-23-7-3-1-4-8-23)29(35)19-20-30(36)34(22-24-9-5-2-6-10-24)28-17-13-26(32)14-18-28/h1-20H,21-22H2/b20-19+ KWZPMLNYYWTTFK-FMQUCBEESA-N 50489078 CHEMBL2296121 Cholinesterase 57670 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489078 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489078&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76323986 433956343 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189680 COc1ccc(cc1)N(Cc1ccccc1)C(=O)\C=C\C(=O)N(Cc1ccccc1)c1ccc(OC)cc1 InChI=1S/C32H30N2O4/c1-37-29-17-13-27(14-18-29)33(23-25-9-5-3-6-10-25)31(35)21-22-32(36)34(24-26-11-7-4-8-12-26)28-15-19-30(38-2)20-16-28/h3-22H,23-24H2,1-2H3/b22-21+ XWUXKSLUDPRQOL-QURGRASLSA-N 50489079 CHEMBL2296115 Cholinesterase 43600 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489079 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489079&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76309413 433956344 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189681 CCc1ccc(cc1)N(Cc1ccccc1)C(=O)\C=C\C(=O)N(Cc1ccccc1)c1ccc(CC)cc1 InChI=1S/C34H34N2O2/c1-3-27-15-19-31(20-16-27)35(25-29-11-7-5-8-12-29)33(37)23-24-34(38)36(26-30-13-9-6-10-14-30)32-21-17-28(4-2)18-22-32/h5-24H,3-4,25-26H2,1-2H3/b24-23+ SBQJYNQHILHUMK-WCWDXBQESA-N 50489080 CHEMBL2296113 Cholinesterase 49270 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489080 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489080&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76323985 433956345 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189682 CCc1ccc(cc1)N(Cc1ccc(C)cc1)C(=O)\C=C\C(=O)N(Cc1ccc(C)cc1)c1ccc(CC)cc1 InChI=1S/C36H38N2O2/c1-5-29-15-19-33(20-16-29)37(25-31-11-7-27(3)8-12-31)35(39)23-24-36(40)38(26-32-13-9-28(4)10-14-32)34-21-17-30(6-2)18-22-34/h7-24H,5-6,25-26H2,1-4H3/b24-23+ LIGUZSNDQJQROZ-WCWDXBQESA-N 50489081 CHEMBL2296112 Cholinesterase 44730 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489081 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489081&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76331213 433956346 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189683 Fc1ccc(NCc2ccccc2)cc1 InChI=1S/C13H12FN/c14-12-6-8-13(9-7-12)15-10-11-4-2-1-3-5-11/h1-9,15H,10H2 VGUGAUNYDBPMQY-UHFFFAOYSA-N 50489082 CHEMBL2296108 Cholinesterase >100000 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489082 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489082&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 913402 433956347 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189684 Brc1ccc(NCc2ccccc2)cc1 InChI=1S/C13H12BrN/c14-12-6-8-13(9-7-12)15-10-11-4-2-1-3-5-11/h1-9,15H,10H2 AZLKZLKCCRFAAE-UHFFFAOYSA-N 50489069 CHEMBL2296106 Cholinesterase >100000 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489069 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489069&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 961575 433956334 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189685 Cc1ccc(CNc2ccc(Cl)cc2)cc1 InChI=1S/C14H14ClN/c1-11-2-4-12(5-3-11)10-16-14-8-6-13(15)7-9-14/h2-9,16H,10H2,1H3 NEBOTWDYNFJHNQ-UHFFFAOYSA-N 50489083 CHEMBL2296104 Cholinesterase >100000 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489083 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489083&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 292568 433956348 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189686 Cc1ccc(NCc2ccccc2)cc1 InChI=1S/C14H15N/c1-12-7-9-14(10-8-12)15-11-13-5-3-2-4-6-13/h2-10,15H,11H2,1H3 KEVOWRWHMCBERP-UHFFFAOYSA-N 50489072 N-BENZYL-4-METHYLANILINE Cholinesterase >100000 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489072 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489072&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 79403 433956337 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189687 CCOc1ccc(NCc2ccccc2)cc1 InChI=1S/C15H17NO/c1-2-17-15-10-8-14(9-11-15)16-12-13-6-4-3-5-7-13/h3-11,16H,2,12H2,1H3 ZAUVBVZMMZMKSQ-UHFFFAOYSA-N 50489084 CHEMBL2296103 Cholinesterase >100000 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489084 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489084&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 770112 433956349 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189688 COc1ccc(NCc2ccccc2)cc1 InChI=1S/C14H15NO/c1-16-14-9-7-13(8-10-14)15-11-12-5-3-2-4-6-12/h2-10,15H,11H2,1H3 LIJJGMDKVVOEFT-UHFFFAOYSA-N 50489085 N-BENZYL-4-METHOXYANILINE Cholinesterase >100000 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489085 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489085&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 519413 433956350 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189689 COc1ccc(NCc2ccc(C)cc2)cc1 InChI=1S/C15H17NO/c1-12-3-5-13(6-4-12)11-16-14-7-9-15(17-2)10-8-14/h3-10,16H,11H2,1-2H3 LNTCVDXWYBHGBH-UHFFFAOYSA-N 50489062 CHEMBL2296101 Cholinesterase >100000 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489062 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489062&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 292571 433956327 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189705 Ic1ccc(cc1)N(Cc1ccccc1)C(=O)\C=C\C(=O)N(Cc1ccccc1)c1ccc(I)cc1 InChI=1S/C30H24I2N2O2/c31-25-11-15-27(16-12-25)33(21-23-7-3-1-4-8-23)29(35)19-20-30(36)34(22-24-9-5-2-6-10-24)28-17-13-26(32)14-18-28/h1-20H,21-22H2/b20-19+ WXVCUMPESHSJNI-FMQUCBEESA-N 50489086 CHEMBL2296126 Cholinesterase 23270 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489086 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489086&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76323987 433956351 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189706 Cc1ccc(CN(C(=O)\C=C\C(=O)N(Cc2ccc(C)cc2)c2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1 InChI=1S/C32H28Cl2N2O2/c1-23-3-7-25(8-4-23)21-35(29-15-11-27(33)12-16-29)31(37)19-20-32(38)36(30-17-13-28(34)14-18-30)22-26-9-5-24(2)6-10-26/h3-20H,21-22H2,1-2H3/b20-19+ YJDSSOYNXARFJZ-FMQUCBEESA-N 50489091 CHEMBL2296120 Cholinesterase 45600 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489091 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489091&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76334799 433956356 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189707 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 14920 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189708 Cc1ccc(CN(C(=O)\C=C\C(=O)N(Cc2ccc(C)cc2)c2ccc(I)cc2)c2ccc(I)cc2)cc1 InChI=1S/C32H28I2N2O2/c1-23-3-7-25(8-4-23)21-35(29-15-11-27(33)12-16-29)31(37)19-20-32(38)36(30-17-13-28(34)14-18-30)22-26-9-5-24(2)6-10-26/h3-20H,21-22H2,1-2H3/b20-19+ MJWYUXJKKQNHIX-FMQUCBEESA-N 50489092 CHEMBL2296125 Cholinesterase 24630 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489092 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489092&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76327542 433956357 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189709 Cc1ccc(CN(C(=O)\C=C\C(=O)N(Cc2ccc(C)cc2)c2ccc(F)cc2)c2ccc(F)cc2)cc1 InChI=1S/C32H28F2N2O2/c1-23-3-7-25(8-4-23)21-35(29-15-11-27(33)12-16-29)31(37)19-20-32(38)36(30-17-13-28(34)14-18-30)22-26-9-5-24(2)6-10-26/h3-20H,21-22H2,1-2H3/b20-19+ BJFQHAIHDSGOBF-FMQUCBEESA-N 50489087 CHEMBL2296124 Cholinesterase 56570 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489087 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489087&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76309415 433956352 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189710 Cc1ccc(cc1)N(Cc1ccccc1)C(=O)\C=C\C(=O)N(Cc1ccccc1)c1ccc(C)cc1 InChI=1S/C32H30N2O2/c1-25-13-17-29(18-14-25)33(23-27-9-5-3-6-10-27)31(35)21-22-32(36)34(24-28-11-7-4-8-12-28)30-19-15-26(2)16-20-30/h3-22H,23-24H2,1-2H3/b22-21+ QRVVNXVKGNVQBA-QURGRASLSA-N 50489088 CHEMBL2296119 Cholinesterase 26270 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489088 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489088&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76331216 433956353 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189711 Cc1ccc(CN(C(=O)\C=C\C(=O)N(Cc2ccc(C)cc2)c2ccc(C)cc2)c2ccc(C)cc2)cc1 InChI=1S/C34H34N2O2/c1-25-5-13-29(14-6-25)23-35(31-17-9-27(3)10-18-31)33(37)21-22-34(38)36(32-19-11-28(4)12-20-32)24-30-15-7-26(2)8-16-30/h5-22H,23-24H2,1-4H3/b22-21+ XZJXJPNXBUNVQR-QURGRASLSA-N 50489089 CHEMBL2296118 Cholinesterase 54770 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489089 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489089&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76313112 433956354 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189713 COc1ccc(cc1)N(Cc1ccc(C)cc1)C(=O)\C=C\C(=O)N(Cc1ccc(C)cc1)c1ccc(OC)cc1 InChI=1S/C34H34N2O4/c1-25-5-9-27(10-6-25)23-35(29-13-17-31(39-3)18-14-29)33(37)21-22-34(38)36(24-28-11-7-26(2)8-12-28)30-15-19-32(40-4)20-16-30/h5-22H,23-24H2,1-4H3/b22-21+ MOOKXCTYFHTOAR-QURGRASLSA-N 50489068 CHEMBL2296114 Cholinesterase 40970 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489068 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489068&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76331214 433956333 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189714 Ic1ccc(NCc2ccccc2)cc1 InChI=1S/C13H12IN/c14-12-6-8-13(9-7-12)15-10-11-4-2-1-3-5-11/h1-9,15H,10H2 XRLJKIYWSQACLG-UHFFFAOYSA-N 50489090 CHEMBL2296110 Cholinesterase >100000 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489090 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489090&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14944691 433956355 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189715 CCOc1ccc(NCc2ccc(C)cc2)cc1 InChI=1S/C16H19NO/c1-3-18-16-10-8-15(9-11-16)17-12-14-6-4-13(2)5-7-14/h4-11,17H,3,12H2,1-2H3 ZEHGKIJRHQCNPI-UHFFFAOYSA-N 50489063 CHEMBL2296102 Cholinesterase 4070 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489063 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489063&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 770114 433956328 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189716 CCc1ccc(NCc2ccccc2)cc1 InChI=1S/C15H17N/c1-2-13-8-10-15(11-9-13)16-12-14-6-4-3-5-7-14/h3-11,16H,2,12H2,1H3 WKPODACDMVTDPU-UHFFFAOYSA-N 50489093 CHEMBL2296100 Cholinesterase >100000 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489093 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489093&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 7951207 433956358 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189724 Brc1ccc(cc1)N(Cc1ccccc1)C(=O)\C=C\C(=O)N(Cc1ccccc1)c1ccc(Br)cc1 InChI=1S/C30H24Br2N2O2/c31-25-11-15-27(16-12-25)33(21-23-7-3-1-4-8-23)29(35)19-20-30(36)34(22-24-9-5-2-6-10-24)28-17-13-26(32)14-18-28/h1-20H,21-22H2/b20-19+ VJOXWLBJJPCFKK-FMQUCBEESA-N 50489073 CHEMBL2296123 Cholinesterase 16500 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489073 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489073&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73425902 433956338 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189725 C(Nc1ccccc1)c1ccccc1 InChI=1S/C13H13N/c1-3-7-12(8-4-1)11-14-13-9-5-2-6-10-13/h1-10,14H,11H2 GTWJETSWSUWSEJ-UHFFFAOYSA-N 50489077 N-BENZYLANILINE::N-Benzylbenzenamine Cholinesterase >100000 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489077 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489077&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 66028 433956342 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189726 Cc1ccc(CNc2ccc(C)cc2)cc1 InChI=1S/C15H17N/c1-12-3-7-14(8-4-12)11-16-15-9-5-13(2)6-10-15/h3-10,16H,11H2,1-2H3 JEZWNFUVMREVTR-UHFFFAOYSA-N 50489095 CHEMBL493222 Cholinesterase >100000 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489095 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489095&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 292573 433956360 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189727 O=C(\C=C\C(=O)N(Cc1ccccc1)c1ccccc1)N(Cc1ccccc1)c1ccccc1 InChI=1S/C30H26N2O2/c33-29(31(27-17-9-3-10-18-27)23-25-13-5-1-6-14-25)21-22-30(34)32(28-19-11-4-12-20-28)24-26-15-7-2-8-16-26/h1-22H,23-24H2/b22-21+ KGVFWOOVIZYTMI-QURGRASLSA-N 50489094 CHEMBL2296111 Cholinesterase 52370 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489094 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489094&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 76313111 433956359 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189728 Cc1ccc(CN(C(=O)\C=C\C(=O)N(Cc2ccc(C)cc2)c2ccc(Br)cc2)c2ccc(Br)cc2)cc1 InChI=1S/C32H28Br2N2O2/c1-23-3-7-25(8-4-23)21-35(29-15-11-27(33)12-16-29)31(37)19-20-32(38)36(30-17-13-28(34)14-18-30)22-26-9-5-24(2)6-10-26/h3-20H,21-22H2,1-2H3/b20-19+ PLDWFLABSYARTP-FMQUCBEESA-N 50489067 CHEMBL2296122 Cholinesterase 23100 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489067 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489067&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73425901 433956332 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51189729 Cc1ccc(CNc2ccc(Br)cc2)cc1 InChI=1S/C14H14BrN/c1-11-2-4-12(5-3-11)10-16-14-8-6-13(15)7-9-14/h2-9,16H,10H2,1H3 WJKFEXKYOWOJPT-UHFFFAOYSA-N 50489076 CHEMBL1993147 Cholinesterase >100000 ChEMBL 10.1007/s00044-013-0493-8 10.7270/Q20K2CG2 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50489076 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50489076&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 292569 433956341 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211544 COc1cccc(NC(=O)Oc2ccc3N(C)C4=NCCCN4C(=O)c3c2)c1 InChI=1S/C20H20N4O4/c1-23-17-8-7-15(12-16(17)18(25)24-10-4-9-21-19(23)24)28-20(26)22-13-5-3-6-14(11-13)27-2/h3,5-8,11-12H,4,9-10H2,1-2H3,(H,22,26) XGVQBQUDJBASND-UHFFFAOYSA-N 50497899 CHEMBL3323389 Cholinesterase 52220 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497899 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497899&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 101903039 433965164 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211546 CC(C)c1ccc(NC(=O)Oc2ccc3nc4N(C)CCCn4c(=O)c3c2)cc1 InChI=1S/C22H24N4O3/c1-14(2)15-5-7-16(8-6-15)23-22(28)29-17-9-10-19-18(13-17)20(27)26-12-4-11-25(3)21(26)24-19/h5-10,13-14H,4,11-12H2,1-3H3,(H,23,28) XPYXFLHXHUPWDC-UHFFFAOYSA-N 50497901 CHEMBL3323376 Cholinesterase 17700 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497901 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497901&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710736 433965166 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211547 CCCCNC(=O)Oc1ccc2N=C3N(C)CCCN3Cc2c1 InChI=1S/C17H24N4O2/c1-3-4-8-18-17(22)23-14-6-7-15-13(11-14)12-21-10-5-9-20(2)16(21)19-15/h6-7,11H,3-5,8-10,12H2,1-2H3,(H,18,22) SYONFHJXDJMXOQ-UHFFFAOYSA-N 50497902 CHEMBL3323394 Cholinesterase 1340 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497902 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497902&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710747 433965167 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211548 O=c1n2CCCN(CCCN3CCCCC3)c2nc2ccc(OCc3ccccc3)cc12 InChI=1S/C26H32N4O2/c31-25-23-19-22(32-20-21-9-3-1-4-10-21)11-12-24(23)27-26-29(17-8-18-30(25)26)16-7-15-28-13-5-2-6-14-28/h1,3-4,9-12,19H,2,5-8,13-18,20H2 KONKWDVSMVGCDB-UHFFFAOYSA-N 50497903 CHEMBL3323369 Cholinesterase 813 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497903 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497903&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710729 433965168 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211552 Oc1ccc2nc3N(CCCN4CCCCC4)CCCn3c(=O)c2c1 InChI=1S/C19H26N4O2/c24-15-6-7-17-16(14-15)18(25)23-13-5-12-22(19(23)20-17)11-4-10-21-8-2-1-3-9-21/h6-7,14,24H,1-5,8-13H2 JJIZWEOYBMMOFI-UHFFFAOYSA-N 50497906 CHEMBL3323372 Cholinesterase 22909 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497906 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497906&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710732 433965171 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211556 CN1C2=NCCCN2C(=O)c2cc(O)ccc12 InChI=1S/C12H13N3O2/c1-14-10-4-3-8(16)7-9(10)11(17)15-6-2-5-13-12(14)15/h3-4,7,16H,2,5-6H2,1H3 WVCUFSLRUAOKQS-UHFFFAOYSA-N 50497910 CHEMBL3323386 Cholinesterase 55530 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497910 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497910&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710743 433965175 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211559 CC(C)c1ccc(NC(=O)Oc2ccc3nc4N(CCCN5CCCCC5)CCCn4c(=O)c3c2)cc1 InChI=1S/C29H37N5O3/c1-21(2)22-8-10-23(11-9-22)30-29(36)37-24-12-13-26-25(20-24)27(35)34-19-7-18-33(28(34)31-26)17-6-16-32-14-4-3-5-15-32/h8-13,20-21H,3-7,14-19H2,1-2H3,(H,30,36) CFFQXSKNVOXHTG-UHFFFAOYSA-N 50497911 CHEMBL3323384 Cholinesterase 245 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497911 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497911&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 101903035 433965176 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211561 CN1CCCn2c1nc1ccc(OCc3ccccc3)cc1c2=O InChI=1S/C19H19N3O2/c1-21-10-5-11-22-18(23)16-12-15(8-9-17(16)20-19(21)22)24-13-14-6-3-2-4-7-14/h2-4,6-9,12H,5,10-11,13H2,1H3 CSFLHVJDZJVTBH-UHFFFAOYSA-N 50497909 CHEMBL3323367 Cholinesterase 81283 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497909 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497909&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710727 433965174 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211585 CN1CCCn2c1nc1ccc(OCc3ccccc3)cc1c2=O InChI=1S/C19H19N3O2/c1-21-10-5-11-22-18(23)16-12-15(8-9-17(16)20-19(21)22)24-13-14-6-3-2-4-7-14/h2-4,6-9,12H,5,10-11,13H2,1H3 CSFLHVJDZJVTBH-UHFFFAOYSA-N 50497909 CHEMBL3323367 Cholinesterase 81720 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497909 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497909&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710727 433965174 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211586 O=c1n2CCCN(CCCN3CCCCC3)c2nc2ccc(OCc3ccccc3)cc12 InChI=1S/C26H32N4O2/c31-25-23-19-22(32-20-21-9-3-1-4-10-21)11-12-24(23)27-26-29(17-8-18-30(25)26)16-7-15-28-13-5-2-6-14-28/h1,3-4,9-12,19H,2,5-8,13-18,20H2 KONKWDVSMVGCDB-UHFFFAOYSA-N 50497903 CHEMBL3323369 Cholinesterase 810 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497903 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497903&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710729 433965168 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211587 COc1cccc(NC(=O)Oc2ccc3nc4N(C)CCCn4c(=O)c3c2)c1 InChI=1S/C20H20N4O4/c1-23-9-4-10-24-18(25)16-12-15(7-8-17(16)22-19(23)24)28-20(26)21-13-5-3-6-14(11-13)27-2/h3,5-8,11-12H,4,9-10H2,1-2H3,(H,21,26) YPDYTVZLHYCEPD-UHFFFAOYSA-N 50497913 CHEMBL3323375 Cholinesterase 12640 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497913 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497913&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710735 433965178 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211588 CCCCCCCNC(=O)Oc1ccc2nc3N(Cc4ccccc4)CCCn3c(=O)c2c1 InChI=1S/C26H32N4O3/c1-2-3-4-5-9-15-27-26(32)33-21-13-14-23-22(18-21)24(31)30-17-10-16-29(25(30)28-23)19-20-11-7-6-8-12-20/h6-8,11-14,18H,2-5,9-10,15-17,19H2,1H3,(H,27,32) ULAYCSDZXUIYAF-UHFFFAOYSA-N 50497914 CHEMBL3323378 Cholinesterase 25310 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497914 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497914&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710738 433965179 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211589 COc1cccc(NC(=O)Oc2ccc3nc4N(CCCN5CCCCC5)CCCn4c(=O)c3c2)c1 InChI=1S/C27H33N5O4/c1-35-21-9-5-8-20(18-21)28-27(34)36-22-10-11-24-23(19-22)25(33)32-17-7-16-31(26(32)29-24)15-6-14-30-12-3-2-4-13-30/h5,8-11,18-19H,2-4,6-7,12-17H2,1H3,(H,28,34) NMDKFSXTBSEUJX-UHFFFAOYSA-N 50497907 CHEMBL3323383 Cholinesterase 450 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497907 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497907&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 101903034 433965172 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211590 CC(C)c1ccc(NC(=O)Oc2ccc3nc4N(CCCN5CCCCC5)CCCn4c(=O)c3c2)cc1 InChI=1S/C29H37N5O3/c1-21(2)22-8-10-23(11-9-22)30-29(36)37-24-12-13-26-25(20-24)27(35)34-19-7-18-33(28(34)31-26)17-6-16-32-14-4-3-5-15-32/h8-13,20-21H,3-7,14-19H2,1-2H3,(H,30,36) CFFQXSKNVOXHTG-UHFFFAOYSA-N 50497911 CHEMBL3323384 Cholinesterase 250 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497911 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497911&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 101903035 433965176 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211591 CCCCNC(=O)Oc1ccc2N(C)C3=NCCCN3C(=O)c2c1 InChI=1S/C17H22N4O3/c1-3-4-8-19-17(23)24-12-6-7-14-13(11-12)15(22)21-10-5-9-18-16(21)20(14)2/h6-7,11H,3-5,8-10H2,1-2H3,(H,19,23) ZKNIQABVXKHRSF-UHFFFAOYSA-N 50497900 CHEMBL3323387 Cholinesterase 43910 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497900 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497900&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710744 433965165 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211592 CN1CCCN2Cc3cc(OCc4ccccc4)ccc3N=C12 InChI=1S/C19H21N3O/c1-21-10-5-11-22-13-16-12-17(8-9-18(16)20-19(21)22)23-14-15-6-3-2-4-7-15/h2-4,6-9,12H,5,10-11,13-14H2,1H3 QXURMWHUVFTMOU-UHFFFAOYSA-N 50497923 CHEMBL3323392 Cholinesterase 4172 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497923 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497923&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710745 433965188 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211593 CCCCCCCNC(=O)Oc1ccc2N=C3N(C)CCCN3Cc2c1 InChI=1S/C20H30N4O2/c1-3-4-5-6-7-11-21-20(25)26-17-9-10-18-16(14-17)15-24-13-8-12-23(2)19(24)22-18/h9-10,14H,3-8,11-13,15H2,1-2H3,(H,21,25) QPNRBRHJXWGYRU-UHFFFAOYSA-N 50497919 CHEMBL3323395 Cholinesterase 630 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497919 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497919&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710748 433965184 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211594 CCCCCCCNC(=O)Oc1ccc2nc3N(C)CCCn3c(=O)c2c1 InChI=1S/C20H28N4O3/c1-3-4-5-6-7-11-21-20(26)27-15-9-10-17-16(14-15)18(25)24-13-8-12-23(2)19(24)22-17/h9-10,14H,3-8,11-13H2,1-2H3,(H,21,26) KTFMUWDMOOIEGY-UHFFFAOYSA-N 50497921 CHEMBL3323374 Cholinesterase 1750 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497921 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497921&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710734 433965186 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211595 COc1cccc(NC(=O)Oc2ccc3nc4N(C)CCCn4c(=O)c3c2)c1 InChI=1S/C20H20N4O4/c1-23-9-4-10-24-18(25)16-12-15(7-8-17(16)22-19(23)24)28-20(26)21-13-5-3-6-14(11-13)27-2/h3,5-8,11-12H,4,9-10H2,1-2H3,(H,21,26) YPDYTVZLHYCEPD-UHFFFAOYSA-N 50497913 CHEMBL3323375 Cholinesterase 12647 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497913 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497913&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710735 433965178 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211596 CC(C)c1ccc(NC(=O)Oc2ccc3nc4N(C)CCCn4c(=O)c3c2)cc1 InChI=1S/C22H24N4O3/c1-14(2)15-5-7-16(8-6-15)23-22(28)29-17-9-10-19-18(13-17)20(27)26-12-4-11-25(3)21(26)24-19/h5-10,13-14H,4,11-12H2,1-3H3,(H,23,28) XPYXFLHXHUPWDC-UHFFFAOYSA-N 50497901 CHEMBL3323376 Cholinesterase 17783 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497901 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497901&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710736 433965166 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211597 CCCCNC(=O)Oc1ccc2nc3N(CCCN4CCCCC4)CCCn3c(=O)c2c1 InChI=1S/C24H35N5O3/c1-2-3-11-25-24(31)32-19-9-10-21-20(18-19)22(30)29-17-8-16-28(23(29)26-21)15-7-14-27-12-5-4-6-13-27/h9-10,18H,2-8,11-17H2,1H3,(H,25,31) SNKRAFDRMZTISF-UHFFFAOYSA-N 50497915 CHEMBL3323381 Cholinesterase 1072 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497915 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497915&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710741 433965180 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211598 CCCCCCCNC(=O)Oc1ccc2nc3N(CCCN4CCCCC4)CCCn3c(=O)c2c1 InChI=1S/C27H41N5O3/c1-2-3-4-5-7-14-28-27(34)35-22-12-13-24-23(21-22)25(33)32-20-11-19-31(26(32)29-24)18-10-17-30-15-8-6-9-16-30/h12-13,21H,2-11,14-20H2,1H3,(H,28,34) VTZMXRQFIWAQNE-UHFFFAOYSA-N 50497922 CHEMBL3323382 Cholinesterase 25 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497922 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497922&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 101903036 433965187 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211599 COc1cccc(NC(=O)Oc2ccc3nc4N(CCCN5CCCCC5)CCCn4c(=O)c3c2)c1 InChI=1S/C27H33N5O4/c1-35-21-9-5-8-20(18-21)28-27(34)36-22-10-11-24-23(19-22)25(33)32-17-7-16-31(26(32)29-24)15-6-14-30-12-3-2-4-13-30/h5,8-11,18-19H,2-4,6-7,12-17H2,1H3,(H,28,34) NMDKFSXTBSEUJX-UHFFFAOYSA-N 50497907 CHEMBL3323383 Cholinesterase 450 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497907 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497907&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 101903034 433965172 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211600 CCCCNC(=O)Oc1ccc2N(C)C3=NCCCN3C(=O)c2c1 InChI=1S/C17H22N4O3/c1-3-4-8-19-17(23)24-12-6-7-14-13(11-12)15(22)21-10-5-9-18-16(21)20(14)2/h6-7,11H,3-5,8-10H2,1-2H3,(H,19,23) ZKNIQABVXKHRSF-UHFFFAOYSA-N 50497900 CHEMBL3323387 Cholinesterase 43652 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497900 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497900&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710744 433965165 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211601 COc1cccc(NC(=O)Oc2ccc3N(C)C4=NCCCN4C(=O)c3c2)c1 InChI=1S/C20H20N4O4/c1-23-17-8-7-15(12-16(17)18(25)24-10-4-9-21-19(23)24)28-20(26)22-13-5-3-6-14(11-13)27-2/h3,5-8,11-12H,4,9-10H2,1-2H3,(H,22,26) XGVQBQUDJBASND-UHFFFAOYSA-N 50497899 CHEMBL3323389 Cholinesterase 52481 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497899 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497899&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 101903039 433965164 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211602 CN1CCCN2Cc3cc(OCc4ccccc4)ccc3N=C12 InChI=1S/C19H21N3O/c1-21-10-5-11-22-13-16-12-17(8-9-18(16)20-19(21)22)23-14-15-6-3-2-4-7-15/h2-4,6-9,12H,5,10-11,13-14H2,1H3 QXURMWHUVFTMOU-UHFFFAOYSA-N 50497923 CHEMBL3323392 Cholinesterase 4169 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497923 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497923&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710745 433965188 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211603 CCCCCCCNC(=O)Oc1ccc2N=C3N(C)CCCN3Cc2c1 InChI=1S/C20H30N4O2/c1-3-4-5-6-7-11-21-20(25)26-17-9-10-18-16(14-17)15-24-13-8-12-23(2)19(24)22-18/h9-10,14H,3-8,11-13,15H2,1-2H3,(H,21,25) QPNRBRHJXWGYRU-UHFFFAOYSA-N 50497919 CHEMBL3323395 Cholinesterase 631 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497919 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497919&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710748 433965184 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211613 CNC(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1 InChI=1S/C15H21N3O2/c1-15-7-8-17(3)13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2/h5-6,9,13H,7-8H2,1-4H3,(H,16,19)/t13-,15+/m1/s1 PIJVFDBKTWXHHD-HIFRSBDPSA-N 50004000 (3aS,8aR)-1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol-5-yl methylcarbamate::Antilirium::CHEMBL94::Eserine::Physostol::physostigmine Cholinesterase 40 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50004000 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50004000&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5983 103917788 27953 CHEMBL94 DB00981 6598 C06535 ZINC33971762 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211614 Oc1ccc2nc3N(CCCN4CCCCC4)CCCn3c(=O)c2c1 InChI=1S/C19H26N4O2/c24-15-6-7-17-16(14-15)18(25)23-13-5-12-22(19(23)20-17)11-4-10-21-8-2-1-3-9-21/h6-7,14,24H,1-5,8-13H2 JJIZWEOYBMMOFI-UHFFFAOYSA-N 50497906 CHEMBL3323372 Cholinesterase 22720 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497906 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497906&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710732 433965171 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211615 CCCCNC(=O)Oc1ccc2nc3N(CCCN4CCCCC4)CCCn3c(=O)c2c1 InChI=1S/C24H35N5O3/c1-2-3-11-25-24(31)32-19-9-10-21-20(18-19)22(30)29-17-8-16-28(23(29)26-21)15-7-14-27-12-5-4-6-13-27/h9-10,18H,2-8,11-17H2,1H3,(H,25,31) SNKRAFDRMZTISF-UHFFFAOYSA-N 50497915 CHEMBL3323381 Cholinesterase 1100 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497915 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497915&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710741 433965180 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211616 CC(C)c1ccc(NC(=O)Oc2ccc3N(C)C4=NCCCN4C(=O)c3c2)cc1 InChI=1S/C22H24N4O3/c1-14(2)15-5-7-16(8-6-15)24-22(28)29-17-9-10-19-18(13-17)20(27)26-12-4-11-23-21(26)25(19)3/h5-10,13-14H,4,11-12H2,1-3H3,(H,24,28) GQKSVFIRHIIXHW-UHFFFAOYSA-N 50497918 CHEMBL3323390 Cholinesterase 3260 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497918 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497918&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 101903040 433965183 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211617 CCCCNC(=O)Oc1ccc2nc3N(C)CCCn3c(=O)c2c1 InChI=1S/C17H22N4O3/c1-3-4-8-18-17(23)24-12-6-7-14-13(11-12)15(22)21-10-5-9-20(2)16(21)19-14/h6-7,11H,3-5,8-10H2,1-2H3,(H,18,23) XKYMEYUPFFNUPW-UHFFFAOYSA-N 50497905 CHEMBL3323373 Cholinesterase 44361 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497905 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497905&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710733 433965170 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211618 CN1C2=NCCCN2C(=O)c2cc(O)ccc12 InChI=1S/C12H13N3O2/c1-14-10-4-3-8(16)7-9(10)11(17)15-6-2-5-13-12(14)15/h3-4,7,16H,2,5-6H2,1H3 WVCUFSLRUAOKQS-UHFFFAOYSA-N 50497910 CHEMBL3323386 Cholinesterase 54954 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497910 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497910&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710743 433965175 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211619 CC(C)c1ccc(NC(=O)Oc2ccc3N(C)C4=NCCCN4C(=O)c3c2)cc1 InChI=1S/C22H24N4O3/c1-14(2)15-5-7-16(8-6-15)24-22(28)29-17-9-10-19-18(13-17)20(27)26-12-4-11-23-21(26)25(19)3/h5-10,13-14H,4,11-12H2,1-3H3,(H,24,28) GQKSVFIRHIIXHW-UHFFFAOYSA-N 50497918 CHEMBL3323390 Cholinesterase 3236 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497918 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497918&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 101903040 433965183 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211624 CCCCCCCNC(=O)Oc1ccc2nc3N(CCCN4CCCCC4)CCCn3c(=O)c2c1 InChI=1S/C27H41N5O3/c1-2-3-4-5-7-14-28-27(34)35-22-12-13-24-23(21-22)25(33)32-20-11-19-31(26(32)29-24)18-10-17-30-15-8-6-9-16-30/h12-13,21H,2-11,14-20H2,1H3,(H,28,34) VTZMXRQFIWAQNE-UHFFFAOYSA-N 50497922 CHEMBL3323382 Cholinesterase 25 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497922 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497922&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 101903036 433965187 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211625 CN1C2=NCCCN2C(=O)c2cc(OCc3ccccc3)ccc12 InChI=1S/C19H19N3O2/c1-21-17-9-8-15(24-13-14-6-3-2-4-7-14)12-16(17)18(23)22-11-5-10-20-19(21)22/h2-4,6-9,12H,5,10-11,13H2,1H3 HNMPUPYMXKWLFH-UHFFFAOYSA-N 50497916 CHEMBL3323385 Cholinesterase 21380 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497916 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497916&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710742 433965181 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211627 CCCCCCCNC(=O)Oc1ccc2N(C)C3=NCCCN3C(=O)c2c1 InChI=1S/C20H28N4O3/c1-3-4-5-6-7-11-22-20(26)27-15-9-10-17-16(14-15)18(25)24-13-8-12-21-19(24)23(17)2/h9-10,14H,3-8,11-13H2,1-2H3,(H,22,26) RMZRMSKMLCFSBA-UHFFFAOYSA-N 50497917 CHEMBL3323388 Cholinesterase 140 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497917 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497917&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 101903037 433965182 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211628 CN1C2=NCCCN2C(=O)c2cc(OCc3ccccc3)ccc12 InChI=1S/C19H19N3O2/c1-21-17-9-8-15(24-13-14-6-3-2-4-7-14)12-16(17)18(23)22-11-5-10-20-19(21)22/h2-4,6-9,12H,5,10-11,13H2,1H3 HNMPUPYMXKWLFH-UHFFFAOYSA-N 50497916 CHEMBL3323385 Cholinesterase 21400 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497916 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497916&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710742 433965181 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211629 CCCCCCCNC(=O)Oc1ccc2nc3N(C)CCCn3c(=O)c2c1 InChI=1S/C20H28N4O3/c1-3-4-5-6-7-11-21-20(26)27-15-9-10-17-16(14-15)18(25)24-13-8-12-23(2)19(24)22-17/h9-10,14H,3-8,11-13H2,1-2H3,(H,21,26) KTFMUWDMOOIEGY-UHFFFAOYSA-N 50497921 CHEMBL3323374 Cholinesterase 1750 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497921 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497921&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710734 433965186 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211633 CCCCNC(=O)Oc1ccc2nc3N(C)CCCn3c(=O)c2c1 InChI=1S/C17H22N4O3/c1-3-4-8-18-17(23)24-12-6-7-14-13(11-12)15(22)21-10-5-9-20(2)16(21)19-14/h6-7,11H,3-5,8-10H2,1-2H3,(H,18,23) XKYMEYUPFFNUPW-UHFFFAOYSA-N 50497905 CHEMBL3323373 Cholinesterase 44320 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497905 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497905&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710733 433965170 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211634 CCCCCCCNC(=O)Oc1ccc2N(C)C3=NCCCN3C(=O)c2c1 InChI=1S/C20H28N4O3/c1-3-4-5-6-7-11-22-20(26)27-15-9-10-17-16(14-15)18(25)24-13-8-12-21-19(24)23(17)2/h9-10,14H,3-8,11-13H2,1-2H3,(H,22,26) RMZRMSKMLCFSBA-UHFFFAOYSA-N 50497917 CHEMBL3323388 Cholinesterase 141 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497917 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497917&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 101903037 433965182 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211636 CCCCCCCNC(=O)Oc1ccc2nc3N(Cc4ccccc4)CCCn3c(=O)c2c1 InChI=1S/C26H32N4O3/c1-2-3-4-5-9-15-27-26(32)33-21-13-14-23-22(18-21)24(31)30-17-10-16-29(25(30)28-23)19-20-11-7-6-8-12-20/h6-8,11-14,18H,2-5,9-10,15-17,19H2,1H3,(H,27,32) ULAYCSDZXUIYAF-UHFFFAOYSA-N 50497914 CHEMBL3323378 Cholinesterase 25293 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497914 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497914&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710738 433965179 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51211637 CCCCNC(=O)Oc1ccc2N=C3N(C)CCCN3Cc2c1 InChI=1S/C17H24N4O2/c1-3-4-8-18-17(22)23-14-6-7-15-13(11-14)12-21-10-5-9-20(2)16(21)19-15/h6-7,11H,3-5,8-10,12H2,1-2H3,(H,18,22) SYONFHJXDJMXOQ-UHFFFAOYSA-N 50497902 CHEMBL3323394 Cholinesterase 1340 ChEMBL 10.1016/j.bmc.2014.06.010 10.7270/Q2V98C3D 25059502 Darras, FH; Kling, B; Sawatzky, E; Heilmann, J; Decker, M Universit£t Regensburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50497902 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50497902&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710747 433965167 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218477 CCN(Cc1cccc2[nH]c3ccccc3c12)C(=O)\C=C\c1ccc(O)c(OC)c1 InChI=1S/C25H24N2O3/c1-3-27(24(29)14-12-17-11-13-22(28)23(15-17)30-2)16-18-7-6-10-21-25(18)19-8-4-5-9-20(19)26-21/h4-15,26,28H,3,16H2,1-2H3/b14-12+ HPBZEEKTQBBMJC-WYMLVPIESA-N 50500685 CHEMBL3754419 Cholinesterase 13800 ChEMBL 10.1016/j.bmc.2016.01.010 10.7270/Q23R0WWJ 26795115 Fang, L; Chen, M; Liu, Z; Fang, X; Gou, S; Chen, L Southeast University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500685 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500685&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127028242 433912586 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218481 COc1cc(\C=C\C(=O)N(Cc2cccc3[nH]c4ccccc4c23)C2CCCC2)ccc1O InChI=1S/C28H28N2O3/c1-33-26-17-19(13-15-25(26)31)14-16-27(32)30(21-8-2-3-9-21)18-20-7-6-12-24-28(20)22-10-4-5-11-23(22)29-24/h4-7,10-17,21,29,31H,2-3,8-9,18H2,1H3/b16-14+ QTJOYFVGNGDFFB-JQIJEIRASA-N 50500689 CHEMBL3752517 Cholinesterase 31600 ChEMBL 10.1016/j.bmc.2016.01.010 10.7270/Q23R0WWJ 26795115 Fang, L; Chen, M; Liu, Z; Fang, X; Gou, S; Chen, L Southeast University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500689 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500689&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127028243 433912590 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218486 CCN(Cc1cccc2[nH]c3cc(Cl)ccc3c12)C(=O)\C=C\c1ccc(O)c(OC)c1 InChI=1S/C25H23ClN2O3/c1-3-28(24(30)12-8-16-7-11-22(29)23(13-16)31-2)15-17-5-4-6-20-25(17)19-10-9-18(26)14-21(19)27-20/h4-14,27,29H,3,15H2,1-2H3/b12-8+ YVAXITGHSDJYIT-XYOKQWHBSA-N 50500691 CHEMBL3754448 Cholinesterase 3100 ChEMBL 10.1016/j.bmc.2016.01.010 10.7270/Q23R0WWJ 26795115 Fang, L; Chen, M; Liu, Z; Fang, X; Gou, S; Chen, L Southeast University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500691 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500691&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127025129 433912592 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218487 COc1cc(\C=C\C(=O)N(Cc2cccc3[nH]c4ccccc4c23)C2CCCCC2)ccc1O InChI=1S/C29H30N2O3/c1-34-27-18-20(14-16-26(27)32)15-17-28(33)31(22-9-3-2-4-10-22)19-21-8-7-13-25-29(21)23-11-5-6-12-24(23)30-25/h5-8,11-18,22,30,32H,2-4,9-10,19H2,1H3/b17-15+ GOLZVUVDEQIUEA-BMRADRMJSA-N 50500692 CHEMBL3754652 Cholinesterase 22000 ChEMBL 10.1016/j.bmc.2016.01.010 10.7270/Q23R0WWJ 26795115 Fang, L; Chen, M; Liu, Z; Fang, X; Gou, S; Chen, L Southeast University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500692 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500692&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127028244 433912593 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218495 COc1ccc2c(c1)[nH]c1cccc(CN(C(C)C)C(=O)\C=C\c3ccc(O)c(OC)c3)c21 InChI=1S/C27H28N2O4/c1-17(2)29(26(31)13-9-18-8-12-24(30)25(14-18)33-4)16-19-6-5-7-22-27(19)21-11-10-20(32-3)15-23(21)28-22/h5-15,17,28,30H,16H2,1-4H3/b13-9+ HNNVVYKBVGZLAU-UKTHLTGXSA-N 50500695 CHEMBL3752518 Cholinesterase 13900 ChEMBL 10.1016/j.bmc.2016.01.010 10.7270/Q23R0WWJ 26795115 Fang, L; Chen, M; Liu, Z; Fang, X; Gou, S; Chen, L Southeast University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500695 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500695&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127036991 433912596 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218496 COc1cc(\C=C\C(=O)N(Cc2cccc3[nH]c4ccccc4c23)C(C)C)ccc1O InChI=1S/C26H26N2O3/c1-17(2)28(25(30)14-12-18-11-13-23(29)24(15-18)31-3)16-19-7-6-10-22-26(19)20-8-4-5-9-21(20)27-22/h4-15,17,27,29H,16H2,1-3H3/b14-12+ CBEQHARBUNEXIY-WYMLVPIESA-N 50500688 CHEMBL3754631 Cholinesterase 12700 ChEMBL 10.1016/j.bmc.2016.01.010 10.7270/Q23R0WWJ 26795115 Fang, L; Chen, M; Liu, Z; Fang, X; Gou, S; Chen, L Southeast University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500688 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500688&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127028241 433912589 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218501 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 28100 ChEMBL 10.1016/j.bmc.2016.01.010 10.7270/Q23R0WWJ 26795115 Fang, L; Chen, M; Liu, Z; Fang, X; Gou, S; Chen, L Southeast University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218503 CCN(Cc1cccc2[nH]c3cc(OC)ccc3c12)C(=O)\C=C\c1ccc(O)c(OC)c1 InChI=1S/C26H26N2O4/c1-4-28(25(30)13-9-17-8-12-23(29)24(14-17)32-3)16-18-6-5-7-21-26(18)20-11-10-19(31-2)15-22(20)27-21/h5-15,27,29H,4,16H2,1-3H3/b13-9+ UHESTEZGCGWYTJ-UKTHLTGXSA-N 50500687 CHEMBL3754289 Cholinesterase 19800 ChEMBL 10.1016/j.bmc.2016.01.010 10.7270/Q23R0WWJ 26795115 Fang, L; Chen, M; Liu, Z; Fang, X; Gou, S; Chen, L Southeast University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500687 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500687&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127036992 433912588 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218504 CCNCc1cccc2[nH]c3cc(Cl)ccc3c12 InChI=1S/C15H15ClN2/c1-2-17-9-10-4-3-5-13-15(10)12-7-6-11(16)8-14(12)18-13/h3-8,17-18H,2,9H2,1H3 PLIFLXOUJPNJNC-UHFFFAOYSA-N 50500686 CHEMBL3752232 Cholinesterase 1900 ChEMBL 10.1016/j.bmc.2016.01.010 10.7270/Q23R0WWJ 26795115 Fang, L; Chen, M; Liu, Z; Fang, X; Gou, S; Chen, L Southeast University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500686 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500686&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127036990 433912587 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218506 CC(C)NCc1cccc2[nH]c3ccccc3c12 InChI=1S/C16H18N2/c1-11(2)17-10-12-6-5-9-15-16(12)13-7-3-4-8-14(13)18-15/h3-9,11,17-18H,10H2,1-2H3 FQDRVQDEPDZKCL-UHFFFAOYSA-N 50500690 CHEMBL3752974 Cholinesterase 8900 ChEMBL 10.1016/j.bmc.2016.01.010 10.7270/Q23R0WWJ 26795115 Fang, L; Chen, M; Liu, Z; Fang, X; Gou, S; Chen, L Southeast University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500690 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500690&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127036864 433912591 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218508 COc1ccc2c(c1)[nH]c1cccc(CN(C3CCCC3)C(=O)\C=C\c3ccc(O)c(OC)c3)c21 InChI=1S/C29H30N2O4/c1-34-22-12-13-23-25(17-22)30-24-9-5-6-20(29(23)24)18-31(21-7-3-4-8-21)28(33)15-11-19-10-14-26(32)27(16-19)35-2/h5-6,9-17,21,30,32H,3-4,7-8,18H2,1-2H3/b15-11+ HGJWLSRIDADYDV-RVDMUPIBSA-N 50500693 CHEMBL3753231 Cholinesterase 25900 ChEMBL 10.1016/j.bmc.2016.01.010 10.7270/Q23R0WWJ 26795115 Fang, L; Chen, M; Liu, Z; Fang, X; Gou, S; Chen, L Southeast University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500693 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500693&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127036993 433912594 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218509 COc1ccc2c(c1)[nH]c1cccc(CN(C3CCCCC3)C(=O)\C=C\c3ccc(O)c(OC)c3)c21 InChI=1S/C30H32N2O4/c1-35-23-13-14-24-26(18-23)31-25-10-6-7-21(30(24)25)19-32(22-8-4-3-5-9-22)29(34)16-12-20-11-15-27(33)28(17-20)36-2/h6-7,10-18,22,31,33H,3-5,8-9,19H2,1-2H3/b16-12+ FVAZNLYVBBCIRD-FOWTUZBSSA-N 50500697 CHEMBL3752521 Cholinesterase 20500 ChEMBL 10.1016/j.bmc.2016.01.010 10.7270/Q23R0WWJ 26795115 Fang, L; Chen, M; Liu, Z; Fang, X; Gou, S; Chen, L Southeast University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500697 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500697&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127027938 433912598 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51217860 COc1ccccc1OCCNC(=O)c1cc2c(ccc3c(C)cc(=O)oc23)oc1=N InChI=1S/C23H20N2O6/c1-13-11-20(26)31-21-14(13)7-8-17-15(21)12-16(22(24)30-17)23(27)25-9-10-29-19-6-4-3-5-18(19)28-2/h3-8,11-12,24H,9-10H2,1-2H3,(H,25,27) JBAJEOIIKJZOMX-UHFFFAOYSA-N 50500453 CHEMBL3746191 Cholinesterase 24800 ChEMBL 10.1016/j.ejmech.2015.10.046 10.7270/Q2JW8HWF 26588065 Shaik, JB; Palaka, BK; Penumala, M; Kotapati, KV; Devineni, SR; Eadlapalli, S; Darla, MM; Ampasala, DR; Vadde, R; Amooru, GD Yogi Vemana University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500453 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500453&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127038274 433912354 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51217863 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 7690 ChEMBL 10.1016/j.ejmech.2015.10.046 10.7270/Q2JW8HWF 26588065 Shaik, JB; Palaka, BK; Penumala, M; Kotapati, KV; Devineni, SR; Eadlapalli, S; Darla, MM; Ampasala, DR; Vadde, R; Amooru, GD Yogi Vemana University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51217864 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 19780 ChEMBL 10.1016/j.ejmech.2015.10.046 10.7270/Q2JW8HWF 26588065 Shaik, JB; Palaka, BK; Penumala, M; Kotapati, KV; Devineni, SR; Eadlapalli, S; Darla, MM; Ampasala, DR; Vadde, R; Amooru, GD Yogi Vemana University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51217865 Cc1cc(=O)oc2c1ccc1oc(=N)c(cc21)C(=O)NCc1ccc(cc1)C(C)(C)C InChI=1S/C25H24N2O4/c1-14-11-21(28)31-22-17(14)9-10-20-18(22)12-19(23(26)30-20)24(29)27-13-15-5-7-16(8-6-15)25(2,3)4/h5-12,26H,13H2,1-4H3,(H,27,29) UMTKCFJRDJJORY-UHFFFAOYSA-N 189377 N-(4-(tert-butyl)benzyl)-8-imino-4-methyl-2-oxo-2H,8H-pyrano[2,3-f]chromene-9-carboxamide (4p) Cholinesterase 57930 ChEMBL 10.1016/j.ejmech.2015.10.046 10.7270/Q2JW8HWF 26588065 Shaik, JB; Palaka, BK; Penumala, M; Kotapati, KV; Devineni, SR; Eadlapalli, S; Darla, MM; Ampasala, DR; Vadde, R; Amooru, GD Yogi Vemana University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=189377 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=189377&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 121238088 316606991 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51217866 Cc1cc(=O)oc2c1ccc1oc(=N)c(cc21)C(=O)NCc1cccc(Cl)c1 InChI=1S/C21H15ClN2O4/c1-11-7-18(25)28-19-14(11)5-6-17-15(19)9-16(20(23)27-17)21(26)24-10-12-3-2-4-13(22)8-12/h2-9,23H,10H2,1H3,(H,24,26) BNIZIDOQRRXXPZ-UHFFFAOYSA-N 50500456 CHEMBL3747774 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.10.046 10.7270/Q2JW8HWF 26588065 Shaik, JB; Palaka, BK; Penumala, M; Kotapati, KV; Devineni, SR; Eadlapalli, S; Darla, MM; Ampasala, DR; Vadde, R; Amooru, GD Yogi Vemana University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500456 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500456&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127038273 433912357 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51217867 Cc1cc(=O)oc2c1ccc1oc(=N)c(cc21)C(=O)NCc1cccc(Br)c1 InChI=1S/C21H15BrN2O4/c1-11-7-18(25)28-19-14(11)5-6-17-15(19)9-16(20(23)27-17)21(26)24-10-12-3-2-4-13(22)8-12/h2-9,23H,10H2,1H3,(H,24,26) NNLAJSUPDKVLFC-UHFFFAOYSA-N 50500457 CHEMBL3746815 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.10.046 10.7270/Q2JW8HWF 26588065 Shaik, JB; Palaka, BK; Penumala, M; Kotapati, KV; Devineni, SR; Eadlapalli, S; Darla, MM; Ampasala, DR; Vadde, R; Amooru, GD Yogi Vemana University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500457 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500457&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127038243 433912358 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51217868 Cc1cc(=O)oc2c1ccc1oc(=N)c(cc21)C(=O)NCc1ccccc1Br InChI=1S/C21H15BrN2O4/c1-11-8-18(25)28-19-13(11)6-7-17-14(19)9-15(20(23)27-17)21(26)24-10-12-4-2-3-5-16(12)22/h2-9,23H,10H2,1H3,(H,24,26) RDRHSWAZLFORIL-UHFFFAOYSA-N 50500458 CHEMBL3746565 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.10.046 10.7270/Q2JW8HWF 26588065 Shaik, JB; Palaka, BK; Penumala, M; Kotapati, KV; Devineni, SR; Eadlapalli, S; Darla, MM; Ampasala, DR; Vadde, R; Amooru, GD Yogi Vemana University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500458 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500458&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127037909 433912359 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51217869 COc1ccc(CNC(=O)c2cc3c(ccc4c(C)cc(=O)oc34)oc2=N)c(OC)c1 InChI=1S/C23H20N2O6/c1-12-8-20(26)31-21-15(12)6-7-18-16(21)10-17(22(24)30-18)23(27)25-11-13-4-5-14(28-2)9-19(13)29-3/h4-10,24H,11H2,1-3H3,(H,25,27) ZJRBVJALNVWYRQ-UHFFFAOYSA-N 50500459 CHEMBL3747030 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.10.046 10.7270/Q2JW8HWF 26588065 Shaik, JB; Palaka, BK; Penumala, M; Kotapati, KV; Devineni, SR; Eadlapalli, S; Darla, MM; Ampasala, DR; Vadde, R; Amooru, GD Yogi Vemana University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500459 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500459&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127042831 433912360 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51217870 Cc1cc(=O)oc2c1ccc1oc(=N)c(cc21)C(=O)NC1CC1 InChI=1S/C17H14N2O4/c1-8-6-14(20)23-15-10(8)4-5-13-11(15)7-12(16(18)22-13)17(21)19-9-2-3-9/h4-7,9,18H,2-3H2,1H3,(H,19,21) OJQOOEGPIAPNKX-UHFFFAOYSA-N 50500452 CHEMBL3746215 Cholinesterase 38900 ChEMBL 10.1016/j.ejmech.2015.10.046 10.7270/Q2JW8HWF 26588065 Shaik, JB; Palaka, BK; Penumala, M; Kotapati, KV; Devineni, SR; Eadlapalli, S; Darla, MM; Ampasala, DR; Vadde, R; Amooru, GD Yogi Vemana University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500452 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500452&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127039996 433912353 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51217871 CCNC(=O)c1cc2c(ccc3c(C)cc(=O)oc23)oc1=N InChI=1S/C16H14N2O4/c1-3-18-16(20)11-7-10-12(21-15(11)17)5-4-9-8(2)6-13(19)22-14(9)10/h4-7,17H,3H2,1-2H3,(H,18,20) LIOOSNFBAOLBOF-UHFFFAOYSA-N 50500460 CHEMBL3746173 Cholinesterase 11320 ChEMBL 10.1016/j.ejmech.2015.10.046 10.7270/Q2JW8HWF 26588065 Shaik, JB; Palaka, BK; Penumala, M; Kotapati, KV; Devineni, SR; Eadlapalli, S; Darla, MM; Ampasala, DR; Vadde, R; Amooru, GD Yogi Vemana University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500460 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500460&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127042507 433912361 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51217872 CNC(=O)c1cc2c(ccc3c(C)cc(=O)oc23)oc1=N InChI=1S/C15H12N2O4/c1-7-5-12(18)21-13-8(7)3-4-11-9(13)6-10(14(16)20-11)15(19)17-2/h3-6,16H,1-2H3,(H,17,19) QIGYMOQNNAMNRB-UHFFFAOYSA-N 50500454 CHEMBL3746327 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.10.046 10.7270/Q2JW8HWF 26588065 Shaik, JB; Palaka, BK; Penumala, M; Kotapati, KV; Devineni, SR; Eadlapalli, S; Darla, MM; Ampasala, DR; Vadde, R; Amooru, GD Yogi Vemana University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500454 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500454&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127037892 433912355 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51217880 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 1770 ChEMBL 10.1016/j.ejmech.2015.10.046 10.7270/Q2JW8HWF 26588065 Shaik, JB; Palaka, BK; Penumala, M; Kotapati, KV; Devineni, SR; Eadlapalli, S; Darla, MM; Ampasala, DR; Vadde, R; Amooru, GD Yogi Vemana University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51217883 Cc1cc(=O)oc2c1ccc1oc(=N)c(cc21)C(=O)NC1CCCCC1 InChI=1S/C20H20N2O4/c1-11-9-17(23)26-18-13(11)7-8-16-14(18)10-15(19(21)25-16)20(24)22-12-5-3-2-4-6-12/h7-10,12,21H,2-6H2,1H3,(H,22,24) PHJCDRRQJGMVBB-UHFFFAOYSA-N 50500464 CHEMBL3745983 Cholinesterase 42050 ChEMBL 10.1016/j.ejmech.2015.10.046 10.7270/Q2JW8HWF 26588065 Shaik, JB; Palaka, BK; Penumala, M; Kotapati, KV; Devineni, SR; Eadlapalli, S; Darla, MM; Ampasala, DR; Vadde, R; Amooru, GD Yogi Vemana University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500464 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500464&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127039997 433912365 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51217886 Cc1cc(=O)oc2c1ccc1oc(=N)c(cc21)C(=O)NCc1ccccc1 InChI=1S/C21H16N2O4/c1-12-9-18(24)27-19-14(12)7-8-17-15(19)10-16(20(22)26-17)21(25)23-11-13-5-3-2-4-6-13/h2-10,22H,11H2,1H3,(H,23,25) XVVUYOBDAZUWNG-UHFFFAOYSA-N 50500465 CHEMBL3747234 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.10.046 10.7270/Q2JW8HWF 26588065 Shaik, JB; Palaka, BK; Penumala, M; Kotapati, KV; Devineni, SR; Eadlapalli, S; Darla, MM; Ampasala, DR; Vadde, R; Amooru, GD Yogi Vemana University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500465 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500465&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127040329 433912366 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51217887 Cc1cc(=O)oc2c1ccc1oc(=N)c(cc21)C(=O)Nc1ccccc1[N+]([O-])=O InChI=1S/C20H13N3O6/c1-10-8-17(24)29-18-11(10)6-7-16-12(18)9-13(19(21)28-16)20(25)22-14-4-2-3-5-15(14)23(26)27/h2-9,21H,1H3,(H,22,25) ONWGINPDIZHZJU-UHFFFAOYSA-N 50500466 CHEMBL3747027 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.10.046 10.7270/Q2JW8HWF 26588065 Shaik, JB; Palaka, BK; Penumala, M; Kotapati, KV; Devineni, SR; Eadlapalli, S; Darla, MM; Ampasala, DR; Vadde, R; Amooru, GD Yogi Vemana University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500466 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500466&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127038275 433912367 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51217888 Cc1cc(=O)oc2c1ccc1oc(=N)c(cc21)C(=O)NCc1ccccc1Cl InChI=1S/C21H15ClN2O4/c1-11-8-18(25)28-19-13(11)6-7-17-14(19)9-15(20(23)27-17)21(26)24-10-12-4-2-3-5-16(12)22/h2-9,23H,10H2,1H3,(H,24,26) WHHWSDAZRVRYPB-UHFFFAOYSA-N 50500467 CHEMBL3745757 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.10.046 10.7270/Q2JW8HWF 26588065 Shaik, JB; Palaka, BK; Penumala, M; Kotapati, KV; Devineni, SR; Eadlapalli, S; Darla, MM; Ampasala, DR; Vadde, R; Amooru, GD Yogi Vemana University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500467 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500467&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127038272 433912368 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51217889 CC(NC(=O)c1cc2c(ccc3c(C)cc(=O)oc23)oc1=N)c1ccccc1 InChI=1S/C22H18N2O4/c1-12-10-19(25)28-20-15(12)8-9-18-16(20)11-17(21(23)27-18)22(26)24-13(2)14-6-4-3-5-7-14/h3-11,13,23H,1-2H3,(H,24,26) FQUHBSCFHGGWQF-UHFFFAOYSA-N 50500468 CHEMBL3745771 Cholinesterase 35840 ChEMBL 10.1016/j.ejmech.2015.10.046 10.7270/Q2JW8HWF 26588065 Shaik, JB; Palaka, BK; Penumala, M; Kotapati, KV; Devineni, SR; Eadlapalli, S; Darla, MM; Ampasala, DR; Vadde, R; Amooru, GD Yogi Vemana University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500468 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500468&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127042529 433912369 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51217890 CCCCCCCCCCCCNC(=O)c1cc2c(ccc3c(C)cc(=O)oc23)oc1=N InChI=1S/C26H34N2O4/c1-3-4-5-6-7-8-9-10-11-12-15-28-26(30)21-17-20-22(31-25(21)27)14-13-19-18(2)16-23(29)32-24(19)20/h13-14,16-17,27H,3-12,15H2,1-2H3,(H,28,30) HCWRMBJJTLEOOL-UHFFFAOYSA-N 50500455 CHEMBL3746856 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2015.10.046 10.7270/Q2JW8HWF 26588065 Shaik, JB; Palaka, BK; Penumala, M; Kotapati, KV; Devineni, SR; Eadlapalli, S; Darla, MM; Ampasala, DR; Vadde, R; Amooru, GD Yogi Vemana University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500455 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500455&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127039995 433912356 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51217901 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 11682 2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::Rivastigmine.tartrate::US9586925, Rivastigmine Cholinesterase 5500 ChEMBL 10.1016/j.ejmech.2015.10.046 10.7270/Q2JW8HWF 26588065 Shaik, JB; Palaka, BK; Penumala, M; Kotapati, KV; Devineni, SR; Eadlapalli, S; Darla, MM; Ampasala, DR; Vadde, R; Amooru, GD Yogi Vemana University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=11682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=11682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46512204 DB00989 C11766 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51217902 Cc1cc(=O)oc2c1ccc1oc(=N)c(cc21)C(=O)N1CCCC1 InChI=1S/C18H16N2O4/c1-10-8-15(21)24-16-11(10)4-5-14-12(16)9-13(17(19)23-14)18(22)20-6-2-3-7-20/h4-5,8-9,19H,2-3,6-7H2,1H3 JNVKCNJAACGUID-UHFFFAOYSA-N 50500463 CHEMBL3746086 Cholinesterase 73080 ChEMBL 10.1016/j.ejmech.2015.10.046 10.7270/Q2JW8HWF 26588065 Shaik, JB; Palaka, BK; Penumala, M; Kotapati, KV; Devineni, SR; Eadlapalli, S; Darla, MM; Ampasala, DR; Vadde, R; Amooru, GD Yogi Vemana University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500463 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500463&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127039998 433912364 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218630 I.ICC1CN=C(Nc2ccc3OCCOc3c2)S1 InChI=1S/C12H13IN2O2S.HI/c13-6-9-7-14-12(18-9)15-8-1-2-10-11(5-8)17-4-3-16-10;/h1-2,5,9H,3-4,6-7H2,(H,14,15);1H SJUNBJUJTAFFBF-UHFFFAOYSA-N 50500747 CHEMBL3753661 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500747 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500747&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 17387123 433912648 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218631 I.COc1ccc(CN(Cc2ccccc2)C2=NCC(CI)S2)cc1 InChI=1S/C19H21IN2OS.HI/c1-23-17-9-7-16(8-10-17)14-22(13-15-5-3-2-4-6-15)19-21-12-18(11-20)24-19;/h2-10,18H,11-14H2,1H3;1H RXXQDXOURVMKKU-UHFFFAOYSA-N 50500748 CHEMBL3753156 Cholinesterase 25000 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500748 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500748&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 45927218 433912649 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218633 Br.Clc1ccccc1CN(Cc1cccnc1)C1=NCC(CBr)S1 InChI=1S/C17H17BrClN3S.BrH/c18-8-15-10-21-17(23-15)22(11-13-4-3-7-20-9-13)12-14-5-1-2-6-16(14)19;/h1-7,9,15H,8,10-12H2;1H AYSLRPNFZIKXFS-UHFFFAOYSA-N 50500750 CHEMBL3752399 Cholinesterase 25000 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500750 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500750&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127037372 433912651 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218634 I.Fc1ccc(CN(Cc2ccccc2)C2=NCC(CI)S2)cc1 InChI=1S/C18H18FIN2S.HI/c19-16-8-6-15(7-9-16)13-22(12-14-4-2-1-3-5-14)18-21-11-17(10-20)23-18;/h1-9,17H,10-13H2;1H INMHFSUJCQKLAK-UHFFFAOYSA-N 50500751 CHEMBL3754088 Cholinesterase 17000 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500751 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500751&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 45927237 433912652 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218640 I.ICC1CN=C(Nc2ccccn2)S1 InChI=1S/C9H10IN3S.HI/c10-5-7-6-12-9(14-7)13-8-3-1-2-4-11-8;/h1-4,7H,5-6H2,(H,11,12,13);1H BBEHLCAYPLLIOZ-UHFFFAOYSA-N 50500756 CHEMBL3752908 Cholinesterase 2740 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500756 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500756&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 22782067 433912657 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218641 Br.BrCC1CN=C(S1)N(Cc1ccccc1)Cc1ccccc1 InChI=1S/C18H19BrN2S.BrH/c19-11-17-12-20-18(22-17)21(13-15-7-3-1-4-8-15)14-16-9-5-2-6-10-16;/h1-10,17H,11-14H2;1H WPSYSYIBUCHSJJ-UHFFFAOYSA-N 50500753 CHEMBL3752331 Cholinesterase 26000 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500753 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500753&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 45927211 433912654 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218642 Br.CC(C)c1ccc(CN(Cc2ccccc2)C2=NCC(CBr)S2)cc1 InChI=1S/C21H25BrN2S.BrH/c1-16(2)19-10-8-18(9-11-19)15-24(14-17-6-4-3-5-7-17)21-23-13-20(12-22)25-21;/h3-11,16,20H,12-15H2,1-2H3;1H FBLYKJMVKIBMLM-UHFFFAOYSA-N 50500757 CHEMBL3752682 Cholinesterase 11000 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500757 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500757&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127034817 433912658 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218643 I.CC(C)c1ccc(CN(Cc2ccccc2)C2=NCC(CI)S2)cc1 InChI=1S/C21H25IN2S.HI/c1-16(2)19-10-8-18(9-11-19)15-24(14-17-6-4-3-5-7-17)21-23-13-20(12-22)25-21;/h3-11,16,20H,12-15H2,1-2H3;1H XUBSZFKBGGTKJG-UHFFFAOYSA-N 50500755 CHEMBL3752466 Cholinesterase 4140 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500755 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500755&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127036470 433912656 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218644 Br.COc1ccc(CN(Cc2ccccc2)C2=NCC(CBr)S2)cc1 InChI=1S/C19H21BrN2OS.BrH/c1-23-17-9-7-16(8-10-17)14-22(13-15-5-3-2-4-6-15)19-21-12-18(11-20)24-19;/h2-10,18H,11-14H2,1H3;1H NQWUMWBROLIACL-UHFFFAOYSA-N 50500758 CHEMBL3753216 Cholinesterase 34000 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500758 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500758&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127035296 433912659 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218645 I.CC(N(Cc1ccccc1)C1=NCC(CI)S1)c1ccccc1 InChI=1S/C19H21IN2S.HI/c1-15(17-10-6-3-7-11-17)22(14-16-8-4-2-5-9-16)19-21-13-18(12-20)23-19;/h2-11,15,18H,12-14H2,1H3;1H SPXZWCGLRJBURD-UHFFFAOYSA-N 50500759 CHEMBL3754616 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500759 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500759&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127037228 433912660 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218646 I.Clc1ccc(CN(Cc2cccnc2)C2=NCC(CI)S2)cc1 InChI=1S/C17H17ClIN3S.HI/c18-15-5-3-13(4-6-15)11-22(12-14-2-1-7-20-9-14)17-21-10-16(8-19)23-17;/h1-7,9,16H,8,10-12H2;1H QKZJBPUGVMCHRK-UHFFFAOYSA-N 50500760 CHEMBL3754622 Cholinesterase 2470 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500760 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500760&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127037371 433912661 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218647 I.Clc1ccccc1CN(Cc1ccccc1)C1=NCC(CI)S1 InChI=1S/C18H18ClIN2S.HI/c19-17-9-5-4-8-15(17)13-22(12-14-6-2-1-3-7-14)18-21-11-16(10-20)23-18;/h1-9,16H,10-13H2;1H IIKSCRJYHWRDPE-UHFFFAOYSA-N 50500761 CHEMBL3752873 Cholinesterase 44000 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500761 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500761&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127037374 433912662 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218648 I.COc1ccc(CN(Cc2ccccc2)C2=NCC(CI)S2)cc1OC InChI=1S/C20H23IN2O2S.HI/c1-24-18-9-8-16(10-19(18)25-2)14-23(13-15-6-4-3-5-7-15)20-22-12-17(11-21)26-20;/h3-10,17H,11-14H2,1-2H3;1H IXAJVSWYENRSLI-UHFFFAOYSA-N 50500762 CHEMBL3752710 Cholinesterase 20000 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500762 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500762&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127037375 433912663 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218649 I.ICC1CN=C(S1)N(Cc1ccco1)Cc1ccccc1 InChI=1S/C16H17IN2OS.HI/c17-9-15-10-18-16(21-15)19(12-14-7-4-8-20-14)11-13-5-2-1-3-6-13;/h1-8,15H,9-12H2;1H GIEYUBQDRHVEIP-UHFFFAOYSA-N 50500763 CHEMBL3753018 Cholinesterase 42000 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500763 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500763&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127037393 433912664 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218662 Br.CC(C)(C)c1ccc(CN(Cc2ccccc2)C2=NCC(CBr)S2)cc1 InChI=1S/C22H27BrN2S.BrH/c1-22(2,3)19-11-9-18(10-12-19)16-25(15-17-7-5-4-6-8-17)21-24-14-20(13-23)26-21;/h4-12,20H,13-16H2,1-3H3;1H NVNFMGZZNJBVDZ-UHFFFAOYSA-N 50500752 CHEMBL3754327 Cholinesterase 620 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500752 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500752&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127035294 433912653 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218663 I.CC(C)(C)c1ccc(CN(Cc2ccccc2)C2=NCC(CI)S2)cc1 InChI=1S/C22H27IN2S.HI/c1-22(2,3)19-11-9-18(10-12-19)16-25(15-17-7-5-4-6-8-17)21-24-14-20(13-23)26-21;/h4-12,20H,13-16H2,1-3H3;1H NGXBGIBCRPYJFJ-UHFFFAOYSA-N 50500766 CHEMBL3754409 Cholinesterase 270 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500766 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500766&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127035295 433912667 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218664 Br.Clc1ccc(CN(Cc2cccnc2)C2=NCC(CBr)S2)cc1 InChI=1S/C17H17BrClN3S.BrH/c18-8-16-10-21-17(23-16)22(12-14-2-1-7-20-9-14)11-13-3-5-15(19)6-4-13;/h1-7,9,16H,8,10-12H2;1H HJSWMBMNDHEZQX-UHFFFAOYSA-N 50500746 CHEMBL3753531 Cholinesterase 9510 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500746 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500746&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127037229 433912647 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218665 Br.Clc1ccc(CN(Cc2cccnc2)C2=NCC(CBr)S2)cc1 InChI=1S/C17H17BrClN3S.BrH/c18-8-16-10-21-17(23-16)22(12-14-2-1-7-20-9-14)11-13-3-5-15(19)6-4-13;/h1-7,9,16H,8,10-12H2;1H HJSWMBMNDHEZQX-UHFFFAOYSA-N 50500746 CHEMBL3753531 Cholinesterase 19900 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500746 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500746&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127037229 433912647 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218666 I.Clc1ccc(CN(Cc2cccnc2)C2=NCC(CI)S2)cc1 InChI=1S/C17H17ClIN3S.HI/c18-15-5-3-13(4-6-15)11-22(12-14-2-1-7-20-9-14)17-21-10-16(8-19)23-17;/h1-7,9,16H,8,10-12H2;1H QKZJBPUGVMCHRK-UHFFFAOYSA-N 50500760 CHEMBL3754622 Cholinesterase 3600 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500760 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500760&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127037371 433912661 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218673 Br.BrCC1CN=C(Nc2ccccn2)S1 InChI=1S/C9H10BrN3S.BrH/c10-5-7-6-12-9(14-7)13-8-3-1-2-4-11-8;/h1-4,7H,5-6H2,(H,11,12,13);1H WJZJQMLNEHPMCE-UHFFFAOYSA-N 50500765 CHEMBL3754585 Cholinesterase 63000 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500765 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500765&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 17387125 433912666 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218674 Br.CC(N(Cc1ccccc1)C1=NCC(CBr)S1)c1ccccc1 InChI=1S/C19H21BrN2S.BrH/c1-15(17-10-6-3-7-11-17)22(14-16-8-4-2-5-9-16)19-21-13-18(12-20)23-19;/h2-11,15,18H,12-14H2,1H3;1H BPNNKKLEAUJXKE-UHFFFAOYSA-N 50500770 CHEMBL3752043 Cholinesterase 14000 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500770 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500770&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127037227 433912671 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218676 I.CC(C)c1ccc(CN(Cc2ccccc2)C2=NCC(CI)S2)cc1 InChI=1S/C21H25IN2S.HI/c1-16(2)19-10-8-18(9-11-19)15-24(14-17-6-4-3-5-7-17)21-23-13-20(12-22)25-21;/h3-11,16,20H,12-15H2,1-2H3;1H XUBSZFKBGGTKJG-UHFFFAOYSA-N 50500755 CHEMBL3752466 Cholinesterase 7560 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500755 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500755&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127036470 433912656 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218678 I.Clc1ccc(CN(Cc2cccnc2)C2=NCC(CI)S2)cc1 InChI=1S/C17H17ClIN3S.HI/c18-15-5-3-13(4-6-15)11-22(12-14-2-1-7-20-9-14)17-21-10-16(8-19)23-17;/h1-7,9,16H,8,10-12H2;1H QKZJBPUGVMCHRK-UHFFFAOYSA-N 50500760 CHEMBL3754622 Cholinesterase 670 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500760 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500760&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127037371 433912661 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218681 Br.Clc1ccc(CN(Cc2cccnc2)C2=NCC(CBr)S2)cc1 InChI=1S/C17H17BrClN3S.BrH/c18-8-16-10-21-17(23-16)22(12-14-2-1-7-20-9-14)11-13-3-5-15(19)6-4-13;/h1-7,9,16H,8,10-12H2;1H HJSWMBMNDHEZQX-UHFFFAOYSA-N 50500746 CHEMBL3753531 Cholinesterase 30000 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500746 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500746&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127037229 433912647 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218682 I.ICC1CN=C(NCc2ccccc2)S1 InChI=1S/C11H13IN2S.HI/c12-6-10-8-14-11(15-10)13-7-9-4-2-1-3-5-9;/h1-5,10H,6-8H2,(H,13,14);1H FEBHLNRWKRUTJV-UHFFFAOYSA-N 50500749 CHEMBL3754187 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500749 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500749&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44665504 433912650 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218683 Br.Fc1ccc(CN(Cc2ccccc2)C2=NCC(CBr)S2)cc1 InChI=1S/C18H18BrFN2S.BrH/c19-10-17-11-21-18(23-17)22(12-14-4-2-1-3-5-14)13-15-6-8-16(20)9-7-15;/h1-9,17H,10-13H2;1H YINGYWPXARMCEK-UHFFFAOYSA-N 50500769 CHEMBL3754339 Cholinesterase 38000 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500769 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500769&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127037352 433912670 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218684 Br.CC(C)(C)c1ccc(CN(Cc2ccccc2)C2=NCC(CBr)S2)cc1 InChI=1S/C22H27BrN2S.BrH/c1-22(2,3)19-11-9-18(10-12-19)16-25(15-17-7-5-4-6-8-17)21-24-14-20(13-23)26-21;/h4-12,20H,13-16H2,1-3H3;1H NVNFMGZZNJBVDZ-UHFFFAOYSA-N 50500752 CHEMBL3754327 Cholinesterase 2340 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500752 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500752&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127035294 433912653 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218685 I.Clc1ccccc1CN(Cc1cccnc1)C1=NCC(CI)S1 InChI=1S/C17H17ClIN3S.HI/c18-16-6-2-1-5-14(16)12-22(11-13-4-3-7-20-9-13)17-21-10-15(8-19)23-17;/h1-7,9,15H,8,10-12H2;1H UNYUXVBTBKWEDI-UHFFFAOYSA-N 50500767 CHEMBL3752953 Cholinesterase 21000 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500767 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500767&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127037373 433912668 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218692 I.CC(C)c1ccc(CN(Cc2ccccc2)C2=NCC(CI)S2)cc1 InChI=1S/C21H25IN2S.HI/c1-16(2)19-10-8-18(9-11-19)15-24(14-17-6-4-3-5-7-17)21-23-13-20(12-22)25-21;/h3-11,16,20H,12-15H2,1-2H3;1H XUBSZFKBGGTKJG-UHFFFAOYSA-N 50500755 CHEMBL3752466 Cholinesterase 1340 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500755 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500755&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127036470 433912656 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218693 I.ICC1CN=C(Nc2ccccn2)S1 InChI=1S/C9H10IN3S.HI/c10-5-7-6-12-9(14-7)13-8-3-1-2-4-11-8;/h1-4,7H,5-6H2,(H,11,12,13);1H BBEHLCAYPLLIOZ-UHFFFAOYSA-N 50500756 CHEMBL3752908 Cholinesterase 1530 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500756 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500756&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 22782067 433912657 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218695 I.CC(C)(C)c1ccc(CN(Cc2ccccc2)C2=NCC(CI)S2)cc1 InChI=1S/C22H27IN2S.HI/c1-22(2,3)19-11-9-18(10-12-19)16-25(15-17-7-5-4-6-8-17)21-24-14-20(13-23)26-21;/h4-12,20H,13-16H2,1-3H3;1H NGXBGIBCRPYJFJ-UHFFFAOYSA-N 50500766 CHEMBL3754409 Cholinesterase 770 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500766 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500766&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127035295 433912667 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218697 I.CC(C)(C)c1ccc(CN(Cc2ccccc2)C2=NCC(CI)S2)cc1 InChI=1S/C22H27IN2S.HI/c1-22(2,3)19-11-9-18(10-12-19)16-25(15-17-7-5-4-6-8-17)21-24-14-20(13-23)26-21;/h4-12,20H,13-16H2,1-3H3;1H NGXBGIBCRPYJFJ-UHFFFAOYSA-N 50500766 CHEMBL3754409 Cholinesterase 1200 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500766 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500766&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127035295 433912667 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218699 I.ICC1CN=C(Nc2ccc3c(c2)oc2ccccc32)S1 InChI=1S/C16H13IN2OS.HI/c17-8-11-9-18-16(21-11)19-10-5-6-13-12-3-1-2-4-14(12)20-15(13)7-10;/h1-7,11H,8-9H2,(H,18,19);1H YINGMGJZPHGOCR-UHFFFAOYSA-N 50500768 CHEMBL3751906 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500768 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500768&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 17388353 433912669 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218700 Br.BrCC1CN=C(NCc2ccccc2)S1 InChI=1S/C11H13BrN2S.BrH/c12-6-10-8-14-11(15-10)13-7-9-4-2-1-3-5-9;/h1-5,10H,6-8H2,(H,13,14);1H VIIFIDASFDEDJI-UHFFFAOYSA-N 50500754 CHEMBL3753110 Cholinesterase 29000 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500754 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500754&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127037033 433912655 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218704 I.CC(C)(C)c1cc(CN(Cc2ccccc2)C2=NCC(CI)S2)cc(c1O)C(C)(C)C InChI=1S/C26H35IN2OS.HI/c1-25(2,3)21-12-19(13-22(23(21)30)26(4,5)6)17-29(16-18-10-8-7-9-11-18)24-28-15-20(14-27)31-24;/h7-13,20,30H,14-17H2,1-6H3;1H HIGNQSJBXWATAL-UHFFFAOYSA-N 50500773 CHEMBL3752567 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500773 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500773&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127037392 433912674 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51218708 I.ICC1CN=C(S1)N(Cc1ccccc1)Cc1ccccc1 InChI=1S/C18H19IN2S.HI/c19-11-17-12-20-18(22-17)21(13-15-7-3-1-4-8-15)14-16-9-5-2-6-10-16;/h1-10,17H,11-14H2;1H KCZKDVRGFRQQQE-UHFFFAOYSA-N 50500772 CHEMBL3751974 Cholinesterase 25000 ChEMBL 10.1016/j.bmc.2016.01.031 10.7270/Q2B85C4Q 26827140 Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Serebryakova, OG; Stupina, TS; Terentiev, AA; Serkov, IV; Proshin, AN; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50500772 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50500772&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 45927209 433912673 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248771 Clc1ccccc1-c1cc(no1)C(=O)NCCc1c[nH]c2ccccc12 InChI=1S/C20H16ClN3O2/c21-16-7-3-1-6-15(16)19-11-18(24-26-19)20(25)22-10-9-13-12-23-17-8-4-2-5-14(13)17/h1-8,11-12,23H,9-10H2,(H,22,25) KGBQXXYYNLETQM-UHFFFAOYSA-N 50510863 CHEMBL4525818 Cholinesterase 46100 ChEMBL 10.1016/j.bmc.2019.01.025 10.7270/Q2N87F3N 30744931 Mishra, P; Kumar, A; Panda, G CSIR-Central Drug Research Institute http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50510863 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50510863&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 99453287 440719445 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248803 O=C(NCCNc1c2CCCCc2nc2ccccc12)\C=C\c1ccc(OCc2ccccc2)cc1 InChI=1S/C31H31N3O2/c35-30(19-16-23-14-17-25(18-15-23)36-22-24-8-2-1-3-9-24)32-20-21-33-31-26-10-4-6-12-28(26)34-29-13-7-5-11-27(29)31/h1-4,6,8-10,12,14-19H,5,7,11,13,20-22H2,(H,32,35)(H,33,34)/b19-16+ XDSJIKQHXRQOIP-KNTRCKAVSA-N 50510841 CHEMBL4522757 Cholinesterase 43 ChEMBL 10.1016/j.bmc.2019.01.025 10.7270/Q2N87F3N 30744931 Mishra, P; Kumar, A; Panda, G CSIR-Central Drug Research Institute http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50510841 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50510841&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155543595 440719423 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51265455 Oc1ccccc1C(=O)\C=C\c1cccc(OCCCCN2CCc3ccccc3C2)c1 InChI=1S/C28H29NO3/c30-27-13-4-3-12-26(27)28(31)15-14-22-8-7-11-25(20-22)32-19-6-5-17-29-18-16-23-9-1-2-10-24(23)21-29/h1-4,7-15,20,30H,5-6,16-19,21H2/b15-14+ SXCBXTMLACVLPO-CCEZHUSRSA-N 50516808 CHEMBL4456222 Cholinesterase 2600 ChEMBL 10.1016/j.ejmech.2019.07.021 10.7270/Q2GH9N9F 31310916 Sang, Z; Wang, K; Zhang, P; Shi, J; Liu, W; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50516808 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50516808&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155525316 440725390 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51265465 Oc1ccccc1C(=O)CCc1cccc(OCCCCN2CCc3ccccc3C2)c1 InChI=1S/C28H31NO3/c30-27-13-4-3-12-26(27)28(31)15-14-22-8-7-11-25(20-22)32-19-6-5-17-29-18-16-23-9-1-2-10-24(23)21-29/h1-4,7-13,20,30H,5-6,14-19,21H2 RHBIZKTZGOSQNZ-UHFFFAOYSA-N 50516814 CHEMBL4473943 Cholinesterase 640 ChEMBL 10.1016/j.ejmech.2019.07.021 10.7270/Q2GH9N9F 31310916 Sang, Z; Wang, K; Zhang, P; Shi, J; Liu, W; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50516814 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50516814&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155536709 440725396 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51265466 CN(C)c1ccc(\C=C\C(=O)c2ccc(OCCCCCCN3CCc4ccccc4C3)cc2O)cc1 InChI=1S/C32H38N2O3/c1-33(2)28-14-11-25(12-15-28)13-18-31(35)30-17-16-29(23-32(30)36)37-22-8-4-3-7-20-34-21-19-26-9-5-6-10-27(26)24-34/h5-6,9-18,23,36H,3-4,7-8,19-22,24H2,1-2H3/b18-13+ LIZMCFOGSREMCG-QGOAFFKASA-N 50516815 CHEMBL4441838 Cholinesterase 10400 ChEMBL 10.1016/j.ejmech.2019.07.021 10.7270/Q2GH9N9F 31310916 Sang, Z; Wang, K; Zhang, P; Shi, J; Liu, W; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50516815 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50516815&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155515670 440725397 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51265467 COc1ccccc1\C=C\C(=O)c1ccc(OCCCCN2CCc3ccccc3C2)cc1O InChI=1S/C29H31NO4/c1-33-29-11-5-4-9-23(29)12-15-27(31)26-14-13-25(20-28(26)32)34-19-7-6-17-30-18-16-22-8-2-3-10-24(22)21-30/h2-5,8-15,20,32H,6-7,16-19,21H2,1H3/b15-12+ NQFHMBDPSBUHPJ-NTCAYCPXSA-N 50516813 CHEMBL4573947 Cholinesterase 5200 ChEMBL 10.1016/j.ejmech.2019.07.021 10.7270/Q2GH9N9F 31310916 Sang, Z; Wang, K; Zhang, P; Shi, J; Liu, W; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50516813 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50516813&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155563561 440725395 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51265468 Oc1ccccc1C(=O)\C=C\c1cccc(OCCCCCCN2CCc3ccccc3C2)c1 InChI=1S/C30H33NO3/c32-29-15-6-5-14-28(29)30(33)17-16-24-10-9-13-27(22-24)34-21-8-2-1-7-19-31-20-18-25-11-3-4-12-26(25)23-31/h3-6,9-17,22,32H,1-2,7-8,18-21,23H2/b17-16+ LMCXXQBXQSOCHG-WUKNDPDISA-N 50516810 CHEMBL4434713 Cholinesterase 4100 ChEMBL 10.1016/j.ejmech.2019.07.021 10.7270/Q2GH9N9F 31310916 Sang, Z; Wang, K; Zhang, P; Shi, J; Liu, W; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50516810 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50516810&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155510755 440725392 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51265469 Oc1ccccc1C(=O)\C=C\c1cccc(OCCCCCN2CCc3ccccc3C2)c1 InChI=1S/C29H31NO3/c31-28-14-5-4-13-27(28)29(32)16-15-23-9-8-12-26(21-23)33-20-7-1-6-18-30-19-17-24-10-2-3-11-25(24)22-30/h2-5,8-16,21,31H,1,6-7,17-20,22H2/b16-15+ BZOSPZDADJSUNX-FOCLMDBBSA-N 50516809 CHEMBL4538762 Cholinesterase 3700 ChEMBL 10.1016/j.ejmech.2019.07.021 10.7270/Q2GH9N9F 31310916 Sang, Z; Wang, K; Zhang, P; Shi, J; Liu, W; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50516809 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50516809&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155549176 440725391 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261635 C(CCNc1c2CCCCc2nc2ccccc12)CCOCCc1ccc(OCc2ccccc2)cc1 InChI=1S/C33H38N2O2/c1-3-11-27(12-4-1)25-37-28-19-17-26(18-20-28)21-24-36-23-10-2-9-22-34-33-29-13-5-7-15-31(29)35-32-16-8-6-14-30(32)33/h1,3-5,7,11-13,15,17-20H,2,6,8-10,14,16,21-25H2,(H,34,35) UHCNDWKIQWKBPR-UHFFFAOYSA-N 50515453 CHEMBL4588525 Cholinesterase 1.9 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515453 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515453&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155567205 440724035 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261636 C(Cc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1)Nc1c2CCCCc2nc2ccccc12 InChI=1S/C35H34N2O2/c1-3-11-27(12-4-1)24-38-33-20-19-26(23-34(33)39-25-28-13-5-2-6-14-28)21-22-36-35-29-15-7-9-17-31(29)37-32-18-10-8-16-30(32)35/h1-7,9,11-15,17,19-20,23H,8,10,16,18,21-22,24-25H2,(H,36,37) FASSBLFMDOWSAD-UHFFFAOYSA-N 50515454 CHEMBL4550977 Cholinesterase 22 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515454 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515454&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155555218 440724036 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261639 COc1ccc(\C=N\c2c3CCCCc3nc3ccccc23)cc1OC InChI=1S/C22H22N2O2/c1-25-20-12-11-15(13-21(20)26-2)14-23-22-16-7-3-5-9-18(16)24-19-10-6-4-8-17(19)22/h3,5,7,9,11-14H,4,6,8,10H2,1-2H3/b23-14+ DBCMGEUCLGVZMZ-OEAKJJBVSA-N 50515456 CHEMBL4564873 Cholinesterase 271 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515456 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515456&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155560122 440724038 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261640 COc1ccc(CNc2c3CCCCc3nc3ccccc23)cc1OC InChI=1S/C22H24N2O2/c1-25-20-12-11-15(13-21(20)26-2)14-23-22-16-7-3-5-9-18(16)24-19-10-6-4-8-17(19)22/h3,5,7,9,11-13H,4,6,8,10,14H2,1-2H3,(H,23,24) FRMYHFABGOUZJS-UHFFFAOYSA-N 199186 N-(3,4-Dimethoxybenzyl)-1,2,3,4-tetrahydroacridin-9-amine (8e) Cholinesterase 6.4 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=199186 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=199186&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122199175 318589105 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261644 C1CCN(CC1)c1c2CCCCc2nc2ccccc12 InChI=1S/C18H22N2/c1-6-12-20(13-7-1)18-14-8-2-4-10-16(14)19-17-11-5-3-9-15(17)18/h2,4,8,10H,1,3,5-7,9,11-13H2 PHKKNMUDCVZREA-UHFFFAOYSA-N 50515455 CHEMBL4549672 Cholinesterase 275 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515455 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515455&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 22021 440724037 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261648 Oc1ccc(CCOCCCCCNc2c3CCCCc3nc3ccccc23)cc1O InChI=1S/C26H32N2O3/c29-24-13-12-19(18-25(24)30)14-17-31-16-7-1-6-15-27-26-20-8-2-4-10-22(20)28-23-11-5-3-9-21(23)26/h2,4,8,10,12-13,18,29-30H,1,3,5-7,9,11,14-17H2,(H,27,28) HHMHVPYNIQVEKU-UHFFFAOYSA-N 50515462 CHEMBL4589250 Cholinesterase 43 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515462 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515462&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155567920 440724044 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261649 COc1ccc(CCOCCCCCNc2c3CCCCc3nc3ccccc23)cc1 InChI=1S/C27H34N2O2/c1-30-22-15-13-21(14-16-22)17-20-31-19-8-2-7-18-28-27-23-9-3-5-11-25(23)29-26-12-6-4-10-24(26)27/h3,5,9,11,13-16H,2,4,6-8,10,12,17-20H2,1H3,(H,28,29) WZYKETQNVWSQLW-UHFFFAOYSA-N 50515460 CHEMBL4475228 Cholinesterase 29 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515460 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515460&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155537540 440724042 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261650 COc1ccc(CNCCCCCNc2c3CCCCc3nc3ccccc23)cc1OC InChI=1S/C27H35N3O2/c1-31-25-15-14-20(18-26(25)32-2)19-28-16-8-3-9-17-29-27-21-10-4-6-12-23(21)30-24-13-7-5-11-22(24)27/h4,6,10,12,14-15,18,28H,3,5,7-9,11,13,16-17,19H2,1-2H3,(H,29,30) HAKBJGAKWDBTMR-UHFFFAOYSA-N 50345196 CHEMBL1783191::N1-(3,4-Dimethoxybenzyl)-N5-(1,2,3,4-tetrahydroacridin-9-yl)pentane-1,5-diamine Cholinesterase 30 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50345196 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50345196&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53304409 131348132 CHEMBL1783191 ZINC71295647 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261651 C1CCN(C1)c1c2CCCCc2nc2ccccc12 InChI=1S/C17H20N2/c1-3-9-15-13(7-1)17(19-11-5-6-12-19)14-8-2-4-10-16(14)18-15/h1,3,7,9H,2,4-6,8,10-12H2 MPPAGJFGXFSONE-UHFFFAOYSA-N 50515463 CHEMBL4450123 Cholinesterase 1202 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515463 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515463&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14615961 440724045 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261652 Oc1ccc(CCNc2c3CCCCc3nc3ccccc23)cc1O InChI=1S/C21H22N2O2/c24-19-10-9-14(13-20(19)25)11-12-22-21-15-5-1-3-7-17(15)23-18-8-4-2-6-16(18)21/h1,3,5,7,9-10,13,24-25H,2,4,6,8,11-12H2,(H,22,23) OFLOLCWSTYMAGI-UHFFFAOYSA-N 50515464 CHEMBL3182739 Cholinesterase 128 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515464 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515464&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53308667 440724046 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261653 Oc1ccc(CCNc2c3CCCCc3nc3ccccc23)cc1 InChI=1S/C21H22N2O/c24-16-11-9-15(10-12-16)13-14-22-21-17-5-1-3-7-19(17)23-20-8-4-2-6-18(20)21/h1,3,5,7,9-12,24H,2,4,6,8,13-14H2,(H,22,23) KKMZWWPFIDONQR-UHFFFAOYSA-N 50515458 CHEMBL4575976 Cholinesterase 184 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515458 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515458&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155564270 440724040 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261654 Oc1ccc(CNc2c3CCCCc3nc3ccccc23)cc1O InChI=1S/C20H20N2O2/c23-18-10-9-13(11-19(18)24)12-21-20-14-5-1-3-7-16(14)22-17-8-4-2-6-15(17)20/h1,3,5,7,9-11,23-24H,2,4,6,8,12H2,(H,21,22) DHQHCSROVOIZIA-UHFFFAOYSA-N 50515461 CHEMBL4535585 Cholinesterase 25 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515461 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515461&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155547778 440724043 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261655 Oc1ccc(\C=N\c2c3CCCCc3nc3ccccc23)cc1O InChI=1S/C20H18N2O2/c23-18-10-9-13(11-19(18)24)12-21-20-14-5-1-3-7-16(14)22-17-8-4-2-6-15(17)20/h1,3,5,7,9-12,23-24H,2,4,6,8H2/b21-12+ PQHHHZGJZDSJDP-CIAFOILYSA-N 50515465 CHEMBL4536715 Cholinesterase 11 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515465 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515465&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155548245 440724047 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261656 COc1ccc(CNc2c3CCCCc3nc3ccccc23)cc1OC InChI=1S/C22H24N2O2/c1-25-20-12-11-15(13-21(20)26-2)14-23-22-16-7-3-5-9-18(16)24-19-10-6-4-8-17(19)22/h3,5,7,9,11-13H,4,6,8,10,14H2,1-2H3,(H,23,24) FRMYHFABGOUZJS-UHFFFAOYSA-N 199186 N-(3,4-Dimethoxybenzyl)-1,2,3,4-tetrahydroacridin-9-amine (8e) Cholinesterase 31 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=199186 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=199186&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 122199175 318589105 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51264499 CCN(CC)C(=O)Oc1cccc(\C=C\C(=O)c2ccccc2O)c1 InChI=1S/C20H21NO4/c1-3-21(4-2)20(24)25-16-9-7-8-15(14-16)12-13-19(23)17-10-5-6-11-18(17)22/h5-14,22H,3-4H2,1-2H3/b13-12+ SZKDMADXPSAQLJ-OUKQBFOZSA-N 50516503 CHEMBL4448344 Cholinesterase 4800 ChEMBL 10.1016/j.ejmech.2019.06.026 10.7270/Q2668HJZ 31229875 Sang, Z; Wang, K; Shi, J; Liu, W; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50516503 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50516503&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155519920 440725085 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51264500 O=C(Oc1cccc(\C=C\C(=O)c2ccccc2OC(=O)N2CCOCC2)c1)N1CCOCC1 InChI=1S/C25H26N2O7/c28-22(21-6-1-2-7-23(21)34-25(30)27-12-16-32-17-13-27)9-8-19-4-3-5-20(18-19)33-24(29)26-10-14-31-15-11-26/h1-9,18H,10-17H2/b9-8+ QMDZVJHLRGCFIG-CMDGGOBGSA-N 50516504 CHEMBL4468771 Cholinesterase 2000 ChEMBL 10.1016/j.ejmech.2019.06.026 10.7270/Q2668HJZ 31229875 Sang, Z; Wang, K; Shi, J; Liu, W; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50516504 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50516504&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155533470 440725086 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51264501 CON(C)C(=O)Oc1cccc(\C=C\C(=O)c2ccccc2O)c1 InChI=1S/C18H17NO5/c1-19(23-2)18(22)24-14-7-5-6-13(12-14)10-11-17(21)15-8-3-4-9-16(15)20/h3-12,20H,1-2H3/b11-10+ JYCVHXOCRFCJNO-ZHACJKMWSA-N 50516505 CHEMBL4579723 Cholinesterase 3200 ChEMBL 10.1016/j.ejmech.2019.06.026 10.7270/Q2668HJZ 31229875 Sang, Z; Wang, K; Shi, J; Liu, W; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50516505 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50516505&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155565612 440725087 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51264502 Oc1ccccc1C(=O)\C=C\c1cccc(OC(=O)N2CCOCC2)c1 InChI=1S/C20H19NO5/c22-18-7-2-1-6-17(18)19(23)9-8-15-4-3-5-16(14-15)26-20(24)21-10-12-25-13-11-21/h1-9,14,22H,10-13H2/b9-8+ JQPNYNBANGCKPS-CMDGGOBGSA-N 50516506 CHEMBL4591934 Cholinesterase 5100 ChEMBL 10.1016/j.ejmech.2019.06.026 10.7270/Q2668HJZ 31229875 Sang, Z; Wang, K; Shi, J; Liu, W; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50516506 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50516506&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155568569 440725088 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51264503 CCN(C)C(=O)Oc1cccc(\C=C\C(=O)c2ccccc2OC(=O)N(C)CC)c1 InChI=1S/C23H26N2O5/c1-5-24(3)22(27)29-18-11-9-10-17(16-18)14-15-20(26)19-12-7-8-13-21(19)30-23(28)25(4)6-2/h7-16H,5-6H2,1-4H3/b15-14+ HZIVYLGDVOIEJK-CCEZHUSRSA-N 50516507 CHEMBL4563460 Cholinesterase 1200 ChEMBL 10.1016/j.ejmech.2019.06.026 10.7270/Q2668HJZ 31229875 Sang, Z; Wang, K; Shi, J; Liu, W; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50516507 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50516507&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155559365 440725089 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51264504 CCN(CC)C(=O)Oc1cccc(\C=C\C(=O)c2ccccc2OC(=O)N(CC)CC)c1 InChI=1S/C25H30N2O5/c1-5-26(6-2)24(29)31-20-13-11-12-19(18-20)16-17-22(28)21-14-9-10-15-23(21)32-25(30)27(7-3)8-4/h9-18H,5-8H2,1-4H3/b17-16+ FZIHTKAKCLVWEI-WUKNDPDISA-N 50516508 CHEMBL4460825 Cholinesterase 3100 ChEMBL 10.1016/j.ejmech.2019.06.026 10.7270/Q2668HJZ 31229875 Sang, Z; Wang, K; Shi, J; Liu, W; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50516508 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50516508&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155527760 440725090 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51264505 O=C(Oc1cccc(\C=C\C(=O)c2ccccc2OC(=O)N(c2ccccc2)c2ccccc2)c1)N(c1ccccc1)c1ccccc1 InChI=1S/C41H30N2O5/c44-38(37-26-13-14-27-39(37)48-41(46)43(34-21-9-3-10-22-34)35-23-11-4-12-24-35)29-28-31-16-15-25-36(30-31)47-40(45)42(32-17-5-1-6-18-32)33-19-7-2-8-20-33/h1-30H/b29-28+ DLMOSLOJIQQXOA-ZQHSETAFSA-N 50516509 CHEMBL4448924 Cholinesterase 42600 ChEMBL 10.1016/j.ejmech.2019.06.026 10.7270/Q2668HJZ 31229875 Sang, Z; Wang, K; Shi, J; Liu, W; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50516509 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50516509&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155520339 440725091 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51264506 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 11682 2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::Rivastigmine.tartrate::US9586925, Rivastigmine Cholinesterase 1300 ChEMBL 10.1016/j.ejmech.2019.06.026 10.7270/Q2668HJZ 31229875 Sang, Z; Wang, K; Shi, J; Liu, W; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=11682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=11682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46512204 DB00989 C11766 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51264517 CN(C)C(=O)Oc1cccc(\C=C\C(=O)c2ccccc2O)c1 InChI=1S/C18H17NO4/c1-19(2)18(22)23-14-7-5-6-13(12-14)10-11-17(21)15-8-3-4-9-16(15)20/h3-12,20H,1-2H3/b11-10+ OOCKYGCCBVUPGD-ZHACJKMWSA-N 50516510 CHEMBL4446815 Cholinesterase 2510 ChEMBL 10.1016/j.ejmech.2019.06.026 10.7270/Q2668HJZ 31229875 Sang, Z; Wang, K; Shi, J; Liu, W; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50516510 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50516510&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155518426 440725092 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51264518 CCN(C)C(=O)Oc1cccc(\C=C\C(=O)c2ccccc2O)c1 InChI=1S/C19H19NO4/c1-3-20(2)19(23)24-15-8-6-7-14(13-15)11-12-18(22)16-9-4-5-10-17(16)21/h4-13,21H,3H2,1-2H3/b12-11+ MFXKQHXOACNCJP-VAWYXSNFSA-N 50504425 CHEMBL4466019 Cholinesterase 3100 ChEMBL 10.1016/j.ejmech.2019.06.026 10.7270/Q2668HJZ 31229875 Sang, Z; Wang, K; Shi, J; Liu, W; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50504425 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50504425&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155531521 440713010 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51265478 Oc1ccccc1C(=O)\C=C\c1cccc(OCCCCN2CCC(Cc3ccccc3)CC2)c1 InChI=1S/C31H35NO3/c33-30-14-5-4-13-29(30)31(34)16-15-26-11-8-12-28(24-26)35-22-7-6-19-32-20-17-27(18-21-32)23-25-9-2-1-3-10-25/h1-5,8-16,24,27,33H,6-7,17-23H2/b16-15+ GIILMBIOAIBFQQ-FOCLMDBBSA-N 50516812 CHEMBL4567417 Cholinesterase 4900 ChEMBL 10.1016/j.ejmech.2019.07.021 10.7270/Q2GH9N9F 31310916 Sang, Z; Wang, K; Zhang, P; Shi, J; Liu, W; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50516812 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50516812&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155544824 440725394 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51265485 Oc1ccccc1C(=O)\C=C\c1cccc(OCCCN2CCc3ccccc3C2)c1 InChI=1S/C27H27NO3/c29-26-12-4-3-11-25(26)27(30)14-13-21-7-5-10-24(19-21)31-18-6-16-28-17-15-22-8-1-2-9-23(22)20-28/h1-5,7-14,19,29H,6,15-18,20H2/b14-13+ GJDWSSJPOCLEEE-BUHFOSPRSA-N 50516811 CHEMBL4574317 Cholinesterase 11200 ChEMBL 10.1016/j.ejmech.2019.07.021 10.7270/Q2GH9N9F 31310916 Sang, Z; Wang, K; Zhang, P; Shi, J; Liu, W; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50516811 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50516811&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155563922 440725393 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51265488 Oc1cc(OCCCN2CCc3ccccc3C2)ccc1C(=O)\C=C\c1ccc(F)cc1 InChI=1S/C27H26FNO3/c28-23-9-6-20(7-10-23)8-13-26(30)25-12-11-24(18-27(25)31)32-17-3-15-29-16-14-21-4-1-2-5-22(21)19-29/h1-2,4-13,18,31H,3,14-17,19H2/b13-8+ GSHSAUCZIDVPRZ-MDWZMJQESA-N 50516807 CHEMBL4457588 Cholinesterase 13400 ChEMBL 10.1016/j.ejmech.2019.07.021 10.7270/Q2GH9N9F 31310916 Sang, Z; Wang, K; Zhang, P; Shi, J; Liu, W; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50516807 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50516807&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155525799 440725389 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51265490 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 4760 ChEMBL 10.1016/j.ejmech.2019.07.021 10.7270/Q2GH9N9F 31310916 Sang, Z; Wang, K; Zhang, P; Shi, J; Liu, W; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51254012 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 21500 ChEMBL 10.1016/j.bmc.2019.07.015 10.7270/Q2T72MTF 31378596 Wajid, S; Khatoon, A; Khan, MA; Zafar, H; Kanwal, S; Atta-Ur-Rahman, na; Choudhary, MI; Basha, FZ University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51254013 CCOc1ccccc1C(=O)Nc1c(Cl)cccc1Cl InChI=1S/C15H13Cl2NO2/c1-2-20-13-9-4-3-6-10(13)15(19)18-14-11(16)7-5-8-12(14)17/h3-9H,2H2,1H3,(H,18,19) OKJYSCRPDGEZKV-UHFFFAOYSA-N 50512774 CHEMBL4448967 Cholinesterase 6000 ChEMBL 10.1016/j.bmc.2019.07.015 10.7270/Q2T72MTF 31378596 Wajid, S; Khatoon, A; Khan, MA; Zafar, H; Kanwal, S; Atta-Ur-Rahman, na; Choudhary, MI; Basha, FZ University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50512774 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50512774&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 773683 440721356 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51254014 Fc1ccc(C(=O)Nc2c(Cl)cccc2Cl)c(F)c1 InChI=1S/C13H7Cl2F2NO/c14-9-2-1-3-10(15)12(9)18-13(19)8-5-4-7(16)6-11(8)17/h1-6H,(H,18,19) LRHUFGFVVNZDSA-UHFFFAOYSA-N 50512775 CHEMBL4529136 Cholinesterase 27600 ChEMBL 10.1016/j.bmc.2019.07.015 10.7270/Q2T72MTF 31378596 Wajid, S; Khatoon, A; Khan, MA; Zafar, H; Kanwal, S; Atta-Ur-Rahman, na; Choudhary, MI; Basha, FZ University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50512775 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50512775&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 17683554 440721357 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51254015 Clc1cccc(Cl)c1NC(=O)c1ccccc1Br InChI=1S/C13H8BrCl2NO/c14-9-5-2-1-4-8(9)13(18)17-12-10(15)6-3-7-11(12)16/h1-7H,(H,17,18) ANPIQKCKVWGLBA-UHFFFAOYSA-N 50512776 CHEMBL4471134 Cholinesterase 2400 ChEMBL 10.1016/j.bmc.2019.07.015 10.7270/Q2T72MTF 31378596 Wajid, S; Khatoon, A; Khan, MA; Zafar, H; Kanwal, S; Atta-Ur-Rahman, na; Choudhary, MI; Basha, FZ University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50512776 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50512776&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 4606170 440721358 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51254016 COc1cccc(c1)C(=O)Nc1c(Cl)cccc1Cl InChI=1S/C14H11Cl2NO2/c1-19-10-5-2-4-9(8-10)14(18)17-13-11(15)6-3-7-12(13)16/h2-8H,1H3,(H,17,18) HWHWKIBZNCDDSK-UHFFFAOYSA-N 50512777 CHEMBL4470521 Cholinesterase 13000 ChEMBL 10.1016/j.bmc.2019.07.015 10.7270/Q2T72MTF 31378596 Wajid, S; Khatoon, A; Khan, MA; Zafar, H; Kanwal, S; Atta-Ur-Rahman, na; Choudhary, MI; Basha, FZ University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50512777 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50512777&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 803383 440721359 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51254017 Fc1ccc(cc1)C(=O)Nc1c(Cl)cccc1Cl InChI=1S/C13H8Cl2FNO/c14-10-2-1-3-11(15)12(10)17-13(18)8-4-6-9(16)7-5-8/h1-7H,(H,17,18) BHRPGZNLQLPUOI-UHFFFAOYSA-N 50512778 CHEMBL4542735 Cholinesterase 9900 ChEMBL 10.1016/j.bmc.2019.07.015 10.7270/Q2T72MTF 31378596 Wajid, S; Khatoon, A; Khan, MA; Zafar, H; Kanwal, S; Atta-Ur-Rahman, na; Choudhary, MI; Basha, FZ University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50512778 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50512778&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 703465 440721360 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51254018 Cc1ccc(cc1[N+]([O-])=O)C(=O)Nc1c(Cl)cccc1Cl InChI=1S/C14H10Cl2N2O3/c1-8-5-6-9(7-12(8)18(20)21)14(19)17-13-10(15)3-2-4-11(13)16/h2-7H,1H3,(H,17,19) DHAZESYVMSATGN-UHFFFAOYSA-N 50512779 CHEMBL4546309 Cholinesterase 165000 ChEMBL 10.1016/j.bmc.2019.07.015 10.7270/Q2T72MTF 31378596 Wajid, S; Khatoon, A; Khan, MA; Zafar, H; Kanwal, S; Atta-Ur-Rahman, na; Choudhary, MI; Basha, FZ University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50512779 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50512779&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 871699 440721361 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51254019 COc1cc(cc(OC)c1OC)C(=O)Nc1c(Cl)cccc1Cl InChI=1S/C16H15Cl2NO4/c1-21-12-7-9(8-13(22-2)15(12)23-3)16(20)19-14-10(17)5-4-6-11(14)18/h4-8H,1-3H3,(H,19,20) SAPQVWMTQBMBKG-UHFFFAOYSA-N 50512780 CHEMBL4513971 Cholinesterase 20800 ChEMBL 10.1016/j.bmc.2019.07.015 10.7270/Q2T72MTF 31378596 Wajid, S; Khatoon, A; Khan, MA; Zafar, H; Kanwal, S; Atta-Ur-Rahman, na; Choudhary, MI; Basha, FZ University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50512780 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50512780&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 989628 440721362 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51254020 COc1ccc(cc1)C(=O)Nc1c(Cl)cccc1Cl InChI=1S/C14H11Cl2NO2/c1-19-10-7-5-9(6-8-10)14(18)17-13-11(15)3-2-4-12(13)16/h2-8H,1H3,(H,17,18) DLSZPRUJGBYYHP-UHFFFAOYSA-N 50512781 CHEMBL4555516 Cholinesterase 11300 ChEMBL 10.1016/j.bmc.2019.07.015 10.7270/Q2T72MTF 31378596 Wajid, S; Khatoon, A; Khan, MA; Zafar, H; Kanwal, S; Atta-Ur-Rahman, na; Choudhary, MI; Basha, FZ University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50512781 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50512781&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 853828 440721363 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51254021 Fc1ccc(C(=O)Nc2c(Cl)cccc2Cl)c(F)c1 InChI=1S/C13H7Cl2F2NO/c14-9-2-1-3-10(15)12(9)18-13(19)8-5-4-7(16)6-11(8)17/h1-6H,(H,18,19) LRHUFGFVVNZDSA-UHFFFAOYSA-N 50512775 CHEMBL4529136 Cholinesterase 18700 ChEMBL 10.1016/j.bmc.2019.07.015 10.7270/Q2T72MTF 31378596 Wajid, S; Khatoon, A; Khan, MA; Zafar, H; Kanwal, S; Atta-Ur-Rahman, na; Choudhary, MI; Basha, FZ University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50512775 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50512775&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 17683554 440721357 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51254022 Fc1ccc(cc1)C(=O)Nc1c(Cl)cccc1Cl InChI=1S/C13H8Cl2FNO/c14-10-2-1-3-11(15)12(10)17-13(18)8-4-6-9(16)7-5-8/h1-7H,(H,17,18) BHRPGZNLQLPUOI-UHFFFAOYSA-N 50512778 CHEMBL4542735 Cholinesterase 16100 ChEMBL 10.1016/j.bmc.2019.07.015 10.7270/Q2T72MTF 31378596 Wajid, S; Khatoon, A; Khan, MA; Zafar, H; Kanwal, S; Atta-Ur-Rahman, na; Choudhary, MI; Basha, FZ University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50512778 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50512778&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 703465 440721360 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51254023 Clc1cccc(Cl)c1NC(=O)c1ccc(Br)cc1 InChI=1S/C13H8BrCl2NO/c14-9-6-4-8(5-7-9)13(18)17-12-10(15)2-1-3-11(12)16/h1-7H,(H,17,18) SIVQKMDMFKXZNV-UHFFFAOYSA-N 50512782 CHEMBL4462721 Cholinesterase 800 ChEMBL 10.1016/j.bmc.2019.07.015 10.7270/Q2T72MTF 31378596 Wajid, S; Khatoon, A; Khan, MA; Zafar, H; Kanwal, S; Atta-Ur-Rahman, na; Choudhary, MI; Basha, FZ University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50512782 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50512782&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3631716 440721364 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261682 C(Oc1ccc(\C=N\c2c3CCCCc3nc3ccccc23)cc1)c1ccccc1 InChI=1S/C27H24N2O/c1-2-8-21(9-3-1)19-30-22-16-14-20(15-17-22)18-28-27-23-10-4-6-12-25(23)29-26-13-7-5-11-24(26)27/h1-4,6,8-10,12,14-18H,5,7,11,13,19H2/b28-18+ CGLCEYKATBCYGF-MTDXEUNCSA-N 50515474 CHEMBL4517722 Cholinesterase 2925 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515474 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515474&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155541182 440724056 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261683 COc1ccc(\C=N\c2c3CCCCc3nc3ccccc23)cc1OC InChI=1S/C22H22N2O2/c1-25-20-12-11-15(13-21(20)26-2)14-23-22-16-7-3-5-9-18(16)24-19-10-6-4-8-17(19)22/h3,5,7,9,11-14H,4,6,8,10H2,1-2H3/b23-14+ DBCMGEUCLGVZMZ-OEAKJJBVSA-N 50515456 CHEMBL4564873 Cholinesterase 35 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515456 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515456&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155560122 440724038 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261684 C(Oc1ccc(\C=N\c2c3CCCCc3nc3ccccc23)cc1)c1ccccc1 InChI=1S/C27H24N2O/c1-2-8-21(9-3-1)19-30-22-16-14-20(15-17-22)18-28-27-23-10-4-6-12-25(23)29-26-13-7-5-11-24(26)27/h1-4,6,8-10,12,14-18H,5,7,11,13,19H2/b28-18+ CGLCEYKATBCYGF-MTDXEUNCSA-N 50515474 CHEMBL4517722 Cholinesterase 643 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515474 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515474&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155541182 440724056 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261685 Oc1ccc(\C=N\c2c3CCCCc3nc3ccccc23)cc1 InChI=1S/C20H18N2O/c23-15-11-9-14(10-12-15)13-21-20-16-5-1-3-7-18(16)22-19-8-4-2-6-17(19)20/h1,3,5,7,9-13,23H,2,4,6,8H2/b21-13+ LPFRQQSAVVOOFW-FYJGNVAPSA-N 50515467 CHEMBL4439554 Cholinesterase 17 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515467 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515467&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 135621406 440724049 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261686 Oc1ccc(CNc2c3CCCCc3nc3ccccc23)cc1 InChI=1S/C20H20N2O/c23-15-11-9-14(10-12-15)13-21-20-16-5-1-3-7-18(16)22-19-8-4-2-6-17(19)20/h1,3,5,7,9-12,23H,2,4,6,8,13H2,(H,21,22) LLBRADQTDMRJOG-UHFFFAOYSA-N 50515468 CHEMBL4483710 Cholinesterase 3.2 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515468 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515468&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155540791 440724050 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261687 Oc1ccc(\C=N\c2c3CCCCc3nc3ccccc23)cc1O InChI=1S/C20H18N2O2/c23-18-10-9-13(11-19(18)24)12-21-20-14-5-1-3-7-16(14)22-17-8-4-2-6-15(17)20/h1,3,5,7,9-12,23-24H,2,4,6,8H2/b21-12+ PQHHHZGJZDSJDP-CIAFOILYSA-N 50515465 CHEMBL4536715 Cholinesterase 1.9 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515465 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515465&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155548245 440724047 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261688 Oc1cc(\C=N\c2c3CCCCc3nc3ccccc23)cc(O)c1O InChI=1S/C20H18N2O3/c23-17-9-12(10-18(24)20(17)25)11-21-19-13-5-1-3-7-15(13)22-16-8-4-2-6-14(16)19/h1,3,5,7,9-11,23-25H,2,4,6,8H2/b21-11+ UPDJYWZNZKMPDX-SRZZPIQSSA-N 50515469 CHEMBL4521755 Cholinesterase 5.8 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515469 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515469&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155542748 440724051 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261689 Oc1ccc(CCNc2c3CCCCc3nc3ccccc23)cc1O InChI=1S/C21H22N2O2/c24-19-10-9-14(13-20(19)25)11-12-22-21-15-5-1-3-7-17(15)23-18-8-4-2-6-16(18)21/h1,3,5,7,9-10,13,24-25H,2,4,6,8,11-12H2,(H,22,23) OFLOLCWSTYMAGI-UHFFFAOYSA-N 50515464 CHEMBL3182739 Cholinesterase 28 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515464 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515464&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53308667 440724046 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261690 COc1ccc(CNCCCCCNc2c3CCCCc3nc3ccccc23)cc1OC InChI=1S/C27H35N3O2/c1-31-25-15-14-20(18-26(25)32-2)19-28-16-8-3-9-17-29-27-21-10-4-6-12-23(21)30-24-13-7-5-11-22(24)27/h4,6,10,12,14-15,18,28H,3,5,7-9,11,13,16-17,19H2,1-2H3,(H,29,30) HAKBJGAKWDBTMR-UHFFFAOYSA-N 50345196 CHEMBL1783191::N1-(3,4-Dimethoxybenzyl)-N5-(1,2,3,4-tetrahydroacridin-9-yl)pentane-1,5-diamine Cholinesterase 9.9 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50345196 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50345196&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53304409 131348132 CHEMBL1783191 ZINC71295647 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261691 Oc1ccc(CNCCCCCCNc2c3CCCCc3nc3ccccc23)cc1O InChI=1S/C26H33N3O2/c30-24-14-13-19(17-25(24)31)18-27-15-7-1-2-8-16-28-26-20-9-3-5-11-22(20)29-23-12-6-4-10-21(23)26/h3,5,9,11,13-14,17,27,30-31H,1-2,4,6-8,10,12,15-16,18H2,(H,28,29) KRJKXHMZSOYNPZ-UHFFFAOYSA-N 50515473 CHEMBL4572757 Cholinesterase 1.7 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515473 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515473&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155563256 440724055 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261692 COc1ccc(CCOCCCCCNc2c3CCCCc3nc3ccccc23)cc1 InChI=1S/C27H34N2O2/c1-30-22-15-13-21(14-16-22)17-20-31-19-8-2-7-18-28-27-23-9-3-5-11-25(23)29-26-12-6-4-10-24(26)27/h3,5,9,11,13-16H,2,4,6-8,10,12,17-20H2,1H3,(H,28,29) WZYKETQNVWSQLW-UHFFFAOYSA-N 50515460 CHEMBL4475228 Cholinesterase 2.9 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515460 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515460&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155537540 440724042 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261693 C(CCNc1c2CCCCc2nc2ccccc12)CCOCCc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1 InChI=1S/C40H44N2O3/c1-4-14-32(15-5-1)29-44-38-23-22-31(28-39(38)45-30-33-16-6-2-7-17-33)24-27-43-26-13-3-12-25-41-40-34-18-8-10-20-36(34)42-37-21-11-9-19-35(37)40/h1-2,4-8,10,14-18,20,22-23,28H,3,9,11-13,19,21,24-27,29-30H2,(H,41,42) KABZVCNOZFGCQY-UHFFFAOYSA-N 50515459 CHEMBL4545701 Cholinesterase 2.7 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515459 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515459&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155553046 440724041 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261694 Oc1ccc(CCOCCCCCNc2c3CCCCc3nc3ccccc23)cc1 InChI=1S/C26H32N2O2/c29-21-14-12-20(13-15-21)16-19-30-18-7-1-6-17-27-26-22-8-2-4-10-24(22)28-25-11-5-3-9-23(25)26/h2,4,8,10,12-15,29H,1,3,5-7,9,11,16-19H2,(H,27,28) AZMKNSQZSVBTKB-UHFFFAOYSA-N 50515471 CHEMBL4531167 Cholinesterase 4.5 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515471 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515471&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155546180 440724053 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261709 COc1ccc(CCOCCCCCNc2c3CCCCc3nc3ccccc23)cc1OC InChI=1S/C28H36N2O3/c1-31-26-15-14-21(20-27(26)32-2)16-19-33-18-9-3-8-17-29-28-22-10-4-6-12-24(22)30-25-13-7-5-11-23(25)28/h4,6,10,12,14-15,20H,3,5,7-9,11,13,16-19H2,1-2H3,(H,29,30) HEPJUELRSNLABC-UHFFFAOYSA-N 50515470 CHEMBL4555120 Cholinesterase 7.0 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515470 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515470&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155556531 440724052 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261710 C(Cc1ccc(OCc2ccccc2)cc1)Nc1c2CCCCc2nc2ccccc12 InChI=1S/C28H28N2O/c1-2-8-22(9-3-1)20-31-23-16-14-21(15-17-23)18-19-29-28-24-10-4-6-12-26(24)30-27-13-7-5-11-25(27)28/h1-4,6,8-10,12,14-17H,5,7,11,13,18-20H2,(H,29,30) AWWFDKCWBXMZRF-UHFFFAOYSA-N 50515472 CHEMBL4469822 Cholinesterase 22 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515472 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515472&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155534421 440724054 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261716 C(Oc1cc(\C=N\c2c3CCCCc3nc3ccccc23)cc(OCc2ccccc2)c1OCc1ccccc1)c1ccccc1 InChI=1S/C41H36N2O3/c1-4-14-30(15-5-1)27-44-38-24-33(26-42-40-34-20-10-12-22-36(34)43-37-23-13-11-21-35(37)40)25-39(45-28-31-16-6-2-7-17-31)41(38)46-29-32-18-8-3-9-19-32/h1-10,12,14-20,22,24-26H,11,13,21,23,27-29H2/b42-26+ HDBAZFWZBQLTKR-OOWNWPBNSA-N 50515466 CHEMBL4534033 Cholinesterase 192 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515466 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515466&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155546931 440724048 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261717 C(Cc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1)Nc1c2CCCCc2nc2ccccc12 InChI=1S/C35H34N2O2/c1-3-11-27(12-4-1)24-38-33-20-19-26(23-34(33)39-25-28-13-5-2-6-14-28)21-22-36-35-29-15-7-9-17-31(29)37-32-18-10-8-16-30(32)35/h1-7,9,11-15,17,19-20,23H,8,10,16,18,21-22,24-25H2,(H,36,37) FASSBLFMDOWSAD-UHFFFAOYSA-N 50515454 CHEMBL4550977 Cholinesterase 1.1 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515454 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515454&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155555218 440724036 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261718 C(CCNc1c2CCCCc2nc2ccccc12)CCOCCc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1 InChI=1S/C40H44N2O3/c1-4-14-32(15-5-1)29-44-38-23-22-31(28-39(38)45-30-33-16-6-2-7-17-33)24-27-43-26-13-3-12-25-41-40-34-18-8-10-20-36(34)42-37-21-11-9-19-35(37)40/h1-2,4-8,10,14-18,20,22-23,28H,3,9,11-13,19,21,24-27,29-30H2,(H,41,42) KABZVCNOZFGCQY-UHFFFAOYSA-N 50515459 CHEMBL4545701 Cholinesterase 4.6 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515459 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515459&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155553046 440724041 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261719 C1CCN(CC1)c1c2CCCCc2nc2ccccc12 InChI=1S/C18H22N2/c1-6-12-20(13-7-1)18-14-8-2-4-10-16(14)19-17-11-5-3-9-15(17)18/h2,4,8,10H,1,3,5-7,9,11-13H2 PHKKNMUDCVZREA-UHFFFAOYSA-N 50515455 CHEMBL4549672 Cholinesterase 1898 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515455 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515455&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 22021 440724037 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261720 Oc1cc(\C=N\c2c3CCCCc3nc3ccccc23)cc(O)c1O InChI=1S/C20H18N2O3/c23-17-9-12(10-18(24)20(17)25)11-21-19-13-5-1-3-7-15(13)22-16-8-4-2-6-14(16)19/h1,3,5,7,9-11,23-25H,2,4,6,8H2/b21-11+ UPDJYWZNZKMPDX-SRZZPIQSSA-N 50515469 CHEMBL4521755 Cholinesterase 51 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515469 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515469&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155542748 440724051 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261721 Oc1ccc(CNc2c3CCCCc3nc3ccccc23)cc1 InChI=1S/C20H20N2O/c23-15-11-9-14(10-12-15)13-21-20-16-5-1-3-7-18(16)22-19-8-4-2-6-17(19)20/h1,3,5,7,9-12,23H,2,4,6,8,13H2,(H,21,22) LLBRADQTDMRJOG-UHFFFAOYSA-N 50515468 CHEMBL4483710 Cholinesterase 12 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515468 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515468&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155540791 440724050 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261732 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 7700 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261733 C(Oc1ccc(\C=N\c2c3CCCCc3nc3ccccc23)cc1OCc1ccccc1)c1ccccc1 InChI=1S/C34H30N2O2/c1-3-11-25(12-4-1)23-37-32-20-19-27(21-33(32)38-24-26-13-5-2-6-14-26)22-35-34-28-15-7-9-17-30(28)36-31-18-10-8-16-29(31)34/h1-7,9,11-15,17,19-22H,8,10,16,18,23-24H2/b35-22+ RBCHVNJEMYCRCK-FADJLKOXSA-N 50515457 CHEMBL4560263 Cholinesterase 173 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515457 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515457&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155558672 440724039 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261734 Oc1ccc(CNc2c3CCCCc3nc3ccccc23)cc1O InChI=1S/C20H20N2O2/c23-18-10-9-13(11-19(18)24)12-21-20-14-5-1-3-7-16(14)22-17-8-4-2-6-15(17)20/h1,3,5,7,9-11,23-24H,2,4,6,8,12H2,(H,21,22) DHQHCSROVOIZIA-UHFFFAOYSA-N 50515461 CHEMBL4535585 Cholinesterase 3.2 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515461 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515461&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155547778 440724043 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261735 C1CCN(C1)c1c2CCCCc2nc2ccccc12 InChI=1S/C17H20N2/c1-3-9-15-13(7-1)17(19-11-5-6-12-19)14-8-2-4-10-16(14)18-15/h1,3,7,9H,2,4-6,8,10-12H2 MPPAGJFGXFSONE-UHFFFAOYSA-N 50515463 CHEMBL4450123 Cholinesterase 304 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515463 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515463&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14615961 440724045 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261736 COc1ccc(CCOCCCCCNc2c3CCCCc3nc3ccccc23)cc1OC InChI=1S/C28H36N2O3/c1-31-26-15-14-21(20-27(26)32-2)16-19-33-18-9-3-8-17-29-28-22-10-4-6-12-24(22)30-25-13-7-5-11-23(25)28/h4,6,10,12,14-15,20H,3,5,7-9,11,13,16-19H2,1-2H3,(H,29,30) HEPJUELRSNLABC-UHFFFAOYSA-N 50515470 CHEMBL4555120 Cholinesterase 1.9 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515470 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515470&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155556531 440724052 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261737 Oc1ccc(CCOCCCCCNc2c3CCCCc3nc3ccccc23)cc1O InChI=1S/C26H32N2O3/c29-24-13-12-19(18-25(24)30)14-17-31-16-7-1-6-15-27-26-20-8-2-4-10-22(20)28-23-11-5-3-9-21(23)26/h2,4,8,10,12-13,18,29-30H,1,3,5-7,9,11,14-17H2,(H,27,28) HHMHVPYNIQVEKU-UHFFFAOYSA-N 50515462 CHEMBL4589250 Cholinesterase 9.0 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515462 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515462&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155567920 440724044 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261744 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 17 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261745 Oc1ccc(CNCCCCCCNc2c3CCCCc3nc3ccccc23)cc1O InChI=1S/C26H33N3O2/c30-24-14-13-19(17-25(24)31)18-27-15-7-1-2-8-16-28-26-20-9-3-5-11-22(20)29-23-12-6-4-10-21(23)26/h3,5,9,11,13-14,17,27,30-31H,1-2,4,6-8,10,12,15-16,18H2,(H,28,29) KRJKXHMZSOYNPZ-UHFFFAOYSA-N 50515473 CHEMBL4572757 Cholinesterase 7.9 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515473 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515473&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155563256 440724055 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51264521 CN(C)C(=O)Oc1cccc(\C=C\C(=O)c2ccccc2OC(=O)N(C)C)c1 InChI=1S/C21H22N2O5/c1-22(2)20(25)27-16-9-7-8-15(14-16)12-13-18(24)17-10-5-6-11-19(17)28-21(26)23(3)4/h5-14H,1-4H3/b13-12+ LCPCXORRDYBCGA-OUKQBFOZSA-N 50516502 CHEMBL4454576 Cholinesterase 4500 ChEMBL 10.1016/j.ejmech.2019.06.026 10.7270/Q2668HJZ 31229875 Sang, Z; Wang, K; Shi, J; Liu, W; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50516502 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50516502&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155524254 440725084 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51264523 Oc1ccccc1C(=O)\C=C\c1cccc(OC(=O)N(c2ccccc2)c2ccccc2)c1 InChI=1S/C28H21NO4/c30-26-17-8-7-16-25(26)27(31)19-18-21-10-9-15-24(20-21)33-28(32)29(22-11-3-1-4-12-22)23-13-5-2-6-14-23/h1-20,30H/b19-18+ SXZXJRPONOQNNJ-VHEBQXMUSA-N 50516512 CHEMBL4565177 Cholinesterase 56200 ChEMBL 10.1016/j.ejmech.2019.06.026 10.7270/Q2668HJZ 31229875 Sang, Z; Wang, K; Shi, J; Liu, W; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50516512 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50516512&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155560171 440725094 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51264524 CON(C)C(=O)Oc1cccc(\C=C\C(=O)c2ccccc2OC(=O)N(C)OC)c1 InChI=1S/C21H22N2O7/c1-22(27-3)20(25)29-16-9-7-8-15(14-16)12-13-18(24)17-10-5-6-11-19(17)30-21(26)23(2)28-4/h5-14H,1-4H3/b13-12+ AQLMMTAPNXATMS-OUKQBFOZSA-N 50516511 CHEMBL4454566 Cholinesterase 1500 ChEMBL 10.1016/j.ejmech.2019.06.026 10.7270/Q2668HJZ 31229875 Sang, Z; Wang, K; Shi, J; Liu, W; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50516511 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50516511&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155523916 440725093 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51264525 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 4760 ChEMBL 10.1016/j.ejmech.2019.06.026 10.7270/Q2668HJZ 31229875 Sang, Z; Wang, K; Shi, J; Liu, W; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51254024 Clc1cccc(Cl)c1NC(=O)c1ccccc1 InChI=1S/C13H9Cl2NO/c14-10-7-4-8-11(15)12(10)16-13(17)9-5-2-1-3-6-9/h1-8H,(H,16,17) KGDQECZKWWPUTK-UHFFFAOYSA-N 50512783 CHEMBL4536564 Cholinesterase 1300 ChEMBL 10.1016/j.bmc.2019.07.015 10.7270/Q2T72MTF 31378596 Wajid, S; Khatoon, A; Khan, MA; Zafar, H; Kanwal, S; Atta-Ur-Rahman, na; Choudhary, MI; Basha, FZ University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50512783 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50512783&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 853661 440721365 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51254025 Fc1cccc(F)c1C(=O)Nc1c(Cl)cccc1Cl InChI=1S/C13H7Cl2F2NO/c14-7-3-1-4-8(15)12(7)18-13(19)11-9(16)5-2-6-10(11)17/h1-6H,(H,18,19) OEAAVYUOUHREFP-UHFFFAOYSA-N 50512784 CHEMBL4579999 Cholinesterase 5600 ChEMBL 10.1016/j.bmc.2019.07.015 10.7270/Q2T72MTF 31378596 Wajid, S; Khatoon, A; Khan, MA; Zafar, H; Kanwal, S; Atta-Ur-Rahman, na; Choudhary, MI; Basha, FZ University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50512784 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50512784&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 16640796 440721366 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51254026 COc1ccc(cc1)C(=O)Nc1c(Cl)cccc1Cl InChI=1S/C14H11Cl2NO2/c1-19-10-7-5-9(6-8-10)14(18)17-13-11(15)3-2-4-12(13)16/h2-8H,1H3,(H,17,18) DLSZPRUJGBYYHP-UHFFFAOYSA-N 50512781 CHEMBL4555516 Cholinesterase 18000 ChEMBL 10.1016/j.bmc.2019.07.015 10.7270/Q2T72MTF 31378596 Wajid, S; Khatoon, A; Khan, MA; Zafar, H; Kanwal, S; Atta-Ur-Rahman, na; Choudhary, MI; Basha, FZ University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50512781 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50512781&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 853828 440721363 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51254027 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 8400 ChEMBL 10.1016/j.bmc.2019.07.015 10.7270/Q2T72MTF 31378596 Wajid, S; Khatoon, A; Khan, MA; Zafar, H; Kanwal, S; Atta-Ur-Rahman, na; Choudhary, MI; Basha, FZ University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51254028 Fc1cccc(F)c1C(=O)Nc1c(Cl)cccc1Cl InChI=1S/C13H7Cl2F2NO/c14-7-3-1-4-8(15)12(7)18-13(19)11-9(16)5-2-6-10(11)17/h1-6H,(H,18,19) OEAAVYUOUHREFP-UHFFFAOYSA-N 50512784 CHEMBL4579999 Cholinesterase 12600 ChEMBL 10.1016/j.bmc.2019.07.015 10.7270/Q2T72MTF 31378596 Wajid, S; Khatoon, A; Khan, MA; Zafar, H; Kanwal, S; Atta-Ur-Rahman, na; Choudhary, MI; Basha, FZ University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50512784 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50512784&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 16640796 440721366 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51254029 Clc1cccc(Cl)c1NC(=O)c1ccccc1Br InChI=1S/C13H8BrCl2NO/c14-9-5-2-1-4-8(9)13(18)17-12-10(15)6-3-7-11(12)16/h1-7H,(H,17,18) ANPIQKCKVWGLBA-UHFFFAOYSA-N 50512776 CHEMBL4471134 Cholinesterase 1100 ChEMBL 10.1016/j.bmc.2019.07.015 10.7270/Q2T72MTF 31378596 Wajid, S; Khatoon, A; Khan, MA; Zafar, H; Kanwal, S; Atta-Ur-Rahman, na; Choudhary, MI; Basha, FZ University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50512776 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50512776&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 4606170 440721358 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51254030 Clc1cccc(Cl)c1NC(=O)c1ccc(Br)cc1 InChI=1S/C13H8BrCl2NO/c14-9-6-4-8(5-7-9)13(18)17-12-10(15)2-1-3-11(12)16/h1-7H,(H,17,18) SIVQKMDMFKXZNV-UHFFFAOYSA-N 50512782 CHEMBL4462721 Cholinesterase 2600 ChEMBL 10.1016/j.bmc.2019.07.015 10.7270/Q2T72MTF 31378596 Wajid, S; Khatoon, A; Khan, MA; Zafar, H; Kanwal, S; Atta-Ur-Rahman, na; Choudhary, MI; Basha, FZ University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50512782 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50512782&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3631716 440721364 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51254032 COc1cccc(c1)C(=O)Nc1c(Cl)cccc1Cl InChI=1S/C14H11Cl2NO2/c1-19-10-5-2-4-9(8-10)14(18)17-13-11(15)6-3-7-12(13)16/h2-8H,1H3,(H,17,18) HWHWKIBZNCDDSK-UHFFFAOYSA-N 50512777 CHEMBL4470521 Cholinesterase 5500 ChEMBL 10.1016/j.bmc.2019.07.015 10.7270/Q2T72MTF 31378596 Wajid, S; Khatoon, A; Khan, MA; Zafar, H; Kanwal, S; Atta-Ur-Rahman, na; Choudhary, MI; Basha, FZ University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50512777 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50512777&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 803383 440721359 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51254033 Clc1cccc(Cl)c1NC(=O)c1ccccc1 InChI=1S/C13H9Cl2NO/c14-10-7-4-8-11(15)12(10)16-13(17)9-5-2-1-3-6-9/h1-8H,(H,16,17) KGDQECZKWWPUTK-UHFFFAOYSA-N 50512783 CHEMBL4536564 Cholinesterase 4400 ChEMBL 10.1016/j.bmc.2019.07.015 10.7270/Q2T72MTF 31378596 Wajid, S; Khatoon, A; Khan, MA; Zafar, H; Kanwal, S; Atta-Ur-Rahman, na; Choudhary, MI; Basha, FZ University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50512783 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50512783&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 853661 440721365 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51254035 COc1cc(cc(OC)c1OC)C(=O)Nc1c(Cl)cccc1Cl InChI=1S/C16H15Cl2NO4/c1-21-12-7-9(8-13(22-2)15(12)23-3)16(20)19-14-10(17)5-4-6-11(14)18/h4-8H,1-3H3,(H,19,20) SAPQVWMTQBMBKG-UHFFFAOYSA-N 50512780 CHEMBL4513971 Cholinesterase 23500 ChEMBL 10.1016/j.bmc.2019.07.015 10.7270/Q2T72MTF 31378596 Wajid, S; Khatoon, A; Khan, MA; Zafar, H; Kanwal, S; Atta-Ur-Rahman, na; Choudhary, MI; Basha, FZ University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50512780 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50512780&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 989628 440721362 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51254036 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 40830 ChEMBL 10.1016/j.bmc.2019.07.015 10.7270/Q2T72MTF 31378596 Wajid, S; Khatoon, A; Khan, MA; Zafar, H; Kanwal, S; Atta-Ur-Rahman, na; Choudhary, MI; Basha, FZ University of Karachi http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261746 C(Oc1cc(\C=N\c2c3CCCCc3nc3ccccc23)cc(OCc2ccccc2)c1OCc1ccccc1)c1ccccc1 InChI=1S/C41H36N2O3/c1-4-14-30(15-5-1)27-44-38-24-33(26-42-40-34-20-10-12-22-36(34)43-37-23-13-11-21-35(37)40)25-39(45-28-31-16-6-2-7-17-31)41(38)46-29-32-18-8-3-9-19-32/h1-10,12,14-20,22,24-26H,11,13,21,23,27-29H2/b42-26+ HDBAZFWZBQLTKR-OOWNWPBNSA-N 50515466 CHEMBL4534033 Cholinesterase 704 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515466 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515466&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155546931 440724048 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261749 C(Oc1ccc(\C=N\c2c3CCCCc3nc3ccccc23)cc1OCc1ccccc1)c1ccccc1 InChI=1S/C34H30N2O2/c1-3-11-25(12-4-1)23-37-32-20-19-27(21-33(32)38-24-26-13-5-2-6-14-26)22-35-34-28-15-7-9-17-30(28)36-31-18-10-8-16-29(31)34/h1-7,9,11-15,17,19-22H,8,10,16,18,23-24H2/b35-22+ RBCHVNJEMYCRCK-FADJLKOXSA-N 50515457 CHEMBL4560263 Cholinesterase 637 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515457 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515457&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155558672 440724039 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261750 C(Cc1ccc(OCc2ccccc2)cc1)Nc1c2CCCCc2nc2ccccc12 InChI=1S/C28H28N2O/c1-2-8-22(9-3-1)20-31-23-16-14-21(15-17-23)18-19-29-28-24-10-4-6-12-26(24)30-27-13-7-5-11-25(27)28/h1-4,6,8-10,12,14-17H,5,7,11,13,18-20H2,(H,29,30) AWWFDKCWBXMZRF-UHFFFAOYSA-N 50515472 CHEMBL4469822 Cholinesterase 1.1 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515472 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515472&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155534421 440724054 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51261754 C(CCNc1c2CCCCc2nc2ccccc12)CCOCCc1ccc(OCc2ccccc2)cc1 InChI=1S/C33H38N2O2/c1-3-11-27(12-4-1)25-37-28-19-17-26(18-20-28)21-24-36-23-10-2-9-22-34-33-29-13-5-7-15-31(29)35-32-16-8-6-14-30(32)33/h1,3-5,7,11-13,15,17-20H,2,6,8-10,14,16,21-25H2,(H,34,35) UHCNDWKIQWKBPR-UHFFFAOYSA-N 50515453 CHEMBL4588525 Cholinesterase 1.5 ChEMBL 10.1016/j.ejmech.2019.07.053 10.7270/Q23R0X60 31376562 Roldán-Peña, JM; Romero-Real, V; Hicke, J; Maya, I; Franconetti, A; Lagunes, I; Padrón, JM; Petralla, S; Poeta, E; Naldi, M; Bartolini, M; Monti, B; Bolognesi, ML; López, Ó; Fernández-Bolaños, JG Universidad de Sevilla http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50515453 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50515453&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155567205 440724035 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51265795 Cc1ccc(Cn2cc(COc3ccc4cc(C(=O)NC5CCN(Cc6ccccc6)CC5)c(=O)oc4c3)nn2)cc1C InChI=1S/C34H35N5O4/c1-23-8-9-26(16-24(23)2)20-39-21-29(36-37-39)22-42-30-11-10-27-17-31(34(41)43-32(27)18-30)33(40)35-28-12-14-38(15-13-28)19-25-6-4-3-5-7-25/h3-11,16-18,21,28H,12-15,19-20,22H2,1-2H3,(H,35,40) JUVIHJSWFPMOQR-UHFFFAOYSA-N 50516952 CHEMBL4465307 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.07.059 10.7270/Q22B92D9 31352246 Xu, M; Peng, Y; Zhu, L; Wang, S; Ji, J; Rakesh, KP Wuhan Institute of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50516952 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50516952&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155531125 440725534 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51265839 O=C(CCCCC1CCSS1)NCc1cn(CCCCOc2ccc(cc2)-c2cc3c(ccc4ccccc34)oc2=O)nn1 InChI=1S/C34H36N4O4S2/c39-33(10-4-2-8-28-17-20-43-44-28)35-22-26-23-38(37-36-26)18-5-6-19-41-27-14-11-25(12-15-27)30-21-31-29-9-3-1-7-24(29)13-16-32(31)42-34(30)40/h1,3,7,9,11-16,21,23,28H,2,4-6,8,10,17-20,22H2,(H,35,39) CTMWVMZGAHRITN-UHFFFAOYSA-N 50516954 CHEMBL4451075 Cholinesterase 68600 ChEMBL 10.1016/j.ejmech.2019.07.059 10.7270/Q22B92D9 31352246 Xu, M; Peng, Y; Zhu, L; Wang, S; Ji, J; Rakesh, KP Wuhan Institute of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50516954 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50516954&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155521555 440725536 C02051 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51255243 CCN1CCc2c(C1)c1ccccc1n2CCC(=O)N1c2ccccc2Sc2ccccc12 InChI=1S/C28H27N3OS/c1-2-29-17-15-23-21(19-29)20-9-3-4-10-22(20)30(23)18-16-28(32)31-24-11-5-7-13-26(24)33-27-14-8-6-12-25(27)31/h3-14H,2,15-19H2,1H3 KKVLXBBVHBRIJD-UHFFFAOYSA-N 50513226 CHEMBL4475303 Cholinesterase 520 ChEMBL 10.1016/j.ejmech.2019.05.020 10.7270/Q2KH0RNP 31103902 Zhang, P; Xu, S; Zhu, Z; Xu, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513226 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513226&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 129766223 440721808 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248288 Fc1cccc(C[n+]2cccc(Cn3nnc4ccccc4c3=O)c2)c1 InChI=1S/C20H16FN4O/c21-17-7-3-5-15(11-17)12-24-10-4-6-16(13-24)14-25-20(26)18-8-1-2-9-19(18)22-23-25/h1-11,13H,12,14H2/q+1 PABQBMOCJPFVNX-UHFFFAOYSA-N 50510669 CHEMBL4443099 Cholinesterase 27800 ChEMBL 10.1016/j.bmc.2019.05.023 10.7270/Q22F7RRB 31128990 Hosseini, F; Ramazani, A; Mohammadi-Khanaposhtani, M; Barazandeh Tehrani, M; Nadri, H; Larijani, B; Mahdavi, M University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50510669 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50510669&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155516375 440719251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248289 Fc1ccccc1C[n+]1ccc(Cn2nnc3ccccc3c2=O)cc1 InChI=1S/C20H16FN4O/c21-18-7-3-1-5-16(18)14-24-11-9-15(10-12-24)13-25-20(26)17-6-2-4-8-19(17)22-23-25/h1-12H,13-14H2/q+1 AVRKMNRKOMBWEE-UHFFFAOYSA-N 50510670 CHEMBL4439191 Cholinesterase 64600 ChEMBL 10.1016/j.bmc.2019.05.023 10.7270/Q22F7RRB 31128990 Hosseini, F; Ramazani, A; Mohammadi-Khanaposhtani, M; Barazandeh Tehrani, M; Nadri, H; Larijani, B; Mahdavi, M University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50510670 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50510670&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155513651 440719252 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248300 Cc1ccccc1C[n+]1cccc(Cn2nnc3ccccc3c2=O)c1 InChI=1S/C21H19N4O/c1-16-7-2-3-9-18(16)15-24-12-6-8-17(13-24)14-25-21(26)19-10-4-5-11-20(19)22-23-25/h2-13H,14-15H2,1H3/q+1 VOGRIZJNUSQYFT-UHFFFAOYSA-N 50510671 CHEMBL4440912 Cholinesterase 13700 ChEMBL 10.1016/j.bmc.2019.05.023 10.7270/Q22F7RRB 31128990 Hosseini, F; Ramazani, A; Mohammadi-Khanaposhtani, M; Barazandeh Tehrani, M; Nadri, H; Larijani, B; Mahdavi, M University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50510671 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50510671&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155514607 440719253 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248301 Fc1ccccc1C[n+]1cccc(Cn2nnc3ccccc3c2=O)c1 InChI=1S/C20H16FN4O/c21-18-9-3-1-7-16(18)14-24-11-5-6-15(12-24)13-25-20(26)17-8-2-4-10-19(17)22-23-25/h1-12H,13-14H2/q+1 JQDDPIXPQUVWPF-UHFFFAOYSA-N 50510672 CHEMBL4559010 Cholinesterase 23900 ChEMBL 10.1016/j.bmc.2019.05.023 10.7270/Q22F7RRB 31128990 Hosseini, F; Ramazani, A; Mohammadi-Khanaposhtani, M; Barazandeh Tehrani, M; Nadri, H; Larijani, B; Mahdavi, M University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50510672 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50510672&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155557433 440719254 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248302 Fc1ccc(C[n+]2cccc(Cn3nnc4ccccc4c3=O)c2)cc1 InChI=1S/C20H16FN4O/c21-17-9-7-15(8-10-17)12-24-11-3-4-16(13-24)14-25-20(26)18-5-1-2-6-19(18)22-23-25/h1-11,13H,12,14H2/q+1 KMFXRZYQEYDNCR-UHFFFAOYSA-N 50510673 CHEMBL4548038 Cholinesterase 23800 ChEMBL 10.1016/j.bmc.2019.05.023 10.7270/Q22F7RRB 31128990 Hosseini, F; Ramazani, A; Mohammadi-Khanaposhtani, M; Barazandeh Tehrani, M; Nadri, H; Larijani, B; Mahdavi, M University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50510673 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50510673&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155554034 440719255 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248303 Brc1ccccc1C[n+]1cccc(Cn2nnc3ccccc3c2=O)c1 InChI=1S/C20H16BrN4O/c21-18-9-3-1-7-16(18)14-24-11-5-6-15(12-24)13-25-20(26)17-8-2-4-10-19(17)22-23-25/h1-12H,13-14H2/q+1 BFAAZUZJIOIIRB-UHFFFAOYSA-N 50510680 CHEMBL4461642 Cholinesterase 16800 ChEMBL 10.1016/j.bmc.2019.05.023 10.7270/Q22F7RRB 31128990 Hosseini, F; Ramazani, A; Mohammadi-Khanaposhtani, M; Barazandeh Tehrani, M; Nadri, H; Larijani, B; Mahdavi, M University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50510680 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50510680&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155528507 440719262 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248304 Brc1ccc(C[n+]2cccc(Cn3nnc4ccccc4c3=O)c2)cc1 InChI=1S/C20H16BrN4O/c21-17-9-7-15(8-10-17)12-24-11-3-4-16(13-24)14-25-20(26)18-5-1-2-6-19(18)22-23-25/h1-11,13H,12,14H2/q+1 DIPWFQCDPUSMCR-UHFFFAOYSA-N 50510675 CHEMBL4546430 Cholinesterase 5800 ChEMBL 10.1016/j.bmc.2019.05.023 10.7270/Q22F7RRB 31128990 Hosseini, F; Ramazani, A; Mohammadi-Khanaposhtani, M; Barazandeh Tehrani, M; Nadri, H; Larijani, B; Mahdavi, M University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50510675 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50510675&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155552672 440719257 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248305 [O-][N+](=O)c1ccccc1C[n+]1cccc(Cn2nnc3ccccc3c2=O)c1 InChI=1S/C20H16N5O3/c26-20-17-8-2-3-9-18(17)21-22-24(20)13-15-6-5-11-23(12-15)14-16-7-1-4-10-19(16)25(27)28/h1-12H,13-14H2/q+1 CBUXCNMZBKLESE-UHFFFAOYSA-N 50510681 CHEMBL4451509 Cholinesterase 17500 ChEMBL 10.1016/j.bmc.2019.05.023 10.7270/Q22F7RRB 31128990 Hosseini, F; Ramazani, A; Mohammadi-Khanaposhtani, M; Barazandeh Tehrani, M; Nadri, H; Larijani, B; Mahdavi, M University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50510681 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50510681&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155522325 440719263 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248306 Fc1ccc(C[n+]2ccc(Cn3nnc4ccccc4c3=O)cc2)cc1 InChI=1S/C20H16FN4O/c21-17-7-5-15(6-8-17)13-24-11-9-16(10-12-24)14-25-20(26)18-3-1-2-4-19(18)22-23-25/h1-12H,13-14H2/q+1 YGRQNPPZSQKOEW-UHFFFAOYSA-N 50510678 CHEMBL4568874 Cholinesterase 70700 ChEMBL 10.1016/j.bmc.2019.05.023 10.7270/Q22F7RRB 31128990 Hosseini, F; Ramazani, A; Mohammadi-Khanaposhtani, M; Barazandeh Tehrani, M; Nadri, H; Larijani, B; Mahdavi, M University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50510678 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50510678&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155560237 440719260 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248307 Clc1ccccc1C[n+]1ccc(Cn2nnc3ccccc3c2=O)cc1 InChI=1S/C20H16ClN4O/c21-18-7-3-1-5-16(18)14-24-11-9-15(10-12-24)13-25-20(26)17-6-2-4-8-19(17)22-23-25/h1-12H,13-14H2/q+1 MCISKISQGWXSJM-UHFFFAOYSA-N 50510682 CHEMBL4447152 Cholinesterase 55000 ChEMBL 10.1016/j.bmc.2019.05.023 10.7270/Q22F7RRB 31128990 Hosseini, F; Ramazani, A; Mohammadi-Khanaposhtani, M; Barazandeh Tehrani, M; Nadri, H; Larijani, B; Mahdavi, M University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50510682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50510682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155519205 440719264 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248308 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 7200 ChEMBL 10.1016/j.bmc.2019.05.023 10.7270/Q22F7RRB 31128990 Hosseini, F; Ramazani, A; Mohammadi-Khanaposhtani, M; Barazandeh Tehrani, M; Nadri, H; Larijani, B; Mahdavi, M University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248311 Brc1ccc(C[n+]2ccc(Cn3nnc4ccccc4c3=O)cc2)cc1 InChI=1S/C20H16BrN4O/c21-17-7-5-15(6-8-17)13-24-11-9-16(10-12-24)14-25-20(26)18-3-1-2-4-19(18)22-23-25/h1-12H,13-14H2/q+1 GTSRXQTXGVJCAP-UHFFFAOYSA-N 50510679 CHEMBL4579652 Cholinesterase 51800 ChEMBL 10.1016/j.bmc.2019.05.023 10.7270/Q22F7RRB 31128990 Hosseini, F; Ramazani, A; Mohammadi-Khanaposhtani, M; Barazandeh Tehrani, M; Nadri, H; Larijani, B; Mahdavi, M University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50510679 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50510679&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155565327 440719261 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248316 O=c1n(Cc2ccc[n+](Cc3ccccc3)c2)nnc2ccccc12 InChI=1S/C20H17N4O/c25-20-18-10-4-5-11-19(18)21-22-24(20)15-17-9-6-12-23(14-17)13-16-7-2-1-3-8-16/h1-12,14H,13,15H2/q+1 WOLZUUPSUACOGH-UHFFFAOYSA-N 50510683 CHEMBL4537623 Cholinesterase 31200 ChEMBL 10.1016/j.bmc.2019.05.023 10.7270/Q22F7RRB 31128990 Hosseini, F; Ramazani, A; Mohammadi-Khanaposhtani, M; Barazandeh Tehrani, M; Nadri, H; Larijani, B; Mahdavi, M University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50510683 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50510683&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155548488 440719265 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248317 Clc1cccc(Cl)c1C[n+]1cccc(Cn2nnc3ccccc3c2=O)c1 InChI=1S/C20H15Cl2N4O/c21-17-7-3-8-18(22)16(17)13-25-10-4-5-14(11-25)12-26-20(27)15-6-1-2-9-19(15)23-24-26/h1-11H,12-13H2/q+1 FOTZUQGVQHWUOP-UHFFFAOYSA-N 50510684 CHEMBL4461261 Cholinesterase 21600 ChEMBL 10.1016/j.bmc.2019.05.023 10.7270/Q22F7RRB 31128990 Hosseini, F; Ramazani, A; Mohammadi-Khanaposhtani, M; Barazandeh Tehrani, M; Nadri, H; Larijani, B; Mahdavi, M University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50510684 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50510684&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155528286 440719266 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248318 [O-][N+](=O)c1ccc(C[n+]2cccc(Cn3nnc4ccccc4c3=O)c2)cc1 InChI=1S/C20H16N5O3/c26-20-18-5-1-2-6-19(18)21-22-24(20)14-16-4-3-11-23(13-16)12-15-7-9-17(10-8-15)25(27)28/h1-11,13H,12,14H2/q+1 ZAJSPLDRCKTCPW-UHFFFAOYSA-N 50510676 CHEMBL4470635 Cholinesterase 17200 ChEMBL 10.1016/j.bmc.2019.05.023 10.7270/Q22F7RRB 31128990 Hosseini, F; Ramazani, A; Mohammadi-Khanaposhtani, M; Barazandeh Tehrani, M; Nadri, H; Larijani, B; Mahdavi, M University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50510676 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50510676&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155534682 440719258 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248319 [O-][N+](=O)c1ccccc1C[n+]1ccc(Cn2nnc3ccccc3c2=O)cc1 InChI=1S/C20H16N5O3/c26-20-17-6-2-3-7-18(17)21-22-24(20)13-15-9-11-23(12-10-15)14-16-5-1-4-8-19(16)25(27)28/h1-12H,13-14H2/q+1 IPAFJSSJLYZZPQ-UHFFFAOYSA-N 50510685 CHEMBL4571446 Cholinesterase 18200 ChEMBL 10.1016/j.bmc.2019.05.023 10.7270/Q22F7RRB 31128990 Hosseini, F; Ramazani, A; Mohammadi-Khanaposhtani, M; Barazandeh Tehrani, M; Nadri, H; Larijani, B; Mahdavi, M University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50510685 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50510685&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155562981 440719267 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248321 O=c1n(Cc2cc[n+](Cc3ccccc3)cc2)nnc2ccccc12 InChI=1S/C20H17N4O/c25-20-18-8-4-5-9-19(18)21-22-24(20)15-17-10-12-23(13-11-17)14-16-6-2-1-3-7-16/h1-13H,14-15H2/q+1 NLGJTYWLSAKIEM-UHFFFAOYSA-N 50510677 CHEMBL4438204 Cholinesterase 75200 ChEMBL 10.1016/j.bmc.2019.05.023 10.7270/Q22F7RRB 31128990 Hosseini, F; Ramazani, A; Mohammadi-Khanaposhtani, M; Barazandeh Tehrani, M; Nadri, H; Larijani, B; Mahdavi, M University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50510677 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50510677&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155513161 440719259 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248323 Brc1cccc(C[n+]2cccc(Cn3nnc4ccccc4c3=O)c2)c1 InChI=1S/C20H16BrN4O/c21-17-7-3-5-15(11-17)12-24-10-4-6-16(13-24)14-25-20(26)18-8-1-2-9-19(18)22-23-25/h1-11,13H,12,14H2/q+1 OLLRLRVOEOJGFY-UHFFFAOYSA-N 50510674 CHEMBL4565865 Cholinesterase 14700 ChEMBL 10.1016/j.bmc.2019.05.023 10.7270/Q22F7RRB 31128990 Hosseini, F; Ramazani, A; Mohammadi-Khanaposhtani, M; Barazandeh Tehrani, M; Nadri, H; Larijani, B; Mahdavi, M University of Zanjan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50510674 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50510674&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155545310 440719256 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256920 Cc1ccc2n(c(CCN3C(=O)c4cccc5cccc(C3=O)c45)nc2c1)-c1ccncc1 InChI=1S/C27H20N4O2/c1-17-8-9-23-22(16-17)29-24(31(23)19-10-13-28-14-11-19)12-15-30-26(32)20-6-2-4-18-5-3-7-21(25(18)20)27(30)33/h2-11,13-14,16H,12,15H2,1H3 VFDVYUMIEWOVJX-UHFFFAOYSA-N 50513788 CHEMBL4558162 Cholinesterase >20000 ChEMBL 10.1021/acs.jmedchem.9b00224 10.7270/Q22B92CV 30888810 Huang, YY; Yu, YF; Zhang, C; Chen, Y; Zhou, Q; Li, Z; Zhou, S; Li, Z; Guo, L; Wu, D; Wu, Y; Luo, HB Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513788 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513788&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search AEL 6IJI 137700779 440722370 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248666 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 11 ChEMBL 10.1016/j.bmc.2019.01.025 10.7270/Q2N87F3N 30744931 Mishra, P; Kumar, A; Panda, G CSIR-Central Drug Research Institute http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248667 COc1cc(\C=C\C(=O)NCCNc2c3CCCCc3nc3ccccc23)ccc1OCc1ccccc1 InChI=1S/C32H33N3O3/c1-37-30-21-23(15-17-29(30)38-22-24-9-3-2-4-10-24)16-18-31(36)33-19-20-34-32-25-11-5-7-13-27(25)35-28-14-8-6-12-26(28)32/h2-5,7,9-11,13,15-18,21H,6,8,12,14,19-20,22H2,1H3,(H,33,36)(H,34,35)/b18-16+ VLBMEFQKZXFPCO-FBMGVBCBSA-N 50510836 CHEMBL4534662 Cholinesterase 53 ChEMBL 10.1016/j.bmc.2019.01.025 10.7270/Q2N87F3N 30744931 Mishra, P; Kumar, A; Panda, G CSIR-Central Drug Research Institute http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50510836 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50510836&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155547289 440719418 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248699 Oc1cccc2C(=O)c3cc(cc(O)c3C(=O)c12)C(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C34H33N3O5/c38-27-15-9-12-23-29(27)33(41)30-24(32(23)40)18-20(19-28(30)39)34(42)36-17-8-2-1-7-16-35-31-21-10-3-5-13-25(21)37-26-14-6-4-11-22(26)31/h3,5,9-10,12-13,15,18-19,38-39H,1-2,4,6-8,11,14,16-17H2,(H,35,37)(H,36,42) RGDHUSBWRVJIDQ-UHFFFAOYSA-N 50510851 CHEMBL4592066 Cholinesterase 200 ChEMBL 10.1016/j.bmc.2019.01.025 10.7270/Q2N87F3N 30744931 Mishra, P; Kumar, A; Panda, G CSIR-Central Drug Research Institute http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50510851 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50510851&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 102433391 440719433 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248700 CCCCCCN(C)C(=O)Oc1cccc(CC(C)N(C)CC#C)c1 InChI=1S/C21H32N2O2/c1-6-8-9-10-15-23(5)21(24)25-20-13-11-12-19(17-20)16-18(3)22(4)14-7-2/h2,11-13,17-18H,6,8-10,14-16H2,1,3-5H3 YNBUJXJHKVCTQX-UHFFFAOYSA-N 10826 3-{2-[methyl(prop-2-yn-1-yl)amino]propyl}phenyl N-hexyl-N-methylcarbamate::CHEMBL356385::Phenethylamine deriv. 53d Cholinesterase 720 ChEMBL 10.1016/j.bmc.2019.01.025 10.7270/Q2N87F3N 30744931 Mishra, P; Kumar, A; Panda, G CSIR-Central Drug Research Institute http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10826 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10826&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10382902 46511404 CHEMBL356385 ZINC13492350 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248712 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 11682 2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::Rivastigmine.tartrate::US9586925, Rivastigmine Cholinesterase 7720 ChEMBL 10.1016/j.bmc.2019.01.025 10.7270/Q2N87F3N 30744931 Mishra, P; Kumar, A; Panda, G CSIR-Central Drug Research Institute http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=11682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=11682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46512204 DB00989 C11766 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248735 CC(C(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccccc1 InChI=1S/C34H38FN3O/c1-24(26-19-20-27(30(35)23-26)25-13-5-4-6-14-25)34(39)37-22-12-3-2-11-21-36-33-28-15-7-9-17-31(28)38-32-18-10-8-16-29(32)33/h4-7,9,13-15,17,19-20,23-24H,2-3,8,10-12,16,18,21-22H2,1H3,(H,36,38)(H,37,39) LIUKBAIABYHLPL-UHFFFAOYSA-N 50433323 CHEMBL2376472 Cholinesterase 3.7 ChEMBL 10.1016/j.bmc.2019.01.025 10.7270/Q2N87F3N 30744931 Mishra, P; Kumar, A; Panda, G CSIR-Central Drug Research Institute http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433323 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433323&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72725538 175445640 CHEMBL2376472 ZINC96269489 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51248736 CC(C(=O)NCCCNc1c2CCCCc2nc2ccccc12)c1ccc(c(F)c1)-c1ccccc1 InChI=1S/C31H32FN3O/c1-21(23-16-17-24(27(32)20-23)22-10-3-2-4-11-22)31(36)34-19-9-18-33-30-25-12-5-7-14-28(25)35-29-15-8-6-13-26(29)30/h2-5,7,10-12,14,16-17,20-21H,6,8-9,13,15,18-19H2,1H3,(H,33,35)(H,34,36) PQPUUCJLTFZTCY-UHFFFAOYSA-N 50433930 CHEMBL2380613 Cholinesterase 14 ChEMBL 10.1016/j.bmc.2019.01.025 10.7270/Q2N87F3N 30744931 Mishra, P; Kumar, A; Panda, G CSIR-Central Drug Research Institute http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50433930 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50433930&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 72725486 175446247 CHEMBL2380613 ZINC96270079 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51229195 Oc1cc(OCCCN2CCCCC2)ccc1C(=O)\C=C\c1ccc(OCCCN2CCCCC2)cc1 InChI=1S/C31H42N2O4/c34-30(29-15-14-28(25-31(29)35)37-24-8-22-33-19-5-2-6-20-33)16-11-26-9-12-27(13-10-26)36-23-7-21-32-17-3-1-4-18-32/h9-16,25,35H,1-8,17-24H2/b16-11+ RIRAPRAROZJFMT-LFIBNONCSA-N 50504410 CHEMBL4461873 Cholinesterase 4100 ChEMBL 10.1016/j.ejmech.2019.111737 10.7270/Q24J0JCX 31581002 Bai, P; Wang, K; Zhang, P; Shi, J; Cheng, X; Zhang, Q; Zheng, C; Cheng, Y; Yang, J; Lu, X; Sang, Z Chinese Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50504410 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50504410&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155528915 440712995 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51229196 CCN(CC)CCCCCCOc1ccc(\C=C\C(=O)c2ccc(OCCCCCCN(CC)CC)cc2O)cc1 InChI=1S/C35H54N2O4/c1-5-36(6-2)25-13-9-11-15-27-40-31-20-17-30(18-21-31)19-24-34(38)33-23-22-32(29-35(33)39)41-28-16-12-10-14-26-37(7-3)8-4/h17-24,29,39H,5-16,25-28H2,1-4H3/b24-19+ SYWOSMAZYBMFGU-LYBHJNIJSA-N 50504411 CHEMBL4543178 Cholinesterase 4200 ChEMBL 10.1016/j.ejmech.2019.111737 10.7270/Q24J0JCX 31581002 Bai, P; Wang, K; Zhang, P; Shi, J; Cheng, X; Zhang, Q; Zheng, C; Cheng, Y; Yang, J; Lu, X; Sang, Z Chinese Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50504411 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50504411&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155510534 440712996 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51229210 CCN(CC)CCOc1ccc(\C=C\C(=O)c2ccc(OCCN(CC)CC)cc2O)cc1 InChI=1S/C27H38N2O4/c1-5-28(6-2)17-19-32-23-12-9-22(10-13-23)11-16-26(30)25-15-14-24(21-27(25)31)33-20-18-29(7-3)8-4/h9-16,21,31H,5-8,17-20H2,1-4H3/b16-11+ SKZQXYZAXPCLLM-LFIBNONCSA-N 50504421 CHEMBL4451613 Cholinesterase 5200 ChEMBL 10.1016/j.ejmech.2019.111737 10.7270/Q24J0JCX 31581002 Bai, P; Wang, K; Zhang, P; Shi, J; Cheng, X; Zhang, Q; Zheng, C; Cheng, Y; Yang, J; Lu, X; Sang, Z Chinese Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50504421 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50504421&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155522174 440713006 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51229211 Oc1cc(OCCCN2CCCC2)ccc1C(=O)\C=C\c1ccc(OCCCN2CCCC2)cc1 InChI=1S/C29H38N2O4/c32-28(27-13-12-26(23-29(27)33)35-22-6-20-31-17-3-4-18-31)14-9-24-7-10-25(11-8-24)34-21-5-19-30-15-1-2-16-30/h7-14,23,33H,1-6,15-22H2/b14-9+ IQPYZNCCRQXWJD-NTEUORMPSA-N 50504422 CHEMBL4466366 Cholinesterase 3800 ChEMBL 10.1016/j.ejmech.2019.111737 10.7270/Q24J0JCX 31581002 Bai, P; Wang, K; Zhang, P; Shi, J; Cheng, X; Zhang, Q; Zheng, C; Cheng, Y; Yang, J; Lu, X; Sang, Z Chinese Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50504422 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50504422&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155531484 440713007 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51229212 Oc1cc(OCCCCN2CCCCC2)ccc1C(=O)\C=C\c1ccc(OCCCCN2CCCCC2)cc1 InChI=1S/C33H46N2O4/c36-32(31-17-16-30(27-33(31)37)39-26-10-8-24-35-21-5-2-6-22-35)18-13-28-11-14-29(15-12-28)38-25-9-7-23-34-19-3-1-4-20-34/h11-18,27,37H,1-10,19-26H2/b18-13+ AYQQQEJLVLPUBT-QGOAFFKASA-N 50504417 CHEMBL4456071 Cholinesterase 3600 ChEMBL 10.1016/j.ejmech.2019.111737 10.7270/Q24J0JCX 31581002 Bai, P; Wang, K; Zhang, P; Shi, J; Cheng, X; Zhang, Q; Zheng, C; Cheng, Y; Yang, J; Lu, X; Sang, Z Chinese Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50504417 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50504417&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155525182 440713002 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51229213 Oc1cc(OCCCCN2CCCC2)ccc1C(=O)\C=C\c1ccc(OCCCCN2CCCC2)cc1 InChI=1S/C31H42N2O4/c34-30(29-15-14-28(25-31(29)35)37-24-8-6-22-33-19-3-4-20-33)16-11-26-9-12-27(13-10-26)36-23-7-5-21-32-17-1-2-18-32/h9-16,25,35H,1-8,17-24H2/b16-11+ JQWNQYXKQKIVRN-LFIBNONCSA-N 50504418 CHEMBL4437622 Cholinesterase 4500 ChEMBL 10.1016/j.ejmech.2019.111737 10.7270/Q24J0JCX 31581002 Bai, P; Wang, K; Zhang, P; Shi, J; Cheng, X; Zhang, Q; Zheng, C; Cheng, Y; Yang, J; Lu, X; Sang, Z Chinese Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50504418 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50504418&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155512624 440713003 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51229214 Oc1cc(OCCCCCCN2CCC(Cc3ccccc3)CC2)ccc1C(=O)\C=C\c1ccc(OCCCCCCN2CCC(Cc3ccccc3)CC2)cc1 InChI=1S/C51H66N2O4/c54-50(49-25-24-48(41-51(49)55)57-38-14-4-2-12-32-53-35-29-46(30-36-53)40-44-17-9-6-10-18-44)26-21-42-19-22-47(23-20-42)56-37-13-3-1-11-31-52-33-27-45(28-34-52)39-43-15-7-5-8-16-43/h5-10,15-26,41,45-46,55H,1-4,11-14,27-40H2/b26-21+ MKDOWBNPCPRMNI-YYADALCUSA-N 50504413 CHEMBL4552080 Cholinesterase 800 ChEMBL 10.1016/j.ejmech.2019.111737 10.7270/Q24J0JCX 31581002 Bai, P; Wang, K; Zhang, P; Shi, J; Cheng, X; Zhang, Q; Zheng, C; Cheng, Y; Yang, J; Lu, X; Sang, Z Chinese Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50504413 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50504413&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155555673 440712998 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51229215 Oc1cc(OCCCCCCN2CCCC2)ccc1C(=O)\C=C\c1ccc(OCCCCCCN2CCCC2)cc1 InChI=1S/C35H50N2O4/c38-34(33-19-18-32(29-35(33)39)41-28-12-4-2-6-22-37-25-9-10-26-37)20-15-30-13-16-31(17-14-30)40-27-11-3-1-5-21-36-23-7-8-24-36/h13-20,29,39H,1-12,21-28H2/b20-15+ HMJSYJOCHJOOKM-HMMYKYKNSA-N 50504419 CHEMBL4537240 Cholinesterase 1200 ChEMBL 10.1016/j.ejmech.2019.111737 10.7270/Q24J0JCX 31581002 Bai, P; Wang, K; Zhang, P; Shi, J; Cheng, X; Zhang, Q; Zheng, C; Cheng, Y; Yang, J; Lu, X; Sang, Z Chinese Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50504419 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50504419&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155548523 440713004 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51229216 Oc1ccccc1C(=O)\C=C\c1ccc(OCCCCCCN2CCCC2)cc1 InChI=1S/C25H31NO3/c27-24-10-4-3-9-23(24)25(28)16-13-21-11-14-22(15-12-21)29-20-8-2-1-5-17-26-18-6-7-19-26/h3-4,9-16,27H,1-2,5-8,17-20H2/b16-13+ QBQGJVIEKYYGBJ-DTQAZKPQSA-N 50504423 CHEMBL4443141 Cholinesterase 50200 ChEMBL 10.1016/j.ejmech.2019.111737 10.7270/Q24J0JCX 31581002 Bai, P; Wang, K; Zhang, P; Shi, J; Cheng, X; Zhang, Q; Zheng, C; Cheng, Y; Yang, J; Lu, X; Sang, Z Chinese Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50504423 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50504423&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155516433 440713008 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51229217 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 4760 ChEMBL 10.1016/j.ejmech.2019.111737 10.7270/Q24J0JCX 31581002 Bai, P; Wang, K; Zhang, P; Shi, J; Cheng, X; Zhang, Q; Zheng, C; Cheng, Y; Yang, J; Lu, X; Sang, Z Chinese Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51229238 CCN(CC)CCCCOc1ccc(\C=C\C(=O)c2ccc(OCCCCN(CC)CC)cc2O)cc1 InChI=1S/C31H46N2O4/c1-5-32(6-2)21-9-11-23-36-27-16-13-26(14-17-27)15-20-30(34)29-19-18-28(25-31(29)35)37-24-12-10-22-33(7-3)8-4/h13-20,25,35H,5-12,21-24H2,1-4H3/b20-15+ YXLQQCOCUUYTIW-HMMYKYKNSA-N 50504424 CHEMBL4454906 Cholinesterase 18500 ChEMBL 10.1016/j.ejmech.2019.111737 10.7270/Q24J0JCX 31581002 Bai, P; Wang, K; Zhang, P; Shi, J; Cheng, X; Zhang, Q; Zheng, C; Cheng, Y; Yang, J; Lu, X; Sang, Z Chinese Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50504424 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50504424&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155523992 440713009 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51229244 Oc1cc(OCCN2CCCC2)ccc1C(=O)\C=C\c1ccc(OCCN2CCCC2)cc1 InChI=1S/C27H34N2O4/c30-26(25-11-10-24(21-27(25)31)33-20-18-29-15-3-4-16-29)12-7-22-5-8-23(9-6-22)32-19-17-28-13-1-2-14-28/h5-12,21,31H,1-4,13-20H2/b12-7+ NNTGLGGIQCYAGA-KPKJPENVSA-N 50504412 CHEMBL4556096 Cholinesterase 6800 ChEMBL 10.1016/j.ejmech.2019.111737 10.7270/Q24J0JCX 31581002 Bai, P; Wang, K; Zhang, P; Shi, J; Cheng, X; Zhang, Q; Zheng, C; Cheng, Y; Yang, J; Lu, X; Sang, Z Chinese Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50504412 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50504412&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155556670 440712997 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51229245 CCN(CC)CCCOc1ccc(\C=C\C(=O)c2ccc(OCCCN(CC)CC)cc2O)cc1 InChI=1S/C29H42N2O4/c1-5-30(6-2)19-9-21-34-25-14-11-24(12-15-25)13-18-28(32)27-17-16-26(23-29(27)33)35-22-10-20-31(7-3)8-4/h11-18,23,33H,5-10,19-22H2,1-4H3/b18-13+ QIAWRNCGELMICX-QGOAFFKASA-N 50504416 CHEMBL4540199 Cholinesterase 5900 ChEMBL 10.1016/j.ejmech.2019.111737 10.7270/Q24J0JCX 31581002 Bai, P; Wang, K; Zhang, P; Shi, J; Cheng, X; Zhang, Q; Zheng, C; Cheng, Y; Yang, J; Lu, X; Sang, Z Chinese Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50504416 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50504416&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155550156 440713001 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51229246 Oc1cc(OCCCCCCN2CCCCC2)ccc1C(=O)\C=C\c1ccc(OCCCCCCN2CCCCC2)cc1 InChI=1S/C37H54N2O4/c40-36(35-21-20-34(31-37(35)41)43-30-14-4-2-8-24-39-27-11-6-12-28-39)22-17-32-15-18-33(19-16-32)42-29-13-3-1-7-23-38-25-9-5-10-26-38/h15-22,31,41H,1-14,23-30H2/b22-17+ NNTWFLMYYMLOEO-OQKWZONESA-N 50504426 CHEMBL4474824 Cholinesterase 3500 ChEMBL 10.1016/j.ejmech.2019.111737 10.7270/Q24J0JCX 31581002 Bai, P; Wang, K; Zhang, P; Shi, J; Cheng, X; Zhang, Q; Zheng, C; Cheng, Y; Yang, J; Lu, X; Sang, Z Chinese Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50504426 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50504426&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155537289 440713011 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51229255 Oc1cc(OCCCCCCN2CCCC2)ccc1C(=O)\C=C\c1ccccc1 InChI=1S/C25H31NO3/c27-24(15-12-21-10-4-3-5-11-21)23-14-13-22(20-25(23)28)29-19-9-2-1-6-16-26-17-7-8-18-26/h3-5,10-15,20,28H,1-2,6-9,16-19H2/b15-12+ RDXMXMFYYIGFGR-NTCAYCPXSA-N 50504420 CHEMBL4476091 Cholinesterase 12300 ChEMBL 10.1016/j.ejmech.2019.111737 10.7270/Q24J0JCX 31581002 Bai, P; Wang, K; Zhang, P; Shi, J; Cheng, X; Zhang, Q; Zheng, C; Cheng, Y; Yang, J; Lu, X; Sang, Z Chinese Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50504420 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50504420&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155538194 440713005 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51243627 C(COc1ccc2N=C3CCCN3Cc2c1)CN1CCCCC1 InChI=1S/C19H27N3O/c1-2-9-21(10-3-1)11-5-13-23-17-7-8-18-16(14-17)15-22-12-4-6-19(22)20-18/h7-8,14H,1-6,9-13,15H2 UVYNECUSQBZMSD-UHFFFAOYSA-N 50053435 CHEMBL3323035 Cholinesterase 8200 ChEMBL 10.1016/j.ejmech.2019.07.040 10.7270/Q2222Z25 31401465 Rodríguez-Soacha, DA; Scheiner, M; Decker, M Julius Maximilian University of W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053435 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053435&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710487 103950116 CHEMBL3323035 ZINC03815717 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51243633 O=c1n2CCCc2nc2ccc(OCCCN3CCCCC3)cc12 InChI=1S/C19H25N3O2/c23-19-16-14-15(24-13-5-11-21-9-2-1-3-10-21)7-8-17(16)20-18-6-4-12-22(18)19/h7-8,14H,1-6,9-13H2 FFIZZPFJAXHTDR-UHFFFAOYSA-N 50053441 CHEMBL3323053 Cholinesterase 248000 ChEMBL 10.1016/j.ejmech.2019.07.040 10.7270/Q2222Z25 31401465 Rodríguez-Soacha, DA; Scheiner, M; Decker, M Julius Maximilian University of W£rzburg http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053441 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053441&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710504 103950122 CHEMBL3323053 ZINC21289983 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51238204 Cc1c(C)c(=O)oc2cc(OCC3CCN(Cc4cccc(CO)c4)CC3)ccc12 InChI=1S/C25H29NO4/c1-17-18(2)25(28)30-24-13-22(6-7-23(17)24)29-16-19-8-10-26(11-9-19)14-20-4-3-5-21(12-20)15-27/h3-7,12-13,19,27H,8-11,14-16H2,1-2H3 AKHUHXLIAAFKEN-UHFFFAOYSA-N 50506793 CHEMBL4450045 Cholinesterase 1300 ChEMBL 10.1016/j.ejmech.2018.10.016 10.7270/Q2X351QR 30366255 Pisani, L; Iacobazzi, RM; Catto, M; Rullo, M; Farina, R; Denora, N; Cellamare, S; Altomare, CD Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50506793 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50506793&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155521356 440715378 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51238240 CN(C)Cc1cc(=O)oc2cc(OCc3ccc(CO)cc3)ccc12 InChI=1S/C20H21NO4/c1-21(2)11-16-9-20(23)25-19-10-17(7-8-18(16)19)24-13-15-5-3-14(12-22)4-6-15/h3-10,22H,11-13H2,1-2H3 KHKOKABORMZOQA-UHFFFAOYSA-N 50506802 CHEMBL4514364 Cholinesterase 11000 ChEMBL 10.1016/j.ejmech.2018.10.016 10.7270/Q2X351QR 30366255 Pisani, L; Iacobazzi, RM; Catto, M; Rullo, M; Farina, R; Denora, N; Cellamare, S; Altomare, CD Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50506802 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50506802&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155539285 440715387 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51238241 Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccc(CO)cc4)C3)ccc12 InChI=1S/C25H29NO4/c1-17-18(2)25(28)30-24-12-22(9-10-23(17)24)29-16-21-4-3-11-26(14-21)13-19-5-7-20(15-27)8-6-19/h5-10,12,21,27H,3-4,11,13-16H2,1-2H3 BXCUGXRKJOGSPH-UHFFFAOYSA-N 50506806 CHEMBL4450310 Cholinesterase 8600 ChEMBL 10.1016/j.ejmech.2018.10.016 10.7270/Q2X351QR 30366255 Pisani, L; Iacobazzi, RM; Catto, M; Rullo, M; Farina, R; Denora, N; Cellamare, S; Altomare, CD Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50506806 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50506806&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155520953 440715391 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51238242 Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4cccc(CO)c4)C3)ccc12 InChI=1S/C25H29NO4/c1-17-18(2)25(28)30-24-12-22(8-9-23(17)24)29-16-21-7-4-10-26(14-21)13-19-5-3-6-20(11-19)15-27/h3,5-6,8-9,11-12,21,27H,4,7,10,13-16H2,1-2H3 JFAXGIYNMLALLU-UHFFFAOYSA-N 50506796 CHEMBL4551962 Cholinesterase 2700 ChEMBL 10.1016/j.ejmech.2018.10.016 10.7270/Q2X351QR 30366255 Pisani, L; Iacobazzi, RM; Catto, M; Rullo, M; Farina, R; Denora, N; Cellamare, S; Altomare, CD Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50506796 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50506796&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155555466 440715381 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51238243 Cc1c(C)c(=O)oc2cc(OCC3CCN(Cc4ccc(CO)cc4)CC3)ccc12 InChI=1S/C25H29NO4/c1-17-18(2)25(28)30-24-13-22(7-8-23(17)24)29-16-21-9-11-26(12-10-21)14-19-3-5-20(15-27)6-4-19/h3-8,13,21,27H,9-12,14-16H2,1-2H3 XRVUZLMXGJXDEZ-UHFFFAOYSA-N 50506798 CHEMBL4580662 Cholinesterase 8800 ChEMBL 10.1016/j.ejmech.2018.10.016 10.7270/Q2X351QR 30366255 Pisani, L; Iacobazzi, RM; Catto, M; Rullo, M; Farina, R; Denora, N; Cellamare, S; Altomare, CD Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50506798 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50506798&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155561569 440715383 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51238244 Cc1cc2ccc(OCC3CCN(Cc4ccc(CO)cc4)CC3)cc2oc1=O InChI=1S/C24H27NO4/c1-17-12-21-6-7-22(13-23(21)29-24(17)27)28-16-20-8-10-25(11-9-20)14-18-2-4-19(15-26)5-3-18/h2-7,12-13,20,26H,8-11,14-16H2,1H3 DLNHNGYHCSSOLK-UHFFFAOYSA-N 50506792 CHEMBL4586509 Cholinesterase 8100 ChEMBL 10.1016/j.ejmech.2018.10.016 10.7270/Q2X351QR 30366255 Pisani, L; Iacobazzi, RM; Catto, M; Rullo, M; Farina, R; Denora, N; Cellamare, S; Altomare, CD Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50506792 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50506792&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155566969 440715377 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51238245 Cc1c(C)c(=O)oc2cc(OCC3CCN(Cc4cccc(OCCCO)c4)CC3)ccc12 InChI=1S/C27H33NO5/c1-19-20(2)27(30)33-26-16-24(7-8-25(19)26)32-18-21-9-11-28(12-10-21)17-22-5-3-6-23(15-22)31-14-4-13-29/h3,5-8,15-16,21,29H,4,9-14,17-18H2,1-2H3 QLFPNOYDCBXGNI-UHFFFAOYSA-N 50506807 CHEMBL4470448 Cholinesterase 180 ChEMBL 10.1016/j.ejmech.2018.10.016 10.7270/Q2X351QR 30366255 Pisani, L; Iacobazzi, RM; Catto, M; Rullo, M; Farina, R; Denora, N; Cellamare, S; Altomare, CD Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50506807 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50506807&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155534304 440715392 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51238255 Cc1c(C)c(=O)oc2cc(OCc3cccc(CN4CCC(CO)CC4)c3)ccc12 InChI=1S/C25H29NO4/c1-17-18(2)25(28)30-24-13-22(6-7-23(17)24)29-16-21-5-3-4-20(12-21)14-26-10-8-19(15-27)9-11-26/h3-7,12-13,19,27H,8-11,14-16H2,1-2H3 AJYQNGRAUDTCMC-UHFFFAOYSA-N 50506805 CHEMBL4444006 Cholinesterase 1000 ChEMBL 10.1016/j.ejmech.2018.10.016 10.7270/Q2X351QR 30366255 Pisani, L; Iacobazzi, RM; Catto, M; Rullo, M; Farina, R; Denora, N; Cellamare, S; Altomare, CD Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50506805 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50506805&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155517252 440715390 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51238256 Cc1cc2ccc(OCC3CCN(Cc4cccc(CO)c4)CC3)cc2oc1=O InChI=1S/C24H27NO4/c1-17-11-21-5-6-22(13-23(21)29-24(17)27)28-16-18-7-9-25(10-8-18)14-19-3-2-4-20(12-19)15-26/h2-6,11-13,18,26H,7-10,14-16H2,1H3 IUWHHNQVLYBBQI-UHFFFAOYSA-N 50506801 CHEMBL4529750 Cholinesterase 910 ChEMBL 10.1016/j.ejmech.2018.10.016 10.7270/Q2X351QR 30366255 Pisani, L; Iacobazzi, RM; Catto, M; Rullo, M; Farina, R; Denora, N; Cellamare, S; Altomare, CD Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50506801 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50506801&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155545663 440715386 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51238259 OCCCN1CCCC(COc2ccc3ccc(=O)oc3c2)C1 InChI=1S/C18H23NO4/c20-10-2-9-19-8-1-3-14(12-19)13-22-16-6-4-15-5-7-18(21)23-17(15)11-16/h4-7,11,14,20H,1-3,8-10,12-13H2 RNMXKJQESIXQCJ-UHFFFAOYSA-N 50506812 CHEMBL4557045 Cholinesterase 1700 ChEMBL 10.1016/j.ejmech.2018.10.016 10.7270/Q2X351QR 30366255 Pisani, L; Iacobazzi, RM; Catto, M; Rullo, M; Farina, R; Denora, N; Cellamare, S; Altomare, CD Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50506812 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50506812&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155557275 440715397 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51238274 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 2100 ChEMBL 10.1016/j.ejmech.2018.10.016 10.7270/Q2X351QR 30366255 Pisani, L; Iacobazzi, RM; Catto, M; Rullo, M; Farina, R; Denora, N; Cellamare, S; Altomare, CD Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51238275 Cc1cc(=O)oc2cc(OCC3CCN(Cc4cccc(CO)c4)CC3)ccc12 InChI=1S/C24H27NO4/c1-17-11-24(27)29-23-13-21(5-6-22(17)23)28-16-18-7-9-25(10-8-18)14-19-3-2-4-20(12-19)15-26/h2-6,11-13,18,26H,7-10,14-16H2,1H3 XLMQLJNHGAXCAD-UHFFFAOYSA-N 50506800 CHEMBL4468552 Cholinesterase 1900 ChEMBL 10.1016/j.ejmech.2018.10.016 10.7270/Q2X351QR 30366255 Pisani, L; Iacobazzi, RM; Catto, M; Rullo, M; Farina, R; Denora, N; Cellamare, S; Altomare, CD Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50506800 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50506800&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155533456 440715385 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51238276 Cc1c(C)c(=O)oc2cc(OCC3CCN(CCCCO)CC3)ccc12 InChI=1S/C21H29NO4/c1-15-16(2)21(24)26-20-13-18(5-6-19(15)20)25-14-17-7-10-22(11-8-17)9-3-4-12-23/h5-6,13,17,23H,3-4,7-12,14H2,1-2H3 VTPAGWWPFBCDCN-UHFFFAOYSA-N 50506797 CHEMBL4580963 Cholinesterase 8300 ChEMBL 10.1016/j.ejmech.2018.10.016 10.7270/Q2X351QR 30366255 Pisani, L; Iacobazzi, RM; Catto, M; Rullo, M; Farina, R; Denora, N; Cellamare, S; Altomare, CD Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50506797 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50506797&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155561583 440715382 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51255593 FC(F)(F)Oc1ccccc1S(=O)(=O)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 InChI=1S/C25H17F3N4O4S/c26-25(27,28)36-20-7-3-4-8-21(20)37(34,35)31-14-9-10-19-17(13-14)24(33)32-12-11-16-15-5-1-2-6-18(15)29-22(16)23(32)30-19/h1-10,13,29,31H,11-12H2 XWMBPUDHCGXOCU-UHFFFAOYSA-N 50513297 CHEMBL4473175 Cholinesterase 3600 ChEMBL 10.1016/j.ejmech.2019.05.055 10.7270/Q2P84G71 31136894 Wu, M; Ma, J; Ji, L; Wang, M; Han, J; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513297 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513297&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155536453 440721879 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51255596 COc1ccc(cc1OC)S(=O)(=O)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 InChI=1S/C26H22N4O5S/c1-34-22-10-8-16(14-23(22)35-2)36(32,33)29-15-7-9-21-19(13-15)26(31)30-12-11-18-17-5-3-4-6-20(17)27-24(18)25(30)28-21/h3-10,13-14,27,29H,11-12H2,1-2H3 DFHSEXDIDQFXEW-UHFFFAOYSA-N 50513300 CHEMBL4550345 Cholinesterase 10900 ChEMBL 10.1016/j.ejmech.2019.05.055 10.7270/Q2P84G71 31136894 Wu, M; Ma, J; Ji, L; Wang, M; Han, J; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513300 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513300&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155555146 440721882 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51255610 COc1ccc(cc1)S(=O)(=O)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 InChI=1S/C25H20N4O4S/c1-33-16-7-9-17(10-8-16)34(31,32)28-15-6-11-22-20(14-15)25(30)29-13-12-19-18-4-2-3-5-21(18)26-23(19)24(29)27-22/h2-11,14,26,28H,12-13H2,1H3 JIQQBJVRKKCFHK-UHFFFAOYSA-N 50513301 CHEMBL4591776 Cholinesterase 8010 ChEMBL 10.1016/j.ejmech.2019.05.055 10.7270/Q2P84G71 31136894 Wu, M; Ma, J; Ji, L; Wang, M; Han, J; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513301 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513301&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155568389 440721883 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51255611 COc1ccc(c(OC)c1)S(=O)(=O)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 InChI=1S/C26H22N4O5S/c1-34-16-8-10-23(22(14-16)35-2)36(32,33)29-15-7-9-21-19(13-15)26(31)30-12-11-18-17-5-3-4-6-20(17)27-24(18)25(30)28-21/h3-10,13-14,27,29H,11-12H2,1-2H3 JRLCTCNKQQZBID-UHFFFAOYSA-N 50513309 CHEMBL4437151 Cholinesterase 7580 ChEMBL 10.1016/j.ejmech.2019.05.055 10.7270/Q2P84G71 31136894 Wu, M; Ma, J; Ji, L; Wang, M; Han, J; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513309 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513309&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155512297 440721891 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51255612 Brc1ccc(cc1)S(=O)(=O)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 InChI=1S/C24H17BrN4O3S/c25-14-5-8-16(9-6-14)33(31,32)28-15-7-10-21-19(13-15)24(30)29-12-11-18-17-3-1-2-4-20(17)26-22(18)23(29)27-21/h1-10,13,26,28H,11-12H2 WIQIORLBRBKPJO-UHFFFAOYSA-N 50513298 CHEMBL4441851 Cholinesterase 8940 ChEMBL 10.1016/j.ejmech.2019.05.055 10.7270/Q2P84G71 31136894 Wu, M; Ma, J; Ji, L; Wang, M; Han, J; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513298 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513298&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155515402 440721880 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51255613 Clc1cccc(Cl)c1S(=O)(=O)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 InChI=1S/C24H16Cl2N4O3S/c25-17-5-3-6-18(26)22(17)34(32,33)29-13-8-9-20-16(12-13)24(31)30-11-10-15-14-4-1-2-7-19(14)27-21(15)23(30)28-20/h1-9,12,27,29H,10-11H2 ARXSMVFGKQFVAL-UHFFFAOYSA-N 50513303 CHEMBL4459390 Cholinesterase 13650 ChEMBL 10.1016/j.ejmech.2019.05.055 10.7270/Q2P84G71 31136894 Wu, M; Ma, J; Ji, L; Wang, M; Han, J; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513303 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513303&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155526428 440721885 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51255614 Fc1ccc(cc1Cl)S(=O)(=O)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 InChI=1S/C24H16ClFN4O3S/c25-18-12-14(6-7-19(18)26)34(32,33)29-13-5-8-21-17(11-13)24(31)30-10-9-16-15-3-1-2-4-20(15)27-22(16)23(30)28-21/h1-8,11-12,27,29H,9-10H2 ZPMMAAQKZOICJO-UHFFFAOYSA-N 50513310 CHEMBL4454279 Cholinesterase 4630 ChEMBL 10.1016/j.ejmech.2019.05.055 10.7270/Q2P84G71 31136894 Wu, M; Ma, J; Ji, L; Wang, M; Han, J; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513310 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513310&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155524245 440721892 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51255615 Fc1ccc(cc1)S(=O)(=O)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 InChI=1S/C24H17FN4O3S/c25-14-5-8-16(9-6-14)33(31,32)28-15-7-10-21-19(13-15)24(30)29-12-11-18-17-3-1-2-4-20(17)26-22(18)23(29)27-21/h1-10,13,26,28H,11-12H2 HNJGIINTXRYWAS-UHFFFAOYSA-N 50513305 CHEMBL4582454 Cholinesterase 7570 ChEMBL 10.1016/j.ejmech.2019.05.055 10.7270/Q2P84G71 31136894 Wu, M; Ma, J; Ji, L; Wang, M; Han, J; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513305 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513305&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155561819 440721887 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51255616 FC(F)(F)c1cccc(c1)S(=O)(=O)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 InChI=1S/C25H17F3N4O3S/c26-25(27,28)14-4-3-5-16(12-14)36(34,35)31-15-8-9-21-19(13-15)24(33)32-11-10-18-17-6-1-2-7-20(17)29-22(18)23(32)30-21/h1-9,12-13,29,31H,10-11H2 FZMOQTFNQLFLQO-UHFFFAOYSA-N 50513311 CHEMBL4522998 Cholinesterase 3820 ChEMBL 10.1016/j.ejmech.2019.05.055 10.7270/Q2P84G71 31136894 Wu, M; Ma, J; Ji, L; Wang, M; Han, J; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513311 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513311&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155543856 440721893 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51255617 FC(F)(F)Oc1ccc(cc1)S(=O)(=O)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 InChI=1S/C25H17F3N4O4S/c26-25(27,28)36-15-6-8-16(9-7-15)37(34,35)31-14-5-10-21-19(13-14)24(33)32-12-11-18-17-3-1-2-4-20(17)29-22(18)23(32)30-21/h1-10,13,29,31H,11-12H2 BBRZYCJZLDRBRK-UHFFFAOYSA-N 50513312 CHEMBL4448097 Cholinesterase 3950 ChEMBL 10.1016/j.ejmech.2019.05.055 10.7270/Q2P84G71 31136894 Wu, M; Ma, J; Ji, L; Wang, M; Han, J; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513312 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513312&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155519531 440721894 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51255618 O=c1n2CCc3c([nH]c4ccccc34)-c2nc2ccc(NS(=O)(=O)c3cccs3)cc12 InChI=1S/C22H16N4O3S2/c27-22-16-12-13(25-31(28,29)19-6-3-11-30-19)7-8-18(16)24-21-20-15(9-10-26(21)22)14-4-1-2-5-17(14)23-20/h1-8,11-12,23,25H,9-10H2 IVTSXZIEAIDDHD-UHFFFAOYSA-N 50513299 CHEMBL4521333 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.05.055 10.7270/Q2P84G71 31136894 Wu, M; Ma, J; Ji, L; Wang, M; Han, J; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513299 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513299&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155542465 440721881 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51255619 Brc1ccc(s1)S(=O)(=O)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 InChI=1S/C22H15BrN4O3S2/c23-18-7-8-19(31-18)32(29,30)26-12-5-6-17-15(11-12)22(28)27-10-9-14-13-3-1-2-4-16(13)24-20(14)21(27)25-17/h1-8,11,24,26H,9-10H2 FIOXKODPLXWXKH-UHFFFAOYSA-N 50513313 CHEMBL4464161 Cholinesterase 60340 ChEMBL 10.1016/j.ejmech.2019.05.055 10.7270/Q2P84G71 31136894 Wu, M; Ma, J; Ji, L; Wang, M; Han, J; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513313 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513313&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155530098 440721895 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51255620 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 40 ChEMBL 10.1016/j.ejmech.2019.05.055 10.7270/Q2P84G71 31136894 Wu, M; Ma, J; Ji, L; Wang, M; Han, J; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51255625 O=c1n2CCc3c([nH]c4ccccc34)-c2nc2ccccc12 InChI=1S/C18H13N3O/c22-18-13-6-2-4-8-15(13)20-17-16-12(9-10-21(17)18)11-5-1-3-7-14(11)19-16/h1-8,19H,9-10H2 ACVGWSKVRYFWRP-UHFFFAOYSA-N 50131046 8,13-Dihydro-7H-indolo[2',3':3,4]pyrido[2,1-b]quinazolin-5-one::CHEMBL85139::cid_65752::rutaecarpine Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.05.055 10.7270/Q2P84G71 31136894 Wu, M; Ma, J; Ji, L; Wang, M; Han, J; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50131046 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50131046&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 65752 104022288 CHEMBL85139 C09238 ZINC00898237 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51255626 [O-][N+](=O)c1ccc(cc1)S(=O)(=O)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 InChI=1S/C24H17N5O5S/c30-24-19-13-14(27-35(33,34)16-8-6-15(7-9-16)29(31)32)5-10-21(19)26-23-22-18(11-12-28(23)24)17-3-1-2-4-20(17)25-22/h1-10,13,25,27H,11-12H2 YDAQUJGTXJONTG-UHFFFAOYSA-N 50513314 CHEMBL4436795 Cholinesterase 16510 ChEMBL 10.1016/j.ejmech.2019.05.055 10.7270/Q2P84G71 31136894 Wu, M; Ma, J; Ji, L; Wang, M; Han, J; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513314 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513314&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155512094 440721896 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51255627 CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 InChI=1S/C28H26N4O3S/c1-28(2,3)17-8-11-19(12-9-17)36(34,35)31-18-10-13-24-22(16-18)27(33)32-15-14-21-20-6-4-5-7-23(20)29-25(21)26(32)30-24/h4-13,16,29,31H,14-15H2,1-3H3 NJTXKAAPBQZLGT-UHFFFAOYSA-N 50513304 CHEMBL4460059 Cholinesterase 12950 ChEMBL 10.1016/j.ejmech.2019.05.055 10.7270/Q2P84G71 31136894 Wu, M; Ma, J; Ji, L; Wang, M; Han, J; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513304 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513304&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155527278 440721886 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51255628 CC(=O)c1ccc(cc1)S(=O)(=O)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 InChI=1S/C26H20N4O4S/c1-15(31)16-6-9-18(10-7-16)35(33,34)29-17-8-11-23-21(14-17)26(32)30-13-12-20-19-4-2-3-5-22(19)27-24(20)25(30)28-23/h2-11,14,27,29H,12-13H2,1H3 MMAYFDARSFNYIY-UHFFFAOYSA-N 50513307 CHEMBL4473904 Cholinesterase 25780 ChEMBL 10.1016/j.ejmech.2019.05.055 10.7270/Q2P84G71 31136894 Wu, M; Ma, J; Ji, L; Wang, M; Han, J; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513307 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513307&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155536654 440721889 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51255629 COC(=O)c1sccc1S(=O)(=O)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 InChI=1S/C24H18N4O5S2/c1-33-24(30)21-19(9-11-34-21)35(31,32)27-13-6-7-18-16(12-13)23(29)28-10-8-15-14-4-2-3-5-17(14)25-20(15)22(28)26-18/h2-7,9,11-12,25,27H,8,10H2,1H3 QHRULMJXLCIOFX-UHFFFAOYSA-N 50513308 CHEMBL4456450 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.05.055 10.7270/Q2P84G71 31136894 Wu, M; Ma, J; Ji, L; Wang, M; Han, J; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513308 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513308&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155524452 440721890 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51255632 Clc1cc(Cl)cc(c1)S(=O)(=O)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 InChI=1S/C24H16Cl2N4O3S/c25-13-9-14(26)11-16(10-13)34(32,33)29-15-5-6-21-19(12-15)24(31)30-8-7-18-17-3-1-2-4-20(17)27-22(18)23(30)28-21/h1-6,9-12,27,29H,7-8H2 ICHXBMLANDAMGM-UHFFFAOYSA-N 50513316 CHEMBL4564374 Cholinesterase 7940 ChEMBL 10.1016/j.ejmech.2019.05.055 10.7270/Q2P84G71 31136894 Wu, M; Ma, J; Ji, L; Wang, M; Han, J; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513316 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513316&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155560105 440721898 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51255633 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 7870 ChEMBL 10.1016/j.ejmech.2019.05.055 10.7270/Q2P84G71 31136894 Wu, M; Ma, J; Ji, L; Wang, M; Han, J; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51255635 [O-][N+](=O)c1cccc(c1)S(=O)(=O)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 InChI=1S/C24H17N5O5S/c30-24-19-12-14(27-35(33,34)16-5-3-4-15(13-16)29(31)32)8-9-21(19)26-23-22-18(10-11-28(23)24)17-6-1-2-7-20(17)25-22/h1-9,12-13,25,27H,10-11H2 ASWBYVBBRXIETI-UHFFFAOYSA-N 50513302 CHEMBL4457225 Cholinesterase 23320 ChEMBL 10.1016/j.ejmech.2019.05.055 10.7270/Q2P84G71 31136894 Wu, M; Ma, J; Ji, L; Wang, M; Han, J; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513302 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513302&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155526250 440721884 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51255637 Clc1ccc(s1)S(=O)(=O)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 InChI=1S/C22H15ClN4O3S2/c23-18-7-8-19(31-18)32(29,30)26-12-5-6-17-15(11-12)22(28)27-10-9-14-13-3-1-2-4-16(13)24-20(14)21(27)25-17/h1-8,11,24,26H,9-10H2 XBSWKXPWDFPGBG-UHFFFAOYSA-N 50513315 CHEMBL4467089 Cholinesterase 76930 ChEMBL 10.1016/j.ejmech.2019.05.055 10.7270/Q2P84G71 31136894 Wu, M; Ma, J; Ji, L; Wang, M; Han, J; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513315 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513315&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155532096 440721897 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51255638 FC(F)(F)c1ccc(cc1)S(=O)(=O)Nc1ccc2nc3-c4[nH]c5ccccc5c4CCn3c(=O)c2c1 InChI=1S/C25H17F3N4O3S/c26-25(27,28)14-5-8-16(9-6-14)36(34,35)31-15-7-10-21-19(13-15)24(33)32-12-11-18-17-3-1-2-4-20(17)29-22(18)23(32)30-21/h1-10,13,29,31H,11-12H2 GSJKDHDEEMJQDD-UHFFFAOYSA-N 50513306 CHEMBL4548040 Cholinesterase 8280 ChEMBL 10.1016/j.ejmech.2019.05.055 10.7270/Q2P84G71 31136894 Wu, M; Ma, J; Ji, L; Wang, M; Han, J; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513306 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513306&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155554035 440721888 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256718 COc1cc2Cc3sc(NC(=O)C4CCN(Cc5ccccc5)CC4)nc3-c2cc1OC InChI=1S/C25H27N3O3S/c1-30-20-12-18-13-22-23(19(18)14-21(20)31-2)26-25(32-22)27-24(29)17-8-10-28(11-9-17)15-16-6-4-3-5-7-16/h3-7,12,14,17H,8-11,13,15H2,1-2H3,(H,26,27,29) CDJTVXPWJGTXSN-UHFFFAOYSA-N 50513701 CHEMBL4434663 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.06.088 10.7270/Q2ZK5M1Z 31280020 van Greunen, DG; Johan van der Westhuizen, C; Cordier, W; Nell, M; Stander, A; Steenkamp, V; Panayides, JL; Riley, DL University of Pretoria http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513701 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513701&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155510808 440722283 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256719 O=C(Nc1nccs1)C1CCN(Cc2ccccc2)CC1 InChI=1S/C16H19N3OS/c20-15(18-16-17-8-11-21-16)14-6-9-19(10-7-14)12-13-4-2-1-3-5-13/h1-5,8,11,14H,6-7,9-10,12H2,(H,17,18,20) IGLSOIZXSPXUHP-UHFFFAOYSA-N 50513702 CHEMBL4436831 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.06.088 10.7270/Q2ZK5M1Z 31280020 van Greunen, DG; Johan van der Westhuizen, C; Cordier, W; Nell, M; Stander, A; Steenkamp, V; Panayides, JL; Riley, DL University of Pretoria http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513702 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513702&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155512155 440722284 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256722 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 5200 ChEMBL 10.1016/j.ejmech.2019.06.088 10.7270/Q2ZK5M1Z 31280020 van Greunen, DG; Johan van der Westhuizen, C; Cordier, W; Nell, M; Stander, A; Steenkamp, V; Panayides, JL; Riley, DL University of Pretoria http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256723 O=C(NCCc1c[nH]cn1)C1CCN(Cc2ccccc2)CC1 InChI=1S/C18H24N4O/c23-18(20-9-6-17-12-19-14-21-17)16-7-10-22(11-8-16)13-15-4-2-1-3-5-15/h1-5,12,14,16H,6-11,13H2,(H,19,21)(H,20,23) LXWMAULZMMTAPF-UHFFFAOYSA-N 50513705 CHEMBL4515497 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.06.088 10.7270/Q2ZK5M1Z 31280020 van Greunen, DG; Johan van der Westhuizen, C; Cordier, W; Nell, M; Stander, A; Steenkamp, V; Panayides, JL; Riley, DL University of Pretoria http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513705 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513705&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155539999 440722287 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256724 O=C(NCc1ccco1)C1CCN(Cc2ccccc2)CC1 InChI=1S/C18H22N2O2/c21-18(19-13-17-7-4-12-22-17)16-8-10-20(11-9-16)14-15-5-2-1-3-6-15/h1-7,12,16H,8-11,13-14H2,(H,19,21) XQOXORDWUICBCW-UHFFFAOYSA-N 50513706 CHEMBL4564197 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.06.088 10.7270/Q2ZK5M1Z 31280020 van Greunen, DG; Johan van der Westhuizen, C; Cordier, W; Nell, M; Stander, A; Steenkamp, V; Panayides, JL; Riley, DL University of Pretoria http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513706 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513706&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3276723 440722288 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256725 O=C(NCc1cccnc1)C1CCN(Cc2ccccc2)CC1 InChI=1S/C19H23N3O/c23-19(21-14-17-7-4-10-20-13-17)18-8-11-22(12-9-18)15-16-5-2-1-3-6-16/h1-7,10,13,18H,8-9,11-12,14-15H2,(H,21,23) LCCWWQQATKKNKK-UHFFFAOYSA-N 50513707 CHEMBL4546728 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.06.088 10.7270/Q2ZK5M1Z 31280020 van Greunen, DG; Johan van der Westhuizen, C; Cordier, W; Nell, M; Stander, A; Steenkamp, V; Panayides, JL; Riley, DL University of Pretoria http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513707 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513707&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3404052 440722289 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256726 O=C(NCc1ccccn1)C1CCN(Cc2ccccc2)CC1 InChI=1S/C19H23N3O/c23-19(21-14-18-8-4-5-11-20-18)17-9-12-22(13-10-17)15-16-6-2-1-3-7-16/h1-8,11,17H,9-10,12-15H2,(H,21,23) CYHBNNGWDYHXOO-UHFFFAOYSA-N 50513708 CHEMBL4445708 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.06.088 10.7270/Q2ZK5M1Z 31280020 van Greunen, DG; Johan van der Westhuizen, C; Cordier, W; Nell, M; Stander, A; Steenkamp, V; Panayides, JL; Riley, DL University of Pretoria http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513708 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513708&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 25249307 440722290 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256727 Cc1c(NC(=O)C2CCN(Cc3ccccc3)CC2)c(=O)n(-c2ccccc2)n1C InChI=1S/C24H28N4O2/c1-18-22(24(30)28(26(18)2)21-11-7-4-8-12-21)25-23(29)20-13-15-27(16-14-20)17-19-9-5-3-6-10-19/h3-12,20H,13-17H2,1-2H3,(H,25,29) VOOWMLWMWZTWPP-UHFFFAOYSA-N 50513709 CHEMBL4435317 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.06.088 10.7270/Q2ZK5M1Z 31280020 van Greunen, DG; Johan van der Westhuizen, C; Cordier, W; Nell, M; Stander, A; Steenkamp, V; Panayides, JL; Riley, DL University of Pretoria http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513709 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513709&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 27234475 440722291 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256728 O=C(NCCN1CCOCC1)C1CCN(Cc2ccccc2)CC1 InChI=1S/C19H29N3O2/c23-19(20-8-11-21-12-14-24-15-13-21)18-6-9-22(10-7-18)16-17-4-2-1-3-5-17/h1-5,18H,6-16H2,(H,20,23) XJYBVKPIEJTPPZ-UHFFFAOYSA-N 50513710 CHEMBL4473728 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.06.088 10.7270/Q2ZK5M1Z 31280020 van Greunen, DG; Johan van der Westhuizen, C; Cordier, W; Nell, M; Stander, A; Steenkamp, V; Panayides, JL; Riley, DL University of Pretoria http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513710 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513710&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 883885 440722292 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256729 O=C(NCCc1c[nH]c2ccccc12)C1CCN(Cc2ccccc2)CC1 InChI=1S/C23H27N3O/c27-23(24-13-10-20-16-25-22-9-5-4-8-21(20)22)19-11-14-26(15-12-19)17-18-6-2-1-3-7-18/h1-9,16,19,25H,10-15,17H2,(H,24,27) QTSKGKRAUSQIQD-UHFFFAOYSA-N 50187127 CHEMBL3824057 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.06.088 10.7270/Q2ZK5M1Z 31280020 van Greunen, DG; Johan van der Westhuizen, C; Cordier, W; Nell, M; Stander, A; Steenkamp, V; Panayides, JL; Riley, DL University of Pretoria http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50187127 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50187127&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5152006 104071144 CHEMBL3824057 ZINC34804713 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256738 O=C(NCCN1CCCCC1)C1CCN(Cc2ccccc2)CC1 InChI=1S/C20H31N3O/c24-20(21-11-16-22-12-5-2-6-13-22)19-9-14-23(15-10-19)17-18-7-3-1-4-8-18/h1,3-4,7-8,19H,2,5-6,9-17H2,(H,21,24) YXXJBRRBUDCYQT-UHFFFAOYSA-N 50513714 CHEMBL4440310 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.06.088 10.7270/Q2ZK5M1Z 31280020 van Greunen, DG; Johan van der Westhuizen, C; Cordier, W; Nell, M; Stander, A; Steenkamp, V; Panayides, JL; Riley, DL University of Pretoria http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513714 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513714&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53501682 440722296 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256739 O=C(NCc1ccncc1)C1CCN(Cc2ccccc2)CC1 InChI=1S/C19H23N3O/c23-19(21-14-16-6-10-20-11-7-16)18-8-12-22(13-9-18)15-17-4-2-1-3-5-17/h1-7,10-11,18H,8-9,12-15H2,(H,21,23) ANCRPVACYRHFMA-UHFFFAOYSA-N 50513711 CHEMBL4543815 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.06.088 10.7270/Q2ZK5M1Z 31280020 van Greunen, DG; Johan van der Westhuizen, C; Cordier, W; Nell, M; Stander, A; Steenkamp, V; Panayides, JL; Riley, DL University of Pretoria http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513711 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513711&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 45017040 440722293 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256740 COc1cc(CCNC(=O)C2CCN(Cc3ccccc3)CC2)cc(OC)c1OC InChI=1S/C24H32N2O4/c1-28-21-15-19(16-22(29-2)23(21)30-3)9-12-25-24(27)20-10-13-26(14-11-20)17-18-7-5-4-6-8-18/h4-8,15-16,20H,9-14,17H2,1-3H3,(H,25,27) RAJQFQQZUNPQKP-UHFFFAOYSA-N 50513712 CHEMBL4465014 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.06.088 10.7270/Q2ZK5M1Z 31280020 van Greunen, DG; Johan van der Westhuizen, C; Cordier, W; Nell, M; Stander, A; Steenkamp, V; Panayides, JL; Riley, DL University of Pretoria http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513712 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513712&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155530841 440722294 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256745 O=C(NCCNc1cccc2ccccc12)C1CCN(Cc2ccccc2)CC1 InChI=1S/C25H29N3O/c29-25(22-13-17-28(18-14-22)19-20-7-2-1-3-8-20)27-16-15-26-24-12-6-10-21-9-4-5-11-23(21)24/h1-12,22,26H,13-19H2,(H,27,29) IHAVDPSKRHMHJN-UHFFFAOYSA-N 50513704 CHEMBL4456298 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.06.088 10.7270/Q2ZK5M1Z 31280020 van Greunen, DG; Johan van der Westhuizen, C; Cordier, W; Nell, M; Stander, A; Steenkamp, V; Panayides, JL; Riley, DL University of Pretoria http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513704 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513704&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155525242 440722286 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256746 O=C(NC1CCCc2ccccc12)C1CCN(Cc2ccccc2)CC1 InChI=1S/C23H28N2O/c26-23(24-22-12-6-10-19-9-4-5-11-21(19)22)20-13-15-25(16-14-20)17-18-7-2-1-3-8-18/h1-5,7-9,11,20,22H,6,10,12-17H2,(H,24,26) UNKWLUYKBRHNMK-UHFFFAOYSA-N 50513703 CHEMBL4438273 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.06.088 10.7270/Q2ZK5M1Z 31280020 van Greunen, DG; Johan van der Westhuizen, C; Cordier, W; Nell, M; Stander, A; Steenkamp, V; Panayides, JL; Riley, DL University of Pretoria http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513703 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513703&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46776074 440722285 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256747 COc1ccccc1CNC(=O)C1CCN(Cc2ccccc2)CC1 InChI=1S/C21H26N2O2/c1-25-20-10-6-5-9-19(20)15-22-21(24)18-11-13-23(14-12-18)16-17-7-3-2-4-8-17/h2-10,18H,11-16H2,1H3,(H,22,24) AKPJVCDMRATSMY-UHFFFAOYSA-N 50513713 CHEMBL4583588 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.06.088 10.7270/Q2ZK5M1Z 31280020 van Greunen, DG; Johan van der Westhuizen, C; Cordier, W; Nell, M; Stander, A; Steenkamp, V; Panayides, JL; Riley, DL University of Pretoria http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513713 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513713&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 40921885 440722295 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256788 COc1cc2CCN(CCCCOc3ccc(C(C)=O)c(O)c3)Cc2cc1OC InChI=1S/C23H29NO5/c1-16(25)20-7-6-19(14-21(20)26)29-11-5-4-9-24-10-8-17-12-22(27-2)23(28-3)13-18(17)15-24/h6-7,12-14,26H,4-5,8-11,15H2,1-3H3 GQORNNSDCGMJPS-UHFFFAOYSA-N 50513744 CHEMBL4577772 Cholinesterase 56400 ChEMBL 10.1016/j.bmcl.2019.126625 10.7270/Q2KD2286 31444085 Zhu, G; Wang, K; Shi, J; Zhang, P; Yang, D; Fan, X; Zhang, Z; Liu, W; Sang, Z Guizhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513744 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513744&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155565080 440722326 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256798 CCN(CCCCCCCCCCCCOc1ccc(C(C)=O)c(O)c1)Cc1ccccc1 InChI=1S/C29H43NO3/c1-3-30(24-26-17-13-12-14-18-26)21-15-10-8-6-4-5-7-9-11-16-22-33-27-19-20-28(25(2)31)29(32)23-27/h12-14,17-20,23,32H,3-11,15-16,21-22,24H2,1-2H3 MLNXBPVEFBISBJ-UHFFFAOYSA-N 50513747 CHEMBL4540746 Cholinesterase 38900 ChEMBL 10.1016/j.bmcl.2019.126625 10.7270/Q2KD2286 31444085 Zhu, G; Wang, K; Shi, J; Zhang, P; Yang, D; Fan, X; Zhang, Z; Liu, W; Sang, Z Guizhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513747 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513747&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155549981 440722329 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256799 CC(=O)c1ccc(OCCCCCCCCCN2CCN(Cc3ccccc3)CC2)cc1O InChI=1S/C28H40N2O3/c1-24(31)27-15-14-26(22-28(27)32)33-21-11-6-4-2-3-5-10-16-29-17-19-30(20-18-29)23-25-12-8-7-9-13-25/h7-9,12-15,22,32H,2-6,10-11,16-21,23H2,1H3 HJUCGPGYZRSDDH-UHFFFAOYSA-N 50513751 CHEMBL4524259 Cholinesterase 19800 ChEMBL 10.1016/j.bmcl.2019.126625 10.7270/Q2KD2286 31444085 Zhu, G; Wang, K; Shi, J; Zhang, P; Yang, D; Fan, X; Zhang, Z; Liu, W; Sang, Z Guizhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513751 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513751&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155520012 440722333 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256800 CC(=O)c1ccc(OCCCCCCN2CCc3ccccc3C2)cc1O InChI=1S/C23H29NO3/c1-18(25)22-11-10-21(16-23(22)26)27-15-7-3-2-6-13-24-14-12-19-8-4-5-9-20(19)17-24/h4-5,8-11,16,26H,2-3,6-7,12-15,17H2,1H3 BMNQOCMGOKAYAE-UHFFFAOYSA-N 50513753 CHEMBL4460888 Cholinesterase 32600 ChEMBL 10.1016/j.bmcl.2019.126625 10.7270/Q2KD2286 31444085 Zhu, G; Wang, K; Shi, J; Zhang, P; Yang, D; Fan, X; Zhang, Z; Liu, W; Sang, Z Guizhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513753 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513753&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155528388 440722335 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256801 CC(=O)c1ccc(OCCCCN2CCc3ccccc3C2)cc1O InChI=1S/C21H25NO3/c1-16(23)20-9-8-19(14-21(20)24)25-13-5-4-11-22-12-10-17-6-2-3-7-18(17)15-22/h2-3,6-9,14,24H,4-5,10-13,15H2,1H3 NOUDIJSWICGUNT-UHFFFAOYSA-N 50513754 CHEMBL4522546 Cholinesterase 47500 ChEMBL 10.1016/j.bmcl.2019.126625 10.7270/Q2KD2286 31444085 Zhu, G; Wang, K; Shi, J; Zhang, P; Yang, D; Fan, X; Zhang, Z; Liu, W; Sang, Z Guizhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513754 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513754&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155543647 440722336 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256802 COc1cc2CCN(CCCOc3ccc(C(C)=O)c(O)c3)Cc2cc1OC InChI=1S/C22H27NO5/c1-15(24)19-6-5-18(13-20(19)25)28-10-4-8-23-9-7-16-11-21(26-2)22(27-3)12-17(16)14-23/h5-6,11-13,25H,4,7-10,14H2,1-3H3 UGTOHDDXGFCAEE-UHFFFAOYSA-N 50513743 CHEMBL4438605 Cholinesterase 57900 ChEMBL 10.1016/j.bmcl.2019.126625 10.7270/Q2KD2286 31444085 Zhu, G; Wang, K; Shi, J; Zhang, P; Yang, D; Fan, X; Zhang, Z; Liu, W; Sang, Z Guizhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513743 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513743&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155513287 440722325 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256803 CC(=O)c1ccc(OCCCN2CCC(CC2)c2ccccc2)cc1O InChI=1S/C22H27NO3/c1-17(24)21-9-8-20(16-22(21)25)26-15-5-12-23-13-10-19(11-14-23)18-6-3-2-4-7-18/h2-4,6-9,16,19,25H,5,10-15H2,1H3 CUVPRMAVZMUBSN-UHFFFAOYSA-N 50513755 CHEMBL4467682 Cholinesterase 29400 ChEMBL 10.1016/j.bmcl.2019.126625 10.7270/Q2KD2286 31444085 Zhu, G; Wang, K; Shi, J; Zhang, P; Yang, D; Fan, X; Zhang, Z; Liu, W; Sang, Z Guizhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513755 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513755&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155532460 440722337 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256804 CC(=O)c1ccc(OCCCN2CCC(Cc3ccccc3)CC2)cc1O InChI=1S/C23H29NO3/c1-18(25)22-9-8-21(17-23(22)26)27-15-5-12-24-13-10-20(11-14-24)16-19-6-3-2-4-7-19/h2-4,6-9,17,20,26H,5,10-16H2,1H3 NYHVOIUQHVNDME-UHFFFAOYSA-N 50513756 CHEMBL4572109 Cholinesterase 63100 ChEMBL 10.1016/j.bmcl.2019.126625 10.7270/Q2KD2286 31444085 Zhu, G; Wang, K; Shi, J; Zhang, P; Yang, D; Fan, X; Zhang, Z; Liu, W; Sang, Z Guizhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513756 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513756&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155563086 440722338 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256837 CCN(CCCCOc1ccc(C(C)=O)c(O)c1)Cc1ccccc1 InChI=1S/C21H27NO3/c1-3-22(16-18-9-5-4-6-10-18)13-7-8-14-25-19-11-12-20(17(2)23)21(24)15-19/h4-6,9-12,15,24H,3,7-8,13-14,16H2,1-2H3 WUYSKQODHVACAH-UHFFFAOYSA-N 50513765 CHEMBL4542187 Cholinesterase 34600 ChEMBL 10.1016/j.bmcl.2019.126625 10.7270/Q2KD2286 31444085 Zhu, G; Wang, K; Shi, J; Zhang, P; Yang, D; Fan, X; Zhang, Z; Liu, W; Sang, Z Guizhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513765 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513765&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155551396 440722347 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256850 CC(=O)c1ccc(OCCCCCCN2CCC(Cc3ccccc3)CC2)cc1O InChI=1S/C26H35NO3/c1-21(28)25-12-11-24(20-26(25)29)30-18-8-3-2-7-15-27-16-13-23(14-17-27)19-22-9-5-4-6-10-22/h4-6,9-12,20,23,29H,2-3,7-8,13-19H2,1H3 KENGQNHOYJFIKK-UHFFFAOYSA-N 50513768 CHEMBL4440788 Cholinesterase 66900 ChEMBL 10.1016/j.bmcl.2019.126625 10.7270/Q2KD2286 31444085 Zhu, G; Wang, K; Shi, J; Zhang, P; Yang, D; Fan, X; Zhang, Z; Liu, W; Sang, Z Guizhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513768 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513768&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155514729 440722350 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256851 CCN(CCCOc1ccc(C(C)=O)c(O)c1)Cc1ccccc1 InChI=1S/C20H25NO3/c1-3-21(15-17-8-5-4-6-9-17)12-7-13-24-18-10-11-19(16(2)22)20(23)14-18/h4-6,8-11,14,23H,3,7,12-13,15H2,1-2H3 NEOMFPFEJLOQMR-UHFFFAOYSA-N 50513761 CHEMBL4450361 Cholinesterase 18700 ChEMBL 10.1016/j.bmcl.2019.126625 10.7270/Q2KD2286 31444085 Zhu, G; Wang, K; Shi, J; Zhang, P; Yang, D; Fan, X; Zhang, Z; Liu, W; Sang, Z Guizhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513761 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513761&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155521473 440722343 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256859 CCN(CCCCCCCCCCOc1ccc(C(C)=O)c(O)c1)Cc1ccccc1 InChI=1S/C27H39NO3/c1-3-28(22-24-15-11-10-12-16-24)19-13-8-6-4-5-7-9-14-20-31-25-17-18-26(23(2)29)27(30)21-25/h10-12,15-18,21,30H,3-9,13-14,19-20,22H2,1-2H3 XRNIVUKXRLMIBN-UHFFFAOYSA-N 50513757 CHEMBL4562783 Cholinesterase 50700 ChEMBL 10.1016/j.bmcl.2019.126625 10.7270/Q2KD2286 31444085 Zhu, G; Wang, K; Shi, J; Zhang, P; Yang, D; Fan, X; Zhang, Z; Liu, W; Sang, Z Guizhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513757 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513757&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155559793 440722339 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256864 CCN(CCCCCOc1ccc(C(C)=O)c(O)c1)Cc1ccccc1 InChI=1S/C22H29NO3/c1-3-23(17-19-10-6-4-7-11-19)14-8-5-9-15-26-20-12-13-21(18(2)24)22(25)16-20/h4,6-7,10-13,16,25H,3,5,8-9,14-15,17H2,1-2H3 WNVWGMFGWQAZCS-UHFFFAOYSA-N 50513746 CHEMBL4456192 Cholinesterase 37200 ChEMBL 10.1016/j.bmcl.2019.126625 10.7270/Q2KD2286 31444085 Zhu, G; Wang, K; Shi, J; Zhang, P; Yang, D; Fan, X; Zhang, Z; Liu, W; Sang, Z Guizhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50513746 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50513746&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155524971 440722328 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51256868 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 4760 ChEMBL 10.1016/j.bmcl.2019.126625 10.7270/Q2KD2286 31444085 Zhu, G; Wang, K; Shi, J; Zhang, P; Yang, D; Fan, X; Zhang, Z; Liu, W; Sang, Z Guizhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51273692 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 15 ChEMBL 10.1016/j.ejmech.2019.111916 10.7270/Q2639T4N 31812794 Wichur, T; Więckowska, A; Więckowski, K; Godyń, J; Jończyk, J; Valdivieso, ÁDR; Panek, D; Pasieka, A; Sabaté, R; Knez, D; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51273695 C(CN1CCC(Cc2ccccc2)CC1)NC1CCN(Cc2ccccc2)C1 InChI=1S/C25H35N3/c1-3-7-22(8-4-1)19-23-11-15-27(16-12-23)18-14-26-25-13-17-28(21-25)20-24-9-5-2-6-10-24/h1-10,23,25-26H,11-21H2 GEXWVZZCZHWMJO-UHFFFAOYSA-N 50519866 CHEMBL4546340 Cholinesterase 620 ChEMBL 10.1016/j.ejmech.2019.111916 10.7270/Q2639T4N 31812794 Wichur, T; Więckowska, A; Więckowski, K; Godyń, J; Jończyk, J; Valdivieso, ÁDR; Panek, D; Pasieka, A; Sabaté, R; Knez, D; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50519866 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50519866&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155552523 440728448 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51273696 C(CN1CCCC(C1)c1ccccc1)NC1CCN(Cc2ccccc2)C1 InChI=1S/C24H33N3/c1-3-8-21(9-4-1)18-27-16-13-24(20-27)25-14-17-26-15-7-12-23(19-26)22-10-5-2-6-11-22/h1-6,8-11,23-25H,7,12-20H2 CCYAENBYIJKXJM-UHFFFAOYSA-N 50519867 CHEMBL4552890 Cholinesterase 2390 ChEMBL 10.1016/j.ejmech.2019.111916 10.7270/Q2639T4N 31812794 Wichur, T; Więckowska, A; Więckowski, K; Godyń, J; Jończyk, J; Valdivieso, ÁDR; Panek, D; Pasieka, A; Sabaté, R; Knez, D; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50519867 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50519867&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155556548 440728449 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51273697 C(CN1CCCC(Cc2ccccc2)C1)NC1CCN(Cc2ccccc2)C1 InChI=1S/C25H35N3/c1-3-8-22(9-4-1)18-24-12-7-15-27(20-24)17-14-26-25-13-16-28(21-25)19-23-10-5-2-6-11-23/h1-6,8-11,24-26H,7,12-21H2 ZCGPBRTYKAWBMD-UHFFFAOYSA-N 50519868 CHEMBL4591651 Cholinesterase 1940 ChEMBL 10.1016/j.ejmech.2019.111916 10.7270/Q2639T4N 31812794 Wichur, T; Więckowska, A; Więckowski, K; Godyń, J; Jończyk, J; Valdivieso, ÁDR; Panek, D; Pasieka, A; Sabaté, R; Knez, D; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50519868 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50519868&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155568329 440728450 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51273698 O=C(CN1CCCC(CCc2ccccc2)C1)NC1CCN(Cc2ccccc2)C1 InChI=1S/C26H35N3O/c30-26(27-25-15-17-29(20-25)18-23-10-5-2-6-11-23)21-28-16-7-12-24(19-28)14-13-22-8-3-1-4-9-22/h1-6,8-11,24-25H,7,12-21H2,(H,27,30) JMLPATPCDYFEAO-UHFFFAOYSA-N 50519869 CHEMBL4467074 Cholinesterase 10310 ChEMBL 10.1016/j.ejmech.2019.111916 10.7270/Q2639T4N 31812794 Wichur, T; Więckowska, A; Więckowski, K; Godyń, J; Jończyk, J; Valdivieso, ÁDR; Panek, D; Pasieka, A; Sabaté, R; Knez, D; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50519869 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50519869&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155531973 440728451 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51273701 C(CN1CCC(CCc2ccccc2)CC1)NC1CCN(Cc2ccccc2)C1 InChI=1S/C26H37N3/c1-3-7-23(8-4-1)11-12-24-13-17-28(18-14-24)20-16-27-26-15-19-29(22-26)21-25-9-5-2-6-10-25/h1-10,24,26-27H,11-22H2 NFJKWJFFIUIDPF-UHFFFAOYSA-N 50519871 CHEMBL4441721 Cholinesterase 7390 ChEMBL 10.1016/j.ejmech.2019.111916 10.7270/Q2639T4N 31812794 Wichur, T; Więckowska, A; Więckowski, K; Godyń, J; Jończyk, J; Valdivieso, ÁDR; Panek, D; Pasieka, A; Sabaté, R; Knez, D; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50519871 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50519871&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155515581 440728453 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51273702 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 1830 ChEMBL 10.1016/j.ejmech.2019.111916 10.7270/Q2639T4N 31812794 Wichur, T; Więckowska, A; Więckowski, K; Godyń, J; Jończyk, J; Valdivieso, ÁDR; Panek, D; Pasieka, A; Sabaté, R; Knez, D; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51273703 Cc1c(OCc2ccccc2)cccc1N1CCN(CC(=O)NC2CCN(Cc3ccccc3)C2)CC1 InChI=1S/C31H38N4O2/c1-25-29(13-8-14-30(25)37-24-27-11-6-3-7-12-27)35-19-17-33(18-20-35)23-31(36)32-28-15-16-34(22-28)21-26-9-4-2-5-10-26/h2-14,28H,15-24H2,1H3,(H,32,36) PVTOPRSOMIQYRX-UHFFFAOYSA-N 50519870 CHEMBL4582631 Cholinesterase 76000 ChEMBL 10.1016/j.ejmech.2019.111916 10.7270/Q2639T4N 31812794 Wichur, T; Więckowska, A; Więckowski, K; Godyń, J; Jończyk, J; Valdivieso, ÁDR; Panek, D; Pasieka, A; Sabaté, R; Knez, D; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50519870 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50519870&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155557894 440728452 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51273704 O=C(CN1CCCC(Cc2ccccc2)C1)NC1CCN(Cc2ccccc2)C1 InChI=1S/C25H33N3O/c29-25(26-24-13-15-28(19-24)17-22-10-5-2-6-11-22)20-27-14-7-12-23(18-27)16-21-8-3-1-4-9-21/h1-6,8-11,23-24H,7,12-20H2,(H,26,29) QYWDZTYCVJVNMJ-UHFFFAOYSA-N 50519872 CHEMBL4441374 Cholinesterase 7000 ChEMBL 10.1016/j.ejmech.2019.111916 10.7270/Q2639T4N 31812794 Wichur, T; Więckowska, A; Więckowski, K; Godyń, J; Jończyk, J; Valdivieso, ÁDR; Panek, D; Pasieka, A; Sabaté, R; Knez, D; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50519872 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50519872&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155515095 440728454 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51273706 C(CN1CCCC(CCc2ccccc2)C1)NC1CCN(Cc2ccccc2)C1 InChI=1S/C26H37N3/c1-3-8-23(9-4-1)13-14-25-12-7-17-28(20-25)19-16-27-26-15-18-29(22-26)21-24-10-5-2-6-11-24/h1-6,8-11,25-27H,7,12-22H2 BRUSHJCBLNVXBK-UHFFFAOYSA-N 50519873 CHEMBL4528953 Cholinesterase 3260 ChEMBL 10.1016/j.ejmech.2019.111916 10.7270/Q2639T4N 31812794 Wichur, T; Więckowska, A; Więckowski, K; Godyń, J; Jończyk, J; Valdivieso, ÁDR; Panek, D; Pasieka, A; Sabaté, R; Knez, D; Gobec, S; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50519873 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50519873&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155544982 440728455 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51227521 OC1(C(=O)N(Cc2ccc(Cl)cc2)c2ccccc12)c1ccccc1 InChI=1S/C21H16ClNO2/c22-17-12-10-15(11-13-17)14-23-19-9-5-4-8-18(19)21(25,20(23)24)16-6-2-1-3-7-16/h1-13,25H,14H2 SIXPGAYGILPSJO-UHFFFAOYSA-N 50344826 1-(4-chlorobenzyl)-3-hydroxy-3-phenylindolin-2-one::CHEMBL1779927 Cholinesterase 1020 ChEMBL 10.1016/j.bmc.2018.12.007 10.7270/Q21Z47PZ 30578075 Bacalhau, P; Fernandes, L; Rosário Martins, M; Candeias, F; Carreiro, EP; López, Ó; Teresa Caldeira, A; Totobenazara, J; Guedes, RC; Burke, AJ Universidade de £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50344826 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50344826&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12004278 131347762 CHEMBL1779927 ZINC71340422 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51227522 OC1(C(=O)N(Cc2ccccc2)c2ccccc12)c1ccccc1 InChI=1S/C21H17NO2/c23-20-21(24,17-11-5-2-6-12-17)18-13-7-8-14-19(18)22(20)15-16-9-3-1-4-10-16/h1-14,24H,15H2 NJFIZXJCCKZPOL-UHFFFAOYSA-N 50503818 CHEMBL4593576 Cholinesterase 7410 ChEMBL 10.1016/j.bmc.2018.12.007 10.7270/Q21Z47PZ 30578075 Bacalhau, P; Fernandes, L; Rosário Martins, M; Candeias, F; Carreiro, EP; López, Ó; Teresa Caldeira, A; Totobenazara, J; Guedes, RC; Burke, AJ Universidade de £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50503818 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50503818&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11141594 440712403 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51227523 Cl.OC1(C(=O)N(CC2CCNCC2)c2ccccc12)c1ccccc1 InChI=1S/C20H22N2O2.ClH/c23-19-20(24,16-6-2-1-3-7-16)17-8-4-5-9-18(17)22(19)14-15-10-12-21-13-11-15;/h1-9,15,21,24H,10-14H2;1H LRVIWQPCOCNVDV-UHFFFAOYSA-N 50503819 CHEMBL4565335 Cholinesterase 18260 ChEMBL 10.1016/j.bmc.2018.12.007 10.7270/Q21Z47PZ 30578075 Bacalhau, P; Fernandes, L; Rosário Martins, M; Candeias, F; Carreiro, EP; López, Ó; Teresa Caldeira, A; Totobenazara, J; Guedes, RC; Burke, AJ Universidade de £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50503819 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50503819&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155544672 440712404 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51227526 Cl.OC1(C(=O)N(CC2CCNCC2)c2ccccc12)c1ccccc1 InChI=1S/C20H22N2O2.ClH/c23-19-20(24,16-6-2-1-3-7-16)17-8-4-5-9-18(17)22(19)14-15-10-12-21-13-11-15;/h1-9,15,21,24H,10-14H2;1H LRVIWQPCOCNVDV-UHFFFAOYSA-N 50503819 CHEMBL4565335 Cholinesterase 41000 ChEMBL 10.1016/j.bmc.2018.12.007 10.7270/Q21Z47PZ 30578075 Bacalhau, P; Fernandes, L; Rosário Martins, M; Candeias, F; Carreiro, EP; López, Ó; Teresa Caldeira, A; Totobenazara, J; Guedes, RC; Burke, AJ Universidade de £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50503819 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50503819&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155544672 440712404 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51227530 OC1(C(=O)N(CC2CCN(Cc3ccccc3)CC2)c2ccccc12)c1ccccc1 InChI=1S/C27H28N2O2/c30-26-27(31,23-11-5-2-6-12-23)24-13-7-8-14-25(24)29(26)20-22-15-17-28(18-16-22)19-21-9-3-1-4-10-21/h1-14,22,31H,15-20H2 KMAVHHFYENQDNL-UHFFFAOYSA-N 50503820 CHEMBL4550082 Cholinesterase 6610 ChEMBL 10.1016/j.bmc.2018.12.007 10.7270/Q21Z47PZ 30578075 Bacalhau, P; Fernandes, L; Rosário Martins, M; Candeias, F; Carreiro, EP; López, Ó; Teresa Caldeira, A; Totobenazara, J; Guedes, RC; Burke, AJ Universidade de £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50503820 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50503820&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155550824 440712405 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51271833 CCc1ccc(OCCCCCCN2CCCCCC2)cc1 InChI=1S/C20H33NO/c1-2-19-11-13-20(14-12-19)22-18-10-6-5-9-17-21-15-7-3-4-8-16-21/h11-14H,2-10,15-18H2,1H3 KKWRNOMPUPBYOA-UHFFFAOYSA-N 50519407 CHEMBL4529681 Cholinesterase 1900 ChEMBL 10.1016/j.ejmech.2019.111785 10.7270/Q2Q81HF9 31669851 Bajda, M; Łażewska, D; Godyń, J; Zaręba, P; Kuder, K; Hagenow, S; Łątka, K; Stawarska, E; Stark, H; Kieć-Kononowicz, K; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50519407 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50519407&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155545703 440727989 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51271844 Cc1ccc2oc(cc(=O)c2c1)-c1ccc(OCCCCCCN2CCCCCC2)cc1 InChI=1S/C28H35NO3/c1-22-10-15-27-25(20-22)26(30)21-28(32-27)23-11-13-24(14-12-23)31-19-9-5-4-8-18-29-16-6-2-3-7-17-29/h10-15,20-21H,2-9,16-19H2,1H3 UKIGXRPAJQOYHR-UHFFFAOYSA-N 50519406 CHEMBL4455690 Cholinesterase 440 ChEMBL 10.1016/j.ejmech.2019.111785 10.7270/Q2Q81HF9 31669851 Bajda, M; Łażewska, D; Godyń, J; Zaręba, P; Kuder, K; Hagenow, S; Łątka, K; Stawarska, E; Stark, H; Kieć-Kononowicz, K; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50519406 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50519406&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155524877 440727988 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51271845 CC1CCCN(CCCCCCOc2ccc3OC(CC(=O)c3c2)c2ccccc2)C1 InChI=1S/C27H35NO3/c1-21-10-9-16-28(20-21)15-7-2-3-8-17-30-23-13-14-26-24(18-23)25(29)19-27(31-26)22-11-5-4-6-12-22/h4-6,11-14,18,21,27H,2-3,7-10,15-17,19-20H2,1H3 HMZBNISOSPDRAV-UHFFFAOYSA-N 50519404 CHEMBL4560469 Cholinesterase 1900 ChEMBL 10.1016/j.ejmech.2019.111785 10.7270/Q2Q81HF9 31669851 Bajda, M; Łażewska, D; Godyń, J; Zaręba, P; Kuder, K; Hagenow, S; Łątka, K; Stawarska, E; Stark, H; Kieć-Kononowicz, K; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50519404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50519404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155558614 440727986 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51271846 Cc1ccc2oc(cc(=O)c2c1)-c1ccc(OCCCCCCN2CCCCC2)cc1 InChI=1S/C27H33NO3/c1-21-9-14-26-24(19-21)25(29)20-27(31-26)22-10-12-23(13-11-22)30-18-8-3-2-5-15-28-16-6-4-7-17-28/h9-14,19-20H,2-8,15-18H2,1H3 NDDYCWJCTGXGIS-UHFFFAOYSA-N 50519412 CHEMBL4474399 Cholinesterase 760 ChEMBL 10.1016/j.ejmech.2019.111785 10.7270/Q2Q81HF9 31669851 Bajda, M; Łażewska, D; Godyń, J; Zaręba, P; Kuder, K; Hagenow, S; Łątka, K; Stawarska, E; Stark, H; Kieć-Kononowicz, K; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50519412 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50519412&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155536937 440727994 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51271847 CCc1ccc(OCCCCCCN2CCC(C)CC2)cc1 InChI=1S/C20H33NO/c1-3-19-8-10-20(11-9-19)22-17-7-5-4-6-14-21-15-12-18(2)13-16-21/h8-11,18H,3-7,12-17H2,1-2H3 YPZAIVRBDAFEOR-UHFFFAOYSA-N 50519408 CHEMBL4454949 Cholinesterase 3920 ChEMBL 10.1016/j.ejmech.2019.111785 10.7270/Q2Q81HF9 31669851 Bajda, M; Łażewska, D; Godyń, J; Zaręba, P; Kuder, K; Hagenow, S; Łątka, K; Stawarska, E; Stark, H; Kieć-Kononowicz, K; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50519408 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50519408&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155523500 440727990 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51271848 Clc1ccc(CCCOCCCN2CCCCC2)cc1 InChI=1S/C17H26ClNO/c18-17-9-7-16(8-10-17)6-4-14-20-15-5-13-19-11-2-1-3-12-19/h7-10H,1-6,11-15H2 NNACHAUCXXVJSP-UHFFFAOYSA-N 50247053 1-(3-(3-(4-chlorophenyl)propoxy)propyl)piperidine::CHEMBL462605::Tiprolisant Cholinesterase 8420 ChEMBL 10.1016/j.ejmech.2019.111785 10.7270/Q2Q81HF9 31669851 Bajda, M; Łażewska, D; Godyń, J; Zaręba, P; Kuder, K; Hagenow, S; Łątka, K; Stawarska, E; Stark, H; Kieć-Kononowicz, K; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50247053 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50247053&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 9948102 104102226 CHEMBL462605 ZINC34045468 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51271850 Cc1ccc2oc(cc(=O)c2c1)-c1ccc(OCCCCCCN2CCCCCC2)cc1 InChI=1S/C28H35NO3/c1-22-10-15-27-25(20-22)26(30)21-28(32-27)23-11-13-24(14-12-23)31-19-9-5-4-8-18-29-16-6-2-3-7-17-29/h10-15,20-21H,2-9,16-19H2,1H3 UKIGXRPAJQOYHR-UHFFFAOYSA-N 50519406 CHEMBL4455690 Cholinesterase 281 ChEMBL 10.1016/j.ejmech.2019.111785 10.7270/Q2Q81HF9 31669851 Bajda, M; Łażewska, D; Godyń, J; Zaręba, P; Kuder, K; Hagenow, S; Łątka, K; Stawarska, E; Stark, H; Kieć-Kononowicz, K; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50519406 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50519406&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155524877 440727988 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51271851 Cc1ccc2oc(cc(=O)c2c1)-c1ccc(OCCCCCCN2CCCCCC2)cc1 InChI=1S/C28H35NO3/c1-22-10-15-27-25(20-22)26(30)21-28(32-27)23-11-13-24(14-12-23)31-19-9-5-4-8-18-29-16-6-2-3-7-17-29/h10-15,20-21H,2-9,16-19H2,1H3 UKIGXRPAJQOYHR-UHFFFAOYSA-N 50519406 CHEMBL4455690 Cholinesterase 282 ChEMBL 10.1016/j.ejmech.2019.111785 10.7270/Q2Q81HF9 31669851 Bajda, M; Łażewska, D; Godyń, J; Zaręba, P; Kuder, K; Hagenow, S; Łątka, K; Stawarska, E; Stark, H; Kieć-Kononowicz, K; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50519406 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50519406&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155524877 440727988 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51271856 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 1.5 ChEMBL 10.1016/j.ejmech.2019.111785 10.7270/Q2Q81HF9 31669851 Bajda, M; Łażewska, D; Godyń, J; Zaręba, P; Kuder, K; Hagenow, S; Łątka, K; Stawarska, E; Stark, H; Kieć-Kononowicz, K; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51271865 CC1CCCN(CCCCCCOc2ccc(cc2)-c2cc(=O)c3cc(C)ccc3o2)C1 InChI=1S/C28H35NO3/c1-21-9-14-27-25(18-21)26(30)19-28(32-27)23-10-12-24(13-11-23)31-17-6-4-3-5-15-29-16-7-8-22(2)20-29/h9-14,18-19,22H,3-8,15-17,20H2,1-2H3 JYRHSSRVHVHKHL-UHFFFAOYSA-N 50519413 CHEMBL4475205 Cholinesterase 1090 ChEMBL 10.1016/j.ejmech.2019.111785 10.7270/Q2Q81HF9 31669851 Bajda, M; Łażewska, D; Godyń, J; Zaręba, P; Kuder, K; Hagenow, S; Łątka, K; Stawarska, E; Stark, H; Kieć-Kononowicz, K; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50519413 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50519413&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155537566 440727995 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51271866 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 1830 ChEMBL 10.1016/j.ejmech.2019.111785 10.7270/Q2Q81HF9 31669851 Bajda, M; Łażewska, D; Godyń, J; Zaręba, P; Kuder, K; Hagenow, S; Łątka, K; Stawarska, E; Stark, H; Kieć-Kononowicz, K; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51284066 Cc1ccc(\C=C2/CNCC3(C(C(Cc4c[nH]c5ccccc45)NC33C4N=c5ccccc5=NC4c4ccccc34)c3ccc(C)cc3)C2=O)cc1 InChI=1S/C46H41N5O/c1-28-15-19-30(20-16-28)23-33-25-47-27-45(44(33)52)41(31-21-17-29(2)18-22-31)40(24-32-26-48-37-12-6-4-9-34(32)37)51-46(45)36-11-5-3-10-35(36)42-43(46)50-39-14-8-7-13-38(39)49-42/h3-23,26,40-43,47-48,51H,24-25,27H2,1-2H3/b33-23+ LLRNRVXTQPDFHS-GZZLJNBRSA-N 50523571 CHEMBL4522515 Cholinesterase 12400 ChEMBL 10.1016/j.bmc.2019.03.058 10.7270/Q26W9FGH 30952387 Arumugam, N; Almansour, AI; Kumar, RS; Kotresha, D; Saiswaroop, R; Venketesh, S King Saud University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523571 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523571&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155543009 440732153 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51284074 Clc1ccccc1\C=C1/CNCC2(C(C(Cc3c[nH]c4ccccc34)NC22C3N=c4ccccc4=NC3c3ccccc23)c2ccccc2Cl)C1=O InChI=1S/C44H35Cl2N5O/c45-33-16-6-1-11-26(33)21-28-23-47-25-43(42(28)52)39(31-14-3-7-17-34(31)46)38(22-27-24-48-35-18-8-4-12-29(27)35)51-44(43)32-15-5-2-13-30(32)40-41(44)50-37-20-10-9-19-36(37)49-40/h1-21,24,38-41,47-48,51H,22-23,25H2/b28-21+ ZOWFWTSFJLMRAE-SGWCAAJKSA-N 50523573 CHEMBL4583817 Cholinesterase 26650 ChEMBL 10.1016/j.bmc.2019.03.058 10.7270/Q26W9FGH 30952387 Arumugam, N; Almansour, AI; Kumar, RS; Kotresha, D; Saiswaroop, R; Venketesh, S King Saud University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523573 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523573&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155566099 440732155 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51284075 Clc1ccc(\C=C2/CNCC3(C(C(Cc4c[nH]c5ccccc45)NC33C4N=c5ccccc5=NC4c4ccccc34)c3ccc(Cl)cc3)C2=O)cc1 InChI=1S/C44H35Cl2N5O/c45-30-17-13-26(14-18-30)21-29-23-47-25-43(42(29)52)39(27-15-19-31(46)20-16-27)38(22-28-24-48-35-10-4-2-7-32(28)35)51-44(43)34-9-3-1-8-33(34)40-41(44)50-37-12-6-5-11-36(37)49-40/h1-21,24,38-41,47-48,51H,22-23,25H2/b29-21+ BHAJCDIAFAGIHZ-XHLNEMQHSA-N 50523575 CHEMBL4452219 Cholinesterase 18760 ChEMBL 10.1016/j.bmc.2019.03.058 10.7270/Q26W9FGH 30952387 Arumugam, N; Almansour, AI; Kumar, RS; Kotresha, D; Saiswaroop, R; Venketesh, S King Saud University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523575 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523575&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155522255 440732157 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51284076 Cc1cccc(\C=C2/CNCC3(C(C(Cc4c[nH]c5ccccc45)NC33C4N=c5ccccc5=NC4c4ccccc34)c3cccc(C)c3)C2=O)c1 InChI=1S/C46H41N5O/c1-28-11-9-13-30(21-28)23-33-25-47-27-45(44(33)52)41(31-14-10-12-29(2)22-31)40(24-32-26-48-37-18-6-4-15-34(32)37)51-46(45)36-17-5-3-16-35(36)42-43(46)50-39-20-8-7-19-38(39)49-42/h3-23,26,40-43,47-48,51H,24-25,27H2,1-2H3/b33-23+ RXNKWNXDRITMIE-GZZLJNBRSA-N 50523576 CHEMBL4459290 Cholinesterase 15210 ChEMBL 10.1016/j.bmc.2019.03.058 10.7270/Q26W9FGH 30952387 Arumugam, N; Almansour, AI; Kumar, RS; Kotresha, D; Saiswaroop, R; Venketesh, S King Saud University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523576 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523576&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155526418 440732158 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51284077 COc1ccc(\C=C2/CNCC3(C(C(Cc4c[nH]c5ccccc45)NC33C4N=c5ccccc5=NC4c4ccccc34)c3ccc(OC)cc3)C2=O)cc1 InChI=1S/C46H41N5O3/c1-53-32-19-15-28(16-20-32)23-31-25-47-27-45(44(31)52)41(29-17-21-33(54-2)22-18-29)40(24-30-26-48-37-12-6-4-9-34(30)37)51-46(45)36-11-5-3-10-35(36)42-43(46)50-39-14-8-7-13-38(39)49-42/h3-23,26,40-43,47-48,51H,24-25,27H2,1-2H3/b31-23+ QLNOCOVIFZTMQP-UQRQXUALSA-N 50523577 CHEMBL4452994 Cholinesterase 23200 ChEMBL 10.1016/j.bmc.2019.03.058 10.7270/Q26W9FGH 30952387 Arumugam, N; Almansour, AI; Kumar, RS; Kotresha, D; Saiswaroop, R; Venketesh, S King Saud University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523577 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523577&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155522717 440732159 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51284078 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 19340 ChEMBL 10.1016/j.bmc.2019.03.058 10.7270/Q26W9FGH 30952387 Arumugam, N; Almansour, AI; Kumar, RS; Kotresha, D; Saiswaroop, R; Venketesh, S King Saud University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51284081 Brc1ccc(\C=C2/CNCC3(C(C(Cc4c[nH]c5ccccc45)NC33C4N=c5ccccc5=NC4c4ccccc34)c3ccc(Br)cc3)C2=O)cc1 InChI=1S/C44H35Br2N5O/c45-30-17-13-26(14-18-30)21-29-23-47-25-43(42(29)52)39(27-15-19-31(46)20-16-27)38(22-28-24-48-35-10-4-2-7-32(28)35)51-44(43)34-9-3-1-8-33(34)40-41(44)50-37-12-6-5-11-36(37)49-40/h1-21,24,38-41,47-48,51H,22-23,25H2/b29-21+ SCOUCXHLIZREQG-XHLNEMQHSA-N 50523578 CHEMBL4464716 Cholinesterase 20620 ChEMBL 10.1016/j.bmc.2019.03.058 10.7270/Q26W9FGH 30952387 Arumugam, N; Almansour, AI; Kumar, RS; Kotresha, D; Saiswaroop, R; Venketesh, S King Saud University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523578 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523578&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155530374 440732160 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51284082 Cc1ccccc1\C=C1/CNCC2(C(C(Cc3c[nH]c4ccccc34)NC22C3N=c4ccccc4=NC3c3ccccc23)c2ccccc2C)C1=O InChI=1S/C46H41N5O/c1-28-13-3-5-15-30(28)23-32-25-47-27-45(44(32)52)41(33-16-6-4-14-29(33)2)40(24-31-26-48-37-20-10-8-17-34(31)37)51-46(45)36-19-9-7-18-35(36)42-43(46)50-39-22-12-11-21-38(39)49-42/h3-23,26,40-43,47-48,51H,24-25,27H2,1-2H3/b32-23+ KZFVCZKLGTXBHJ-AWSUPERCSA-N 50523579 CHEMBL4473000 Cholinesterase 14740 ChEMBL 10.1016/j.bmc.2019.03.058 10.7270/Q26W9FGH 30952387 Arumugam, N; Almansour, AI; Kumar, RS; Kotresha, D; Saiswaroop, R; Venketesh, S King Saud University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523579 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523579&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155536154 440732161 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51284083 Clc1ccc(\C=C2/CNCC3(C(C(Cc4c[nH]c5ccccc45)NC33C4N=c5ccccc5=NC4c4ccccc34)c3ccc(Cl)cc3Cl)C2=O)c(Cl)c1 InChI=1S/C44H33Cl4N5O/c45-27-14-13-24(33(47)19-27)17-26-21-49-23-43(42(26)54)39(31-16-15-28(46)20-34(31)48)38(18-25-22-50-35-10-4-2-7-29(25)35)53-44(43)32-9-3-1-8-30(32)40-41(44)52-37-12-6-5-11-36(37)51-40/h1-17,19-20,22,38-41,49-50,53H,18,21,23H2/b26-17+ HRKUZHNRAOCKBI-YZSQISJMSA-N 50523574 CHEMBL4562781 Cholinesterase 17620 ChEMBL 10.1016/j.bmc.2019.03.058 10.7270/Q26W9FGH 30952387 Arumugam, N; Almansour, AI; Kumar, RS; Kotresha, D; Saiswaroop, R; Venketesh, S King Saud University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523574 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523574&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155559791 440732156 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51284084 [O-][N+](=O)c1cccc(\C=C2/CNCC3(C(C(Cc4c[nH]c5ccccc45)NC33C4N=c5ccccc5=NC4c4ccccc34)c3cccc(c3)[N+]([O-])=O)C2=O)c1 InChI=1S/C44H35N7O5/c52-42-29(19-26-9-7-11-30(20-26)50(53)54)23-45-25-43(42)39(27-10-8-12-31(21-27)51(55)56)38(22-28-24-46-35-16-4-2-13-32(28)35)49-44(43)34-15-3-1-14-33(34)40-41(44)48-37-18-6-5-17-36(37)47-40/h1-21,24,38-41,45-46,49H,22-23,25H2/b29-19+ SBXYJYXTZRSKMK-VUTHCHCSSA-N 50523570 CHEMBL4436182 Cholinesterase 10450 ChEMBL 10.1016/j.bmc.2019.03.058 10.7270/Q26W9FGH 30952387 Arumugam, N; Almansour, AI; Kumar, RS; Kotresha, D; Saiswaroop, R; Venketesh, S King Saud University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523570 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523570&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155511442 440732152 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51284086 O=C1\C(CNCC11C(C(Cc2c[nH]c3ccccc23)NC11C2N=c3ccccc3=NC2c2ccccc12)c1ccccc1)=C\c1ccccc1 InChI=1S/C44H37N5O/c50-42-31(23-28-13-3-1-4-14-28)25-45-27-43(42)39(29-15-5-2-6-16-29)38(24-30-26-46-35-20-10-8-17-32(30)35)49-44(43)34-19-9-7-18-33(34)40-41(44)48-37-22-12-11-21-36(37)47-40/h1-23,26,38-41,45-46,49H,24-25,27H2/b31-23+ IVPSVNUXGICLEA-UQRQXUALSA-N 50523572 CHEMBL4549715 Cholinesterase 14220 ChEMBL 10.1016/j.bmc.2019.03.058 10.7270/Q26W9FGH 30952387 Arumugam, N; Almansour, AI; Kumar, RS; Kotresha, D; Saiswaroop, R; Venketesh, S King Saud University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523572 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523572&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155543464 440732154 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51278893 O=C(CCCCC1CCSS1)NCc1cn(CCCCOc2ccc(cc2)-c2cc3c(ccc4ccccc34)oc2=O)nn1 InChI=1S/C34H36N4O4S2/c39-33(10-4-2-8-28-17-20-43-44-28)35-22-26-23-38(37-36-26)18-5-6-19-41-27-14-11-25(12-15-27)30-21-31-29-9-3-1-7-24(29)13-16-32(31)42-34(30)40/h1,3,7,9,11-16,21,23,28H,2,4-6,8,10,17-20,22H2,(H,35,39) CTMWVMZGAHRITN-UHFFFAOYSA-N 50516954 CHEMBL4451075 Cholinesterase 68600 ChEMBL 10.1016/j.bmc.2019.07.005 10.7270/Q2RB7819 31300317 Bozorov, K; Zhao, J; Aisa, HA Chinese Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50516954 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50516954&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155521555 440725536 C02051 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51281540 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 8710 ChEMBL 10.1016/j.bmc.2019.06.004 10.7270/Q2XS5ZSQ 31176571 Umar, T; Gusain, S; Raza, MK; Shalini, S; Kumar, J; Tiwari, M; Hoda, N Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51281541 COc1ccc(cc1OC)-c1cc(nc2nncn12)-c1cccc2ccccc12 InChI=1S/C23H18N4O2/c1-28-21-11-10-16(12-22(21)29-2)20-13-19(25-23-26-24-14-27(20)23)18-9-5-7-15-6-3-4-8-17(15)18/h3-14H,1-2H3 ORFACBDRKIGDAL-UHFFFAOYSA-N 50522775 CHEMBL4473126 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2019.06.004 10.7270/Q2XS5ZSQ 31176571 Umar, T; Gusain, S; Raza, MK; Shalini, S; Kumar, J; Tiwari, M; Hoda, N Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50522775 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50522775&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155536352 440731357 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51281545 Fc1ccc(cc1)C1C=C(Nc2nncn12)c1cccc2ccccc12 InChI=1S/C21H15FN4/c22-16-10-8-15(9-11-16)20-12-19(24-21-25-23-13-26(20)21)18-7-3-5-14-4-1-2-6-17(14)18/h1-13,20H,(H,24,25) MZJCAWCKWVXSLO-UHFFFAOYSA-N 50522778 CHEMBL4444043 Cholinesterase 39030 ChEMBL 10.1016/j.bmc.2019.06.004 10.7270/Q2XS5ZSQ 31176571 Umar, T; Gusain, S; Raza, MK; Shalini, S; Kumar, J; Tiwari, M; Hoda, N Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50522778 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50522778&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155517024 440731360 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51281546 COc1ccc(OC)c(c1)C1C=C(Nc2nncn12)c1cccc2ccccc12 InChI=1S/C23H20N4O2/c1-28-16-10-11-22(29-2)19(12-16)21-13-20(25-23-26-24-14-27(21)23)18-9-5-7-15-6-3-4-8-17(15)18/h3-14,21H,1-2H3,(H,25,26) YGEHCALDWKPUNI-UHFFFAOYSA-N 50522779 CHEMBL4435306 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2019.06.004 10.7270/Q2XS5ZSQ 31176571 Umar, T; Gusain, S; Raza, MK; Shalini, S; Kumar, J; Tiwari, M; Hoda, N Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50522779 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50522779&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155510971 440731361 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51281547 Clc1ccc(cc1)C1C=C(Nc2nncn12)c1cccc2ccccc12 InChI=1S/C21H15ClN4/c22-16-10-8-15(9-11-16)20-12-19(24-21-25-23-13-26(20)21)18-7-3-5-14-4-1-2-6-17(14)18/h1-13,20H,(H,24,25) QECONAGVAZCSDA-UHFFFAOYSA-N 50522780 CHEMBL4456307 Cholinesterase 900 ChEMBL 10.1016/j.bmc.2019.06.004 10.7270/Q2XS5ZSQ 31176571 Umar, T; Gusain, S; Raza, MK; Shalini, S; Kumar, J; Tiwari, M; Hoda, N Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50522780 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50522780&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155525248 440731362 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51281548 COc1ccc(cc1)C1C=C(Nc2nncn12)c1cccc2ccccc12 InChI=1S/C22H18N4O/c1-27-17-11-9-16(10-12-17)21-13-20(24-22-25-23-14-26(21)22)19-8-4-6-15-5-2-3-7-18(15)19/h2-14,21H,1H3,(H,24,25) IWLZFMVSYDNNEY-UHFFFAOYSA-N 50522781 CHEMBL4590912 Cholinesterase 150 ChEMBL 10.1016/j.bmc.2019.06.004 10.7270/Q2XS5ZSQ 31176571 Umar, T; Gusain, S; Raza, MK; Shalini, S; Kumar, J; Tiwari, M; Hoda, N Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50522781 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50522781&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155568535 440731363 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51281549 c1coc(c1)-c1cc(nc2nncn12)-c1cccc2ccccc12 InChI=1S/C19H12N4O/c1-2-7-14-13(5-1)6-3-8-15(14)16-11-17(18-9-4-10-24-18)23-12-20-22-19(23)21-16/h1-12H CKAKPBOTKYSZOH-UHFFFAOYSA-N 50522782 CHEMBL4584649 Cholinesterase 528 ChEMBL 10.1016/j.bmc.2019.06.004 10.7270/Q2XS5ZSQ 31176571 Umar, T; Gusain, S; Raza, MK; Shalini, S; Kumar, J; Tiwari, M; Hoda, N Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50522782 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50522782&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155561749 440731364 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51281550 c1nnc2nc(cc(-c3ccccc3)n12)-c1cccc2ccccc12 InChI=1S/C21H14N4/c1-2-8-16(9-3-1)20-13-19(23-21-24-22-14-25(20)21)18-12-6-10-15-7-4-5-11-17(15)18/h1-14H IMTJKAWFONNFRX-UHFFFAOYSA-N 50522783 CHEMBL4444113 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2019.06.004 10.7270/Q2XS5ZSQ 31176571 Umar, T; Gusain, S; Raza, MK; Shalini, S; Kumar, J; Tiwari, M; Hoda, N Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50522783 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50522783&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155517154 440731365 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51281556 [O-][N+](=O)c1cccc(c1)C1C=C(Nc2nncn12)c1cccc2ccccc12 InChI=1S/C21H15N5O2/c27-26(28)16-8-3-7-15(11-16)20-12-19(23-21-24-22-13-25(20)21)18-10-4-6-14-5-1-2-9-17(14)18/h1-13,20H,(H,23,24) UYUDNALWNUOOCC-UHFFFAOYSA-N 50522777 CHEMBL4436866 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2019.06.004 10.7270/Q2XS5ZSQ 31176571 Umar, T; Gusain, S; Raza, MK; Shalini, S; Kumar, J; Tiwari, M; Hoda, N Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50522777 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50522777&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155512131 440731359 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51281557 Clc1ccccc1C1C=C(Nc2nncn12)c1cccc2ccccc12 InChI=1S/C21H15ClN4/c22-18-11-4-3-9-17(18)20-12-19(24-21-25-23-13-26(20)21)16-10-5-7-14-6-1-2-8-15(14)16/h1-13,20H,(H,24,25) YNNKNSLVTNNPJP-UHFFFAOYSA-N 50522784 CHEMBL4438613 Cholinesterase 76 ChEMBL 10.1016/j.bmc.2019.06.004 10.7270/Q2XS5ZSQ 31176571 Umar, T; Gusain, S; Raza, MK; Shalini, S; Kumar, J; Tiwari, M; Hoda, N Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50522784 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50522784&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155513293 440731366 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51281561 CN(C)c1ccc(cc1)-c1cc(nc2nncn12)-c1cccc2ccccc12 InChI=1S/C23H19N5/c1-27(2)18-12-10-17(11-13-18)22-14-21(25-23-26-24-15-28(22)23)20-9-5-7-16-6-3-4-8-19(16)20/h3-15H,1-2H3 IPPABVXASIKASH-UHFFFAOYSA-N 50522776 CHEMBL4578090 Cholinesterase 20950 ChEMBL 10.1016/j.bmc.2019.06.004 10.7270/Q2XS5ZSQ 31176571 Umar, T; Gusain, S; Raza, MK; Shalini, S; Kumar, J; Tiwari, M; Hoda, N Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50522776 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50522776&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155564741 440731358 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325324 Cc1cc(F)ccc1Cn1cc(nn1)-c1ccc(C)c(c1)C(=O)NCCN1CCOCC1 InChI=1S/C24H28FN5O2/c1-17-3-4-19(14-22(17)24(31)26-7-8-29-9-11-32-12-10-29)23-16-30(28-27-23)15-20-5-6-21(25)13-18(20)2/h3-6,13-14,16H,7-12,15H2,1-2H3,(H,26,31) ZYVABJRQKYYACI-UHFFFAOYSA-N 50536282 CHEMBL4572737 Cholinesterase 60960 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536282 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536282&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155563138 440827106 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325328 Cc1ccc(cc1C(=O)NCCN1CCOCC1)-c1cn(Cc2ccc(cc2)S(N)(=O)=O)nn1 InChI=1S/C23H28N6O4S/c1-17-2-5-19(14-21(17)23(30)25-8-9-28-10-12-33-13-11-28)22-16-29(27-26-22)15-18-3-6-20(7-4-18)34(24,31)32/h2-7,14,16H,8-13,15H2,1H3,(H,25,30)(H2,24,31,32) HIJYGMPIRGCJRS-UHFFFAOYSA-N 50536286 CHEMBL4522818 Cholinesterase 45520 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536286 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536286&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155543669 440827110 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325329 Cc1ccc(cc1C(=O)NCCN1CCOCC1)-c1cn(Cc2ccc3ccccc3c2)nn1 InChI=1S/C27H29N5O2/c1-20-6-8-24(17-25(20)27(33)28-10-11-31-12-14-34-15-13-31)26-19-32(30-29-26)18-21-7-9-22-4-2-3-5-23(22)16-21/h2-9,16-17,19H,10-15,18H2,1H3,(H,28,33) LJJFRDYJWSRAOQ-UHFFFAOYSA-N 50536287 CHEMBL4581664 Cholinesterase 90760 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536287 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536287&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155561630 440827111 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325330 Cc1ccc(cc1C(=O)NCCN1CCOCC1)-c1cn(Cc2ccc(cc2)[N+]([O-])=O)nn1 InChI=1S/C23H26N6O4/c1-17-2-5-19(14-21(17)23(30)24-8-9-27-10-12-33-13-11-27)22-16-28(26-25-22)15-18-3-6-20(7-4-18)29(31)32/h2-7,14,16H,8-13,15H2,1H3,(H,24,30) XAIBXYLSSYRDSH-UHFFFAOYSA-N 50536288 CHEMBL4561751 Cholinesterase 60460 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536288 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536288&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155559023 440827112 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325331 COC(=O)c1ccc(Cn2cc(nn2)-c2ccc(C)c(c2)C(=O)NCCN2CCOCC2)cc1 InChI=1S/C25H29N5O4/c1-18-3-6-21(15-22(18)24(31)26-9-10-29-11-13-34-14-12-29)23-17-30(28-27-23)16-19-4-7-20(8-5-19)25(32)33-2/h3-8,15,17H,9-14,16H2,1-2H3,(H,26,31) KYNMVHITTTVCKK-UHFFFAOYSA-N 50536289 CHEMBL4539017 Cholinesterase 67770 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536289 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536289&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155544435 440827113 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325332 COC(=O)\C=C\c1ccc(Cn2cc(nn2)-c2ccc(C)c(c2)C(=O)NCCN2CCOCC2)cc1 InChI=1S/C27H31N5O4/c1-20-3-9-23(17-24(20)27(34)28-11-12-31-13-15-36-16-14-31)25-19-32(30-29-25)18-22-6-4-21(5-7-22)8-10-26(33)35-2/h3-10,17,19H,11-16,18H2,1-2H3,(H,28,34)/b10-8+ PCPAAPVGRBCVRC-CSKARUKUSA-N 50536283 CHEMBL4589486 Cholinesterase 90860 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536283 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536283&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155569257 440827107 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325333 Cc1ccc(cc1C(=O)NCCN1CCOCC1)-c1cn(Cc2ccc(F)cc2Cl)nn1 InChI=1S/C23H25ClFN5O2/c1-16-2-3-17(12-20(16)23(31)26-6-7-29-8-10-32-11-9-29)22-15-30(28-27-22)14-18-4-5-19(25)13-21(18)24/h2-5,12-13,15H,6-11,14H2,1H3,(H,26,31) KFASMMJFNMRMBH-UHFFFAOYSA-N 50536290 CHEMBL4525497 Cholinesterase 68950 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536290 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536290&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155543156 440827114 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325334 Cc1ccc(cc1C(=O)NCCN1CCOCC1)-c1cn(Cc2ccc(F)cc2F)nn1 InChI=1S/C23H25F2N5O2/c1-16-2-3-17(12-20(16)23(31)26-6-7-29-8-10-32-11-9-29)22-15-30(28-27-22)14-18-4-5-19(24)13-21(18)25/h2-5,12-13,15H,6-11,14H2,1H3,(H,26,31) RTAAVHZJONZWOE-UHFFFAOYSA-N 50536291 CHEMBL4513605 Cholinesterase 89560 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536291 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536291&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155538846 440827115 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325335 Cc1ccc(cc1C(=O)NCCN1CCOCC1)-c1cn(Cc2ccc(F)c(c2)[N+]([O-])=O)nn1 InChI=1S/C23H25FN6O4/c1-16-2-4-18(13-19(16)23(31)25-6-7-28-8-10-34-11-9-28)21-15-29(27-26-21)14-17-3-5-20(24)22(12-17)30(32)33/h2-5,12-13,15H,6-11,14H2,1H3,(H,25,31) BVMUACILGIXFDU-UHFFFAOYSA-N 50536292 CHEMBL4536296 Cholinesterase 34780 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536292 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536292&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155548558 440827116 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325336 Cc1ccc(cc1C(=O)NCCN1CCOCC1)-c1cn(Cc2cccc(Br)c2)nn1 InChI=1S/C23H26BrN5O2/c1-17-5-6-19(14-21(17)23(30)25-7-8-28-9-11-31-12-10-28)22-16-29(27-26-22)15-18-3-2-4-20(24)13-18/h2-6,13-14,16H,7-12,15H2,1H3,(H,25,30) VFDWBUDGOSDSNE-UHFFFAOYSA-N 50536293 CHEMBL4524162 Cholinesterase 40340 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536293 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536293&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155520031 440827117 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325337 Cc1ccc(cc1C(=O)NCCN1CCOCC1)-c1cn(Cc2ccc(Br)cc2)nn1 InChI=1S/C23H26BrN5O2/c1-17-2-5-19(14-21(17)23(30)25-8-9-28-10-12-31-13-11-28)22-16-29(27-26-22)15-18-3-6-20(24)7-4-18/h2-7,14,16H,8-13,15H2,1H3,(H,25,30) GZLMFJUFDPMMCT-UHFFFAOYSA-N 50536294 CHEMBL4581887 Cholinesterase 45560 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536294 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536294&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155561383 440827118 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325338 Cc1ccc(cc1C(=O)NCCN1CCOCC1)-c1cn(Cc2cccc(F)c2)nn1 InChI=1S/C23H26FN5O2/c1-17-5-6-19(14-21(17)23(30)25-7-8-28-9-11-31-12-10-28)22-16-29(27-26-22)15-18-3-2-4-20(24)13-18/h2-6,13-14,16H,7-12,15H2,1H3,(H,25,30) BJVSPNJYPBVOAP-UHFFFAOYSA-N 50536295 CHEMBL4516485 Cholinesterase 60780 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536295 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536295&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155540106 440827119 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325339 Cc1ccc(cc1C(=O)NCCN1CCOCC1)-c1cn(Cc2ccc(F)cc2)nn1 InChI=1S/C23H26FN5O2/c1-17-2-5-19(14-21(17)23(30)25-8-9-28-10-12-31-13-11-28)22-16-29(27-26-22)15-18-3-6-20(24)7-4-18/h2-7,14,16H,8-13,15H2,1H3,(H,25,30) LLJLZCLCORQIHT-UHFFFAOYSA-N 50536296 CHEMBL4578074 Cholinesterase 43660 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536296 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536296&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155565126 440827120 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325340 Cc1ccc(cc1C(=O)NCCN1CCOCC1)-c1cn(Cc2ccc(OC(F)(F)F)cc2)nn1 InChI=1S/C24H26F3N5O3/c1-17-2-5-19(14-21(17)23(33)28-8-9-31-10-12-34-13-11-31)22-16-32(30-29-22)15-18-3-6-20(7-4-18)35-24(25,26)27/h2-7,14,16H,8-13,15H2,1H3,(H,28,33) RBQVWZIBIJCOOG-UHFFFAOYSA-N 50536285 CHEMBL4521556 Cholinesterase 60230 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536285 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536285&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155542665 440827109 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325358 Cc1ccc(cc1C(=O)NCCN1CCOCC1)-c1cn(Cc2cccc(Cl)c2)nn1 InChI=1S/C23H26ClN5O2/c1-17-5-6-19(14-21(17)23(30)25-7-8-28-9-11-31-12-10-28)22-16-29(27-26-22)15-18-3-2-4-20(24)13-18/h2-6,13-14,16H,7-12,15H2,1H3,(H,25,30) CAEBLVZCUJNDSI-UHFFFAOYSA-N 50536303 CHEMBL4531267 Cholinesterase 36250 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536303 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536303&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155546239 440827127 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325359 Cc1ccc(Cn2cc(nn2)-c2ccc(C)c(c2)C(=O)NCCN2CCOCC2)cc1 InChI=1S/C24H29N5O2/c1-18-3-6-20(7-4-18)16-29-17-23(26-27-29)21-8-5-19(2)22(15-21)24(30)25-9-10-28-11-13-31-14-12-28/h3-8,15,17H,9-14,16H2,1-2H3,(H,25,30) XMAQIRLQRUAWMA-UHFFFAOYSA-N 50536284 CHEMBL4515828 Cholinesterase 83120 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536284 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536284&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155539690 440827108 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325360 Cc1ccc(cc1C(=O)NCCN1CCOCC1)-c1cn(C)nn1 InChI=1S/C17H23N5O2/c1-13-3-4-14(16-12-21(2)20-19-16)11-15(13)17(23)18-5-6-22-7-9-24-10-8-22/h3-4,11-12H,5-10H2,1-2H3,(H,18,23) CNMLNGMTKFKAHE-UHFFFAOYSA-N 50536302 CHEMBL4534953 Cholinesterase 68120 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536302 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536302&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155547697 440827126 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325361 Cc1ccc(cc1C(=O)NCCN1CCOCC1)-c1cn(Cc2ccccc2Cl)nn1 InChI=1S/C23H26ClN5O2/c1-17-6-7-18(14-20(17)23(30)25-8-9-28-10-12-31-13-11-28)22-16-29(27-26-22)15-19-4-2-3-5-21(19)24/h2-7,14,16H,8-13,15H2,1H3,(H,25,30) JQTMLIVIXOCARX-UHFFFAOYSA-N 50536307 CHEMBL4541730 Cholinesterase 34450 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536307 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536307&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155551207 440827131 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325363 Cc1cc(C)cc(Cn2cc(nn2)-c2ccc(C)c(c2)C(=O)NCCN2CCOCC2)c1 InChI=1S/C25H31N5O2/c1-18-12-19(2)14-21(13-18)16-30-17-24(27-28-30)22-5-4-20(3)23(15-22)25(31)26-6-7-29-8-10-32-11-9-29/h4-5,12-15,17H,6-11,16H2,1-3H3,(H,26,31) WEDFGVTXHPXYPZ-UHFFFAOYSA-N 50536301 CHEMBL4547644 Cholinesterase 56230 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536301 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536301&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155553427 440827125 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325364 Cc1ccc(cc1C(=O)NCCN1CCOCC1)-c1cn(Cc2ccc(F)c(F)c2)nn1 InChI=1S/C23H25F2N5O2/c1-16-2-4-18(13-19(16)23(31)26-6-7-29-8-10-32-11-9-29)22-15-30(28-27-22)14-17-3-5-20(24)21(25)12-17/h2-5,12-13,15H,6-11,14H2,1H3,(H,26,31) SOXFVDAUPMAGKW-UHFFFAOYSA-N 50536299 CHEMBL4525580 Cholinesterase 95450 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536299 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536299&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155543201 440827123 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325368 Cc1ccc(cc1C(=O)NCCN1CCOCC1)-c1cn(Cc2cccc3ccccc23)nn1 InChI=1S/C27H29N5O2/c1-20-9-10-22(17-25(20)27(33)28-11-12-31-13-15-34-16-14-31)26-19-32(30-29-26)18-23-7-4-6-21-5-2-3-8-24(21)23/h2-10,17,19H,11-16,18H2,1H3,(H,28,33) QQWFPULAMOJMNC-UHFFFAOYSA-N 50536297 CHEMBL4549496 Cholinesterase 72850 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536297 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536297&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155550770 440827121 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325369 Cc1ccc(cc1C(=O)NCCN1CCOCC1)-c1cn(Cc2ccc(cc2)C#N)nn1 InChI=1S/C24H26N6O2/c1-18-2-7-21(14-22(18)24(31)26-8-9-29-10-12-32-13-11-29)23-17-30(28-27-23)16-20-5-3-19(15-25)4-6-20/h2-7,14,17H,8-13,16H2,1H3,(H,26,31) OKUMLMUOHYXASE-UHFFFAOYSA-N 50536298 CHEMBL4551175 Cholinesterase 92830 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536298 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536298&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155555076 440827122 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325370 Cc1ccc(cc1C(=O)NCCN1CCOCC1)-c1cn(Cc2ccc(F)cc2Br)nn1 InChI=1S/C23H25BrFN5O2/c1-16-2-3-17(12-20(16)23(31)26-6-7-29-8-10-32-11-9-29)22-15-30(28-27-22)14-18-4-5-19(25)13-21(18)24/h2-5,12-13,15H,6-11,14H2,1H3,(H,26,31) YYAAAVRQQAIFTJ-UHFFFAOYSA-N 50536309 CHEMBL4576458 Cholinesterase 70760 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536309 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536309&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155551980 440827133 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325371 COc1ccc(Br)c(Cn2cc(nn2)-c2ccc(C)c(c2)C(=O)NCCN2CCOCC2)c1 InChI=1S/C24H28BrN5O3/c1-17-3-4-18(14-21(17)24(31)26-7-8-29-9-11-33-12-10-29)23-16-30(28-27-23)15-19-13-20(32-2)5-6-22(19)25/h3-6,13-14,16H,7-12,15H2,1-2H3,(H,26,31) GUKCFHRLBFIFHQ-UHFFFAOYSA-N 50536300 CHEMBL4545234 Cholinesterase 50760 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536300 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536300&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155553127 440827124 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325372 Cc1ccc(cc1C(=O)NCCN1CCOCC1)-c1cn(Cc2ccccc2F)nn1 InChI=1S/C23H26FN5O2/c1-17-6-7-18(14-20(17)23(30)25-8-9-28-10-12-31-13-11-28)22-16-29(27-26-22)15-19-4-2-3-5-21(19)24/h2-7,14,16H,8-13,15H2,1H3,(H,25,30) KUTXVVCAKYPQFB-UHFFFAOYSA-N 50536308 CHEMBL4571408 Cholinesterase 47230 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536308 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536308&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155562762 440827132 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325373 Cc1ccc(cc1C(=O)NCCN1CCOCC1)-c1cn(Cc2ccccc2C(F)(F)F)nn1 InChI=1S/C24H26F3N5O2/c1-17-6-7-18(14-20(17)23(33)28-8-9-31-10-12-34-13-11-31)22-16-32(30-29-22)15-19-4-2-3-5-21(19)24(25,26)27/h2-7,14,16H,8-13,15H2,1H3,(H,28,33) NMOAPTBTRDJUSA-UHFFFAOYSA-N 50536305 CHEMBL4584351 Cholinesterase 45150 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536305 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536305&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155566597 440827129 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325380 Cc1ccc(cc1C(=O)NCCN1CCOCC1)-c1cn(Cc2ccccc2Br)nn1 InChI=1S/C23H26BrN5O2/c1-17-6-7-18(14-20(17)23(30)25-8-9-28-10-12-31-13-11-28)22-16-29(27-26-22)15-19-4-2-3-5-21(19)24/h2-7,14,16H,8-13,15H2,1H3,(H,25,30) VUSSSGYZNNXHCQ-UHFFFAOYSA-N 50536304 CHEMBL4530986 Cholinesterase 78560 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50536304 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50536304&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155545962 440827128 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51325381 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 16320 ChEMBL 10.1016/j.bmcl.2016.07.017 10.7270/Q2KW5KJZ 27426301 Li, JC; Zhang, J; Rodrigues, MC; Ding, DJ; Longo, JP; Azevedo, RB; Muehlmann, LA; Jiang, CS University of Jinan http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51285223 COc1cc2c(Nc3cccc(O)c3)c(cnc2cc1OCCCN(C)Cc1ccccc1)[N+]([O-])=O InChI=1S/C27H28N4O5/c1-30(18-19-8-4-3-5-9-19)12-7-13-36-26-16-23-22(15-25(26)35-2)27(24(17-28-23)31(33)34)29-20-10-6-11-21(32)14-20/h3-6,8-11,14-17,32H,7,12-13,18H2,1-2H3,(H,28,29) LSXUGQZBLRIRJF-UHFFFAOYSA-N 50523964 CHEMBL4472020 Cholinesterase 10770 ChEMBL 10.1016/j.bmcl.2019.03.050 10.7270/Q2QR51J6 30956012 Zhu, J; Wang, LN; Cai, R; Geng, SQ; Dong, YF; Liu, YM Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523964 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523964&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155535384 440732546 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51285225 COc1cc2c(Nc3cccc(Cl)c3)c(cnc2cc1OCCCN(C)Cc1ccccc1)[N+]([O-])=O InChI=1S/C27H27ClN4O4/c1-31(18-19-8-4-3-5-9-19)12-7-13-36-26-16-23-22(15-25(26)35-2)27(24(17-29-23)32(33)34)30-21-11-6-10-20(28)14-21/h3-6,8-11,14-17H,7,12-13,18H2,1-2H3,(H,29,30) OUXJQEJXEXYDCX-UHFFFAOYSA-N 50523966 CHEMBL4559011 Cholinesterase 15170 ChEMBL 10.1016/j.bmcl.2019.03.050 10.7270/Q2QR51J6 30956012 Zhu, J; Wang, LN; Cai, R; Geng, SQ; Dong, YF; Liu, YM Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523966 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523966&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155557434 440732548 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51285227 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 24410 ChEMBL 10.1016/j.bmcl.2019.03.050 10.7270/Q2QR51J6 30956012 Zhu, J; Wang, LN; Cai, R; Geng, SQ; Dong, YF; Liu, YM Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51285228 COc1cc2c(Nc3cccc(c3)C(F)(F)F)c(cnc2cc1OCCCN(C)Cc1ccccc1)[N+]([O-])=O InChI=1S/C28H27F3N4O4/c1-34(18-19-8-4-3-5-9-19)12-7-13-39-26-16-23-22(15-25(26)38-2)27(24(17-32-23)35(36)37)33-21-11-6-10-20(14-21)28(29,30)31/h3-6,8-11,14-17H,7,12-13,18H2,1-2H3,(H,32,33) VVYOHXFCTNHUDZ-UHFFFAOYSA-N 50523965 CHEMBL4514323 Cholinesterase 55410 ChEMBL 10.1016/j.bmcl.2019.03.050 10.7270/Q2QR51J6 30956012 Zhu, J; Wang, LN; Cai, R; Geng, SQ; Dong, YF; Liu, YM Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523965 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523965&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155539308 440732547 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51285229 COc1ccc(Nc2c(cnc3cc(OCCCN(C)Cc4ccccc4)c(OC)cc23)[N+]([O-])=O)cc1 InChI=1S/C28H30N4O5/c1-31(19-20-8-5-4-6-9-20)14-7-15-37-27-17-24-23(16-26(27)36-3)28(25(18-29-24)32(33)34)30-21-10-12-22(35-2)13-11-21/h4-6,8-13,16-18H,7,14-15,19H2,1-3H3,(H,29,30) LAGDYXRLMLJWBU-UHFFFAOYSA-N 50523968 CHEMBL4451869 Cholinesterase 50370 ChEMBL 10.1016/j.bmcl.2019.03.050 10.7270/Q2QR51J6 30956012 Zhu, J; Wang, LN; Cai, R; Geng, SQ; Dong, YF; Liu, YM Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523968 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523968&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155522022 440732550 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51285230 COc1cccc(Nc2c(cnc3cc(OCCCN(C)Cc4ccccc4)c(OC)cc23)[N+]([O-])=O)c1 InChI=1S/C28H30N4O5/c1-31(19-20-9-5-4-6-10-20)13-8-14-37-27-17-24-23(16-26(27)36-3)28(25(18-29-24)32(33)34)30-21-11-7-12-22(15-21)35-2/h4-7,9-12,15-18H,8,13-14,19H2,1-3H3,(H,29,30) NISOOKIWGVFDPP-UHFFFAOYSA-N 50523969 CHEMBL4565785 Cholinesterase 9190 ChEMBL 10.1016/j.bmcl.2019.03.050 10.7270/Q2QR51J6 30956012 Zhu, J; Wang, LN; Cai, R; Geng, SQ; Dong, YF; Liu, YM Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523969 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523969&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155545294 440732551 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51285231 COc1cc2c(Nc3ccc(C)cc3)c(cnc2cc1OCCCN(C)Cc1ccccc1)[N+]([O-])=O InChI=1S/C28H30N4O4/c1-20-10-12-22(13-11-20)30-28-23-16-26(35-3)27(17-24(23)29-18-25(28)32(33)34)36-15-7-14-31(2)19-21-8-5-4-6-9-21/h4-6,8-13,16-18H,7,14-15,19H2,1-3H3,(H,29,30) ZJUYEHSXNBHYBI-UHFFFAOYSA-N 50523970 CHEMBL4472782 Cholinesterase 73590 ChEMBL 10.1016/j.bmcl.2019.03.050 10.7270/Q2QR51J6 30956012 Zhu, J; Wang, LN; Cai, R; Geng, SQ; Dong, YF; Liu, YM Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523970 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523970&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155535888 440732552 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51285232 COc1cc2c(Nc3ccccc3C)c(cnc2cc1OCCCN(C)Cc1ccccc1)[N+]([O-])=O InChI=1S/C28H30N4O4/c1-20-10-7-8-13-23(20)30-28-22-16-26(35-3)27(17-24(22)29-18-25(28)32(33)34)36-15-9-14-31(2)19-21-11-5-4-6-12-21/h4-8,10-13,16-18H,9,14-15,19H2,1-3H3,(H,29,30) POLDIRNTSLXBIL-UHFFFAOYSA-N 50523971 CHEMBL4467849 Cholinesterase 29710 ChEMBL 10.1016/j.bmcl.2019.03.050 10.7270/Q2QR51J6 30956012 Zhu, J; Wang, LN; Cai, R; Geng, SQ; Dong, YF; Liu, YM Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523971 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523971&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155532570 440732553 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51285233 COc1cc2c(Nc3ccccc3Cl)c(cnc2cc1OCCCN(C)Cc1ccccc1)[N+]([O-])=O InChI=1S/C27H27ClN4O4/c1-31(18-19-9-4-3-5-10-19)13-8-14-36-26-16-23-20(15-25(26)35-2)27(24(17-29-23)32(33)34)30-22-12-7-6-11-21(22)28/h3-7,9-12,15-17H,8,13-14,18H2,1-2H3,(H,29,30) XTCLJHQOYFEPIY-UHFFFAOYSA-N 50523972 CHEMBL4571610 Cholinesterase 2650 ChEMBL 10.1016/j.bmcl.2019.03.050 10.7270/Q2QR51J6 30956012 Zhu, J; Wang, LN; Cai, R; Geng, SQ; Dong, YF; Liu, YM Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523972 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523972&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155562640 440732554 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51285234 COc1cc2c(Nc3ccccc3)c(cnc2cc1OCCCN(C)Cc1ccccc1)[N+]([O-])=O InChI=1S/C27H28N4O4/c1-30(19-20-10-5-3-6-11-20)14-9-15-35-26-17-23-22(16-25(26)34-2)27(24(18-28-23)31(32)33)29-21-12-7-4-8-13-21/h3-8,10-13,16-18H,9,14-15,19H2,1-2H3,(H,28,29) HUMCQUBRLLEIIW-UHFFFAOYSA-N 50523973 CHEMBL4440195 Cholinesterase 10110 ChEMBL 10.1016/j.bmcl.2019.03.050 10.7270/Q2QR51J6 30956012 Zhu, J; Wang, LN; Cai, R; Geng, SQ; Dong, YF; Liu, YM Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523973 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523973&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155514346 440732555 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51285235 [Cl-].COc1cc2c(Nc3ccc(Cl)cc3)c(cnc2cc1OCCC[n+]1ccccc1)[N+]([O-])=O InChI=1S/C24H22ClN4O4.ClH/c1-32-22-14-19-20(15-23(22)33-13-5-12-28-10-3-2-4-11-28)26-16-21(29(30)31)24(19)27-18-8-6-17(25)7-9-18;/h2-4,6-11,14-16H,5,12-13H2,1H3,(H,26,27);1H/q+1;/p-1 ROANKCOARTZITM-UHFFFAOYSA-M 50523974 CHEMBL4463625 Cholinesterase 14200 ChEMBL 10.1016/j.bmcl.2019.03.050 10.7270/Q2QR51J6 30956012 Zhu, J; Wang, LN; Cai, R; Geng, SQ; Dong, YF; Liu, YM Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523974 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523974&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155530242 440732556 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51285245 COc1cc2c(Nc3cccc(C)c3)c(cnc2cc1OCCCN(C)Cc1ccccc1)[N+]([O-])=O InChI=1S/C28H30N4O4/c1-20-9-7-12-22(15-20)30-28-23-16-26(35-3)27(17-24(23)29-18-25(28)32(33)34)36-14-8-13-31(2)19-21-10-5-4-6-11-21/h4-7,9-12,15-18H,8,13-14,19H2,1-3H3,(H,29,30) XHHNEZLAMQQWKG-UHFFFAOYSA-N 50523975 CHEMBL4442059 Cholinesterase 2780 ChEMBL 10.1016/j.bmcl.2019.03.050 10.7270/Q2QR51J6 30956012 Zhu, J; Wang, LN; Cai, R; Geng, SQ; Dong, YF; Liu, YM Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523975 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523975&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155515343 440732557 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51285247 COc1cc2c(Nc3ccc(Cl)cc3Cl)c(cnc2cc1OCCCN(C)Cc1ccccc1)[N+]([O-])=O InChI=1S/C27H26Cl2N4O4/c1-32(17-18-7-4-3-5-8-18)11-6-12-37-26-15-23-20(14-25(26)36-2)27(24(16-30-23)33(34)35)31-22-10-9-19(28)13-21(22)29/h3-5,7-10,13-16H,6,11-12,17H2,1-2H3,(H,30,31) XZSLQILWDCENBN-UHFFFAOYSA-N 50523967 CHEMBL4592262 Cholinesterase 58740 ChEMBL 10.1016/j.bmcl.2019.03.050 10.7270/Q2QR51J6 30956012 Zhu, J; Wang, LN; Cai, R; Geng, SQ; Dong, YF; Liu, YM Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523967 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523967&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155569423 440732549 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51285248 COc1cc2c(Nc3ccc(Cl)cc3)c(cnc2cc1OCCCN(C)Cc1ccccc1)[N+]([O-])=O InChI=1S/C27H27ClN4O4/c1-31(18-19-7-4-3-5-8-19)13-6-14-36-26-16-23-22(15-25(26)35-2)27(24(17-29-23)32(33)34)30-21-11-9-20(28)10-12-21/h3-5,7-12,15-17H,6,13-14,18H2,1-2H3,(H,29,30) XROQYDFRMMFXOS-UHFFFAOYSA-N 50523977 CHEMBL4513368 Cholinesterase 17450 ChEMBL 10.1016/j.bmcl.2019.03.050 10.7270/Q2QR51J6 30956012 Zhu, J; Wang, LN; Cai, R; Geng, SQ; Dong, YF; Liu, YM Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523977 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523977&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155538945 440732559 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51285253 COc1cc2c(Nc3ccc(O)cc3)c(cnc2cc1OCCCN(C)Cc1ccccc1)[N+]([O-])=O InChI=1S/C27H28N4O5/c1-30(18-19-7-4-3-5-8-19)13-6-14-36-26-16-23-22(15-25(26)35-2)27(24(17-28-23)31(33)34)29-20-9-11-21(32)12-10-20/h3-5,7-12,15-17,32H,6,13-14,18H2,1-2H3,(H,28,29) LYMCCDYMEGYDCC-UHFFFAOYSA-N 50523976 CHEMBL4440051 Cholinesterase 17380 ChEMBL 10.1016/j.bmcl.2019.03.050 10.7270/Q2QR51J6 30956012 Zhu, J; Wang, LN; Cai, R; Geng, SQ; Dong, YF; Liu, YM Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523976 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523976&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155514393 440732558 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51285254 COc1ccccc1Nc1c(cnc2cc(OCCCN(C)Cc3ccccc3)c(OC)cc12)[N+]([O-])=O InChI=1S/C28H30N4O5/c1-31(19-20-10-5-4-6-11-20)14-9-15-37-27-17-23-21(16-26(27)36-3)28(24(18-29-23)32(33)34)30-22-12-7-8-13-25(22)35-2/h4-8,10-13,16-18H,9,14-15,19H2,1-3H3,(H,29,30) QZKXJNZGOOPXEI-UHFFFAOYSA-N 50523978 CHEMBL4456112 Cholinesterase 8670 ChEMBL 10.1016/j.bmcl.2019.03.050 10.7270/Q2QR51J6 30956012 Zhu, J; Wang, LN; Cai, R; Geng, SQ; Dong, YF; Liu, YM Tianjin University of Technology http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523978 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523978&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155525190 440732560 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51286459 O=C(CN1CCCCC1)Nc1n[nH]c2ncccc12 InChI=1S/C13H17N5O/c19-11(9-18-7-2-1-3-8-18)15-13-10-5-4-6-14-12(10)16-17-13/h4-6H,1-3,7-9H2,(H2,14,15,16,17,19) PNRDLRAHZFTBEV-UHFFFAOYSA-N 50524452 CHEMBL4451095 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.04.038 10.7270/Q22V2KHC 31055149 Umar, T; Shalini, S; Raza, MK; Gusain, S; Kumar, J; Seth, P; Tiwari, M; Hoda, N Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524452 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524452&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155521666 440733034 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51286462 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 8710 ChEMBL 10.1016/j.ejmech.2019.04.038 10.7270/Q22V2KHC 31055149 Umar, T; Shalini, S; Raza, MK; Gusain, S; Kumar, J; Seth, P; Tiwari, M; Hoda, N Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51286463 CN1CCN(CC(=O)Nc2n[nH]c3ncccc23)CC1 InChI=1S/C13H18N6O/c1-18-5-7-19(8-6-18)9-11(20)15-13-10-3-2-4-14-12(10)16-17-13/h2-4H,5-9H2,1H3,(H2,14,15,16,17,20) NPBCCEIYDLINBB-UHFFFAOYSA-N 50524455 CHEMBL4560049 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.04.038 10.7270/Q22V2KHC 31055149 Umar, T; Shalini, S; Raza, MK; Gusain, S; Kumar, J; Seth, P; Tiwari, M; Hoda, N Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524455 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524455&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155510498 440733037 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51286464 O=C(CN1CCN(CC1)c1ncccc1C#N)Nc1n[nH]c2ncccc12 InChI=1S/C18H18N8O/c19-11-13-3-1-6-21-18(13)26-9-7-25(8-10-26)12-15(27)22-17-14-4-2-5-20-16(14)23-24-17/h1-6H,7-10,12H2,(H2,20,22,23,24,27) ZIKYYOZRFYCRPK-UHFFFAOYSA-N 50524453 CHEMBL4569884 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.04.038 10.7270/Q22V2KHC 31055149 Umar, T; Shalini, S; Raza, MK; Gusain, S; Kumar, J; Seth, P; Tiwari, M; Hoda, N Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524453 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524453&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155551698 440733035 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51286465 Cc1cc(N2CCN(CC(=O)Nc3n[nH]c4ncccc34)CC2)n2ncnc2n1 InChI=1S/C18H20N10O/c1-12-9-15(28-18(22-12)20-11-21-28)27-7-5-26(6-8-27)10-14(29)23-17-13-3-2-4-19-16(13)24-25-17/h2-4,9,11H,5-8,10H2,1H3,(H2,19,23,24,25,29) KSQYZELCKVEQEJ-UHFFFAOYSA-N 50524454 CHEMBL4474224 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.04.038 10.7270/Q22V2KHC 31055149 Umar, T; Shalini, S; Raza, MK; Gusain, S; Kumar, J; Seth, P; Tiwari, M; Hoda, N Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524454 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524454&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155536886 440733036 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51286466 O=C(CN1CCN(CC(=O)Nc2n[nH]c3ncccc23)CC1)Nc1n[nH]c2ncccc12 InChI=1S/C20H22N10O2/c31-15(23-19-13-3-1-5-21-17(13)25-27-19)11-29-7-9-30(10-8-29)12-16(32)24-20-14-4-2-6-22-18(14)26-28-20/h1-6H,7-12H2,(H2,21,23,25,27,31)(H2,22,24,26,28,32) KPEOGOPVKUTIJQ-UHFFFAOYSA-N 50524456 CHEMBL4444093 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.04.038 10.7270/Q22V2KHC 31055149 Umar, T; Shalini, S; Raza, MK; Gusain, S; Kumar, J; Seth, P; Tiwari, M; Hoda, N Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524456 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524456&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155517170 440733038 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51286467 CCOC(=O)c1cnc2ccccc2c1N1CCN(CC(=O)Nc2n[nH]c3ncccc23)CC1 InChI=1S/C24H25N7O3/c1-2-34-24(33)18-14-26-19-8-4-3-6-16(19)21(18)31-12-10-30(11-13-31)15-20(32)27-23-17-7-5-9-25-22(17)28-29-23/h3-9,14H,2,10-13,15H2,1H3,(H2,25,27,28,29,32) LEMLONYYHOVZFQ-UHFFFAOYSA-N 50524457 CHEMBL4453548 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.04.038 10.7270/Q22V2KHC 31055149 Umar, T; Shalini, S; Raza, MK; Gusain, S; Kumar, J; Seth, P; Tiwari, M; Hoda, N Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524457 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524457&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155522864 440733039 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51286474 O=C(CN1CCOCC1)Nc1n[nH]c2ncccc12 InChI=1S/C12H15N5O2/c18-10(8-17-4-6-19-7-5-17)14-12-9-2-1-3-13-11(9)15-16-12/h1-3H,4-8H2,(H2,13,14,15,16,18) RVWMNZMCXBRAGC-UHFFFAOYSA-N 50524459 CHEMBL4437109 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.04.038 10.7270/Q22V2KHC 31055149 Umar, T; Shalini, S; Raza, MK; Gusain, S; Kumar, J; Seth, P; Tiwari, M; Hoda, N Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524459 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524459&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155512356 440733041 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51286475 CCOC(=O)c1cnc2ccc(C)cc2c1N1CCN(CC(=O)Nc2n[nH]c3ncccc23)CC1 InChI=1S/C25H27N7O3/c1-3-35-25(34)19-14-27-20-7-6-16(2)13-18(20)22(19)32-11-9-31(10-12-32)15-21(33)28-24-17-5-4-8-26-23(17)29-30-24/h4-8,13-14H,3,9-12,15H2,1-2H3,(H2,26,28,29,30,33) UNZLOHMKHJXERK-UHFFFAOYSA-N 50524458 CHEMBL4439198 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.04.038 10.7270/Q22V2KHC 31055149 Umar, T; Shalini, S; Raza, MK; Gusain, S; Kumar, J; Seth, P; Tiwari, M; Hoda, N Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524458 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524458&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155513680 440733040 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51286480 Clc1ccc2c(ccnc2c1)N1CCN(CC(=O)Nc2n[nH]c3ncccc23)CC1 InChI=1S/C21H20ClN7O/c22-14-3-4-15-17(12-14)23-7-5-18(15)29-10-8-28(9-11-29)13-19(30)25-21-16-2-1-6-24-20(16)26-27-21/h1-7,12H,8-11,13H2,(H2,24,25,26,27,30) LTQAWGKHJBZJMG-UHFFFAOYSA-N 50524460 CHEMBL4437847 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2019.04.038 10.7270/Q22V2KHC 31055149 Umar, T; Shalini, S; Raza, MK; Gusain, S; Kumar, J; Seth, P; Tiwari, M; Hoda, N Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524460 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524460&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155513040 440733042 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314703 Cc1c(C)c(=O)oc2cc(OC3CCN(CCc4ccccc4)CC3)ccc12 InChI=1S/C24H27NO3/c1-17-18(2)24(26)28-23-16-21(8-9-22(17)23)27-20-11-14-25(15-12-20)13-10-19-6-4-3-5-7-19/h3-9,16,20H,10-15H2,1-2H3 HIBJQIBFQCSPQC-UHFFFAOYSA-N 50532732 CHEMBL4473562 Cholinesterase 1770 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50532732 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50532732&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155536279 440741314 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314704 Cl.Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4cccc(Cl)c4)C3)ccc12 InChI=1S/C24H26ClNO3.ClH/c1-16-17(2)24(27)29-23-12-21(8-9-22(16)23)28-15-19-6-4-10-26(14-19)13-18-5-3-7-20(25)11-18;/h3,5,7-9,11-12,19H,4,6,10,13-15H2,1-2H3;1H DVHSQXOMDRSHCZ-UHFFFAOYSA-N 50532737 CHEMBL4447506 Cholinesterase 4690 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50532737 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50532737&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155519043 440741319 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314705 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 2310 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314723 Cc1c(C)c(=O)oc2cc(OC3CCN(Cc4ccccc4)CC3)ccc12 InChI=1S/C23H25NO3/c1-16-17(2)23(25)27-22-14-20(8-9-21(16)22)26-19-10-12-24(13-11-19)15-18-6-4-3-5-7-18/h3-9,14,19H,10-13,15H2,1-2H3 DCRCANSGLMNLEA-UHFFFAOYSA-N 50532718 CHEMBL4569054 Cholinesterase 9570 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50532718 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50532718&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155550841 440741300 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314724 Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccccc4)C3)ccc12 InChI=1S/C24H27NO3/c1-17-18(2)24(26)28-23-13-21(10-11-22(17)23)27-16-20-9-6-12-25(15-20)14-19-7-4-3-5-8-19/h3-5,7-8,10-11,13,20H,6,9,12,14-16H2,1-2H3 HKIDXMKKZYHFEM-UHFFFAOYSA-N 50532731 CHEMBL4571763 Cholinesterase 2910 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50532731 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50532731&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155525760 440741313 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314725 Cc1c(C)c(=O)oc2cc(OCCCN3CCc4ccccc4C3)ccc12 InChI=1S/C23H25NO3/c1-16-17(2)23(25)27-22-14-20(8-9-21(16)22)26-13-5-11-24-12-10-18-6-3-4-7-19(18)15-24/h3-4,6-9,14H,5,10-13,15H2,1-2H3 CACNJUZLFSDMHF-UHFFFAOYSA-N 50506899 CHEMBL4574355 Cholinesterase 950 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50506899 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50506899&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155542981 440715484 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314732 Cl.Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccc(F)cc4)C3)ccc12 InChI=1S/C24H26FNO3.ClH/c1-16-17(2)24(27)29-23-12-21(9-10-22(16)23)28-15-19-4-3-11-26(14-19)13-18-5-7-20(25)8-6-18;/h5-10,12,19H,3-4,11,13-15H2,1-2H3;1H YOWUEPXICGUKNK-UHFFFAOYSA-N 50532725 CHEMBL4439320 Cholinesterase 3690 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50532725 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50532725&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155513877 440741307 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316504 CC1CCCN(CCCCCCOc2cccc(Cl)c2)C1 InChI=1S/C18H28ClNO/c1-16-8-7-12-20(15-16)11-4-2-3-5-13-21-18-10-6-9-17(19)14-18/h6,9-10,14,16H,2-5,7-8,11-13,15H2,1H3 WBOGZBAYZRFZSE-UHFFFAOYSA-N 50533181 CHEMBL3747896 Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533181 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533181&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127038673 440741763 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316508 CC1CCN(CCCCCOc2ccc(Cl)cc2)CC1 InChI=1S/C17H26ClNO/c1-15-9-12-19(13-10-15)11-3-2-4-14-20-17-7-5-16(18)6-8-17/h5-8,15H,2-4,9-14H2,1H3 OZPNEALQKHYBAJ-UHFFFAOYSA-N 50533184 CHEMBL3747893 Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533184 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533184&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127038668 440741766 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316513 CC1CCN(CCCCCOc2ccc(Cl)cc2)CC1 InChI=1S/C17H26ClNO/c1-15-9-12-19(13-10-15)11-3-2-4-14-20-17-7-5-16(18)6-8-17/h5-8,15H,2-4,9-14H2,1H3 OZPNEALQKHYBAJ-UHFFFAOYSA-N 50533184 CHEMBL3747893 Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533184 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533184&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127038668 440741766 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316514 CC1CCCN(CCCCCCOc2cccc(Cl)c2)C1 InChI=1S/C18H28ClNO/c1-16-8-7-12-20(15-16)11-4-2-3-5-13-21-18-10-6-9-17(19)14-18/h6,9-10,14,16H,2-5,7-8,11-13,15H2,1H3 WBOGZBAYZRFZSE-UHFFFAOYSA-N 50533181 CHEMBL3747896 Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533181 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533181&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127038673 440741763 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316527 Clc1ccc(OCCCCCN2CCCCC2)cc1 InChI=1S/C16H24ClNO/c17-15-7-9-16(10-8-15)19-14-6-2-5-13-18-11-3-1-4-12-18/h7-10H,1-6,11-14H2 CISLNJILBFCUJI-UHFFFAOYSA-N 50533182 CHEMBL3747891 Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533182 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533182&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 2843471 440741764 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316528 Clc1ccc(OCCCCCCCN2CCCCC2)cc1 InChI=1S/C18H28ClNO/c19-17-9-11-18(12-10-17)21-16-8-3-1-2-5-13-20-14-6-4-7-15-20/h9-12H,1-8,13-16H2 BNRCWTHOFLFDDE-UHFFFAOYSA-N 50508998 CHEMBL3747907 Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50508998 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50508998&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127040592 440717583 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316529 CC1CCCN(CCCCCOc2ccc(Cl)cc2)C1 InChI=1S/C17H26ClNO/c1-15-6-5-12-19(14-15)11-3-2-4-13-20-17-9-7-16(18)8-10-17/h7-10,15H,2-6,11-14H2,1H3 GPTIYOZHRGPQPV-UHFFFAOYSA-N 50533191 CHEMBL3747892 Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533191 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533191&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127040267 440741773 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316530 CC1CCCN(CCCCCCCOc2ccc(Cl)cc2)C1 InChI=1S/C19H30ClNO/c1-17-8-7-14-21(16-17)13-5-3-2-4-6-15-22-19-11-9-18(20)10-12-19/h9-12,17H,2-8,13-16H2,1H3 KCDBGISMCSMDRJ-UHFFFAOYSA-N 50533192 CHEMBL3747908 Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533192 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533192&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127038945 440741774 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316531 CC1CCN(CCCCCCOc2ccc(Cl)cc2)CC1 InChI=1S/C18H28ClNO/c1-16-10-13-20(14-11-16)12-4-2-3-5-15-21-18-8-6-17(19)7-9-18/h6-9,16H,2-5,10-15H2,1H3 QOQMTYKSXCQWFH-UHFFFAOYSA-N 50533187 CHEMBL3747901 Cholinesterase 5430 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533187 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533187&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127038686 440741769 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316532 CC1CCN(CCCCCCCOc2ccc(Cl)cc2)CC1 InChI=1S/C19H30ClNO/c1-17-11-14-21(15-12-17)13-5-3-2-4-6-16-22-19-9-7-18(20)8-10-19/h7-10,17H,2-6,11-16H2,1H3 XPZSFEKMWDEMKG-UHFFFAOYSA-N 50533183 CHEMBL3747909 Cholinesterase 2920 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533183 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533183&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127040256 440741765 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316533 Clc1ccc(OCCCCCCCN2CCCCCC2)cc1 InChI=1S/C19H30ClNO/c20-18-10-12-19(13-11-18)22-17-9-5-1-2-6-14-21-15-7-3-4-8-16-21/h10-13H,1-9,14-17H2 RIFYNBIQUGNAIX-UHFFFAOYSA-N 50533180 CHEMBL3747910 Cholinesterase 1640 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533180 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533180&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127041626 440741762 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316534 Clc1cccc(OCCCCCCN2CCCCC2)c1 InChI=1S/C17H26ClNO/c18-16-9-8-10-17(15-16)20-14-7-2-1-4-11-19-12-5-3-6-13-19/h8-10,15H,1-7,11-14H2 LXKXCCJFOWBMCZ-UHFFFAOYSA-N 50533193 CHEMBL3747895 Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533193 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533193&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 2057716 440741775 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316535 Clc1cccc(OCCCCCCCN2CCCCC2)c1 InChI=1S/C18H28ClNO/c19-17-10-9-11-18(16-17)21-15-8-3-1-2-5-12-20-13-6-4-7-14-20/h9-11,16H,1-8,12-15H2 INFPAWWZLAODKB-UHFFFAOYSA-N 50533194 CHEMBL3747903 Cholinesterase 4750 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533194 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533194&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127039029 440741776 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316536 CC1CCN(CCCCCCOc2cccc(Cl)c2)CC1 InChI=1S/C18H28ClNO/c1-16-9-12-20(13-10-16)11-4-2-3-5-14-21-18-8-6-7-17(19)15-18/h6-8,15-16H,2-5,9-14H2,1H3 UPPYCJOYNPALJZ-UHFFFAOYSA-N 50533188 CHEMBL3747897 Cholinesterase 3530 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533188 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533188&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127038675 440741770 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316537 CC1CCN(CCCCCCCOc2cccc(Cl)c2)CC1 InChI=1S/C19H30ClNO/c1-17-10-13-21(14-11-17)12-5-3-2-4-6-15-22-19-9-7-8-18(20)16-19/h7-9,16-17H,2-6,10-15H2,1H3 YSGPRIFLIJFIDY-UHFFFAOYSA-N 50533189 CHEMBL3747905 Cholinesterase 1660 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533189 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533189&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127039033 440741771 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316538 Clc1cccc(OCCCCCCCN2CCCCCC2)c1 InChI=1S/C19H30ClNO/c20-18-11-10-12-19(17-18)22-16-9-5-1-2-6-13-21-14-7-3-4-8-15-21/h10-12,17H,1-9,13-16H2 ZIDOLPDWARBWCM-UHFFFAOYSA-N 50533186 CHEMBL3747906 Cholinesterase 900 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533186 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533186&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127041329 440741768 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316539 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 1830 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316540 Clc1ccc(OCCCOCCCN2CCCCCC2)cc1 InChI=1S/C18H28ClNO2/c19-17-7-9-18(10-8-17)22-16-6-15-21-14-5-13-20-11-3-1-2-4-12-20/h7-10H,1-6,11-16H2 JGFWTZPEFKPIHN-UHFFFAOYSA-N 50533190 CHEMBL4452966 Cholinesterase 4970 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533190 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533190&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 42629970 440741772 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316553 C(COc1ccc2N=C3CCCN3Cc2c1)CN1CCCCC1 InChI=1S/C19H27N3O/c1-2-9-21(10-3-1)11-5-13-23-17-7-8-18-16(14-17)15-22-12-4-6-19(22)20-18/h7-8,14H,1-6,9-13,15H2 UVYNECUSQBZMSD-UHFFFAOYSA-N 50053435 CHEMBL3323035 Cholinesterase 8200 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053435 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053435&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710487 103950116 CHEMBL3323035 ZINC03815717 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51287004 Cl.C(CN1CCCc2[nH]c3ccccc3c2C1)Cc1ccccc1 InChI=1S/C21H24N2.ClH/c1-2-8-17(9-3-1)10-6-14-23-15-7-13-21-19(16-23)18-11-4-5-12-20(18)22-21;/h1-5,8-9,11-12,22H,6-7,10,13-16H2;1H LYUUNERXWJVNQH-UHFFFAOYSA-N 50524739 CHEMBL4570863 Cholinesterase 280 ChEMBL 10.1016/j.ejmech.2019.05.062 10.7270/Q2RF5ZGP 31158754 Purgatorio, R; de Candia, M; Catto, M; Carrieri, A; Pisani, L; De Palma, A; Toma, M; Ivanova, OA; Voskressensky, LG; Altomare, CD University of Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524739 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524739&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155562728 440733321 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51287006 Cl.Fc1ccc2[nH]c3CCCN(Cc4ccccc4)Cc3c2c1 InChI=1S/C19H19FN2.ClH/c20-15-8-9-19-16(11-15)17-13-22(10-4-7-18(17)21-19)12-14-5-2-1-3-6-14;/h1-3,5-6,8-9,11,21H,4,7,10,12-13H2;1H LIZUZGJMGPCRKQ-UHFFFAOYSA-N 50524741 CHEMBL4464662 Cholinesterase 2130 ChEMBL 10.1016/j.ejmech.2019.05.062 10.7270/Q2RF5ZGP 31158754 Purgatorio, R; de Candia, M; Catto, M; Carrieri, A; Pisani, L; De Palma, A; Toma, M; Ivanova, OA; Voskressensky, LG; Altomare, CD University of Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524741 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524741&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155530532 440733323 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51287008 C1CNCc2c(C1)[nH]c1ccccc21 InChI=1S/C12H14N2/c1-2-5-11-9(4-1)10-8-13-7-3-6-12(10)14-11/h1-2,4-5,13-14H,3,6-8H2 RMXBKBFEKGCARG-UHFFFAOYSA-N 50524743 CHEMBL4472742 Cholinesterase 20000 ChEMBL 10.1016/j.ejmech.2019.05.062 10.7270/Q2RF5ZGP 31158754 Purgatorio, R; de Candia, M; Catto, M; Carrieri, A; Pisani, L; De Palma, A; Toma, M; Ivanova, OA; Voskressensky, LG; Altomare, CD University of Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524743 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524743&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 21885955 440733325 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51287009 Cl.Cc1ccc(CN2CCCc3[nH]c4ccccc4c3C2)cc1 InChI=1S/C20H22N2.ClH/c1-15-8-10-16(11-9-15)13-22-12-4-7-20-18(14-22)17-5-2-3-6-19(17)21-20;/h2-3,5-6,8-11,21H,4,7,12-14H2,1H3;1H ZTPVWFRIMZUJCH-UHFFFAOYSA-N 50524744 CHEMBL4459186 Cholinesterase 950 ChEMBL 10.1016/j.ejmech.2019.05.062 10.7270/Q2RF5ZGP 31158754 Purgatorio, R; de Candia, M; Catto, M; Carrieri, A; Pisani, L; De Palma, A; Toma, M; Ivanova, OA; Voskressensky, LG; Altomare, CD University of Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524744 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524744&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155526530 440733326 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51287010 Cl.Fc1ccc(CN2CCCc3[nH]c4ccc(F)cc4c3C2)cc1 InChI=1S/C19H18F2N2.ClH/c20-14-5-3-13(4-6-14)11-23-9-1-2-18-17(12-23)16-10-15(21)7-8-19(16)22-18;/h3-8,10,22H,1-2,9,11-12H2;1H CGPJBPDFESWLMK-UHFFFAOYSA-N 50524742 CHEMBL4577733 Cholinesterase 2900 ChEMBL 10.1016/j.ejmech.2019.05.062 10.7270/Q2RF5ZGP 31158754 Purgatorio, R; de Candia, M; Catto, M; Carrieri, A; Pisani, L; De Palma, A; Toma, M; Ivanova, OA; Voskressensky, LG; Altomare, CD University of Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524742 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524742&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155564779 440733324 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51287011 Cl.Cl.CCN(CC)Cc1ccc(CN2CCCc3[nH]c4ccc(F)cc4c3C2)cc1 InChI=1S/C24H30FN3.2ClH/c1-3-27(4-2)15-18-7-9-19(10-8-18)16-28-13-5-6-23-22(17-28)21-14-20(25)11-12-24(21)26-23;;/h7-12,14,26H,3-6,13,15-17H2,1-2H3;2*1H IMWUGRRCPNOHGU-UHFFFAOYSA-N 50524745 CHEMBL4469564 Cholinesterase 1400 ChEMBL 10.1016/j.ejmech.2019.05.062 10.7270/Q2RF5ZGP 31158754 Purgatorio, R; de Candia, M; Catto, M; Carrieri, A; Pisani, L; De Palma, A; Toma, M; Ivanova, OA; Voskressensky, LG; Altomare, CD University of Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524745 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524745&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155533797 440733327 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51287012 Cl.Fc1ccc2[nH]c3CCCN(Cc4ccc(CN5CCCC5)cc4)Cc3c2c1 InChI=1S/C24H28FN3.ClH/c25-20-9-10-24-21(14-20)22-17-28(13-3-4-23(22)26-24)16-19-7-5-18(6-8-19)15-27-11-1-2-12-27;/h5-10,14,26H,1-4,11-13,15-17H2;1H VXYXWLCJZNEYSL-UHFFFAOYSA-N 50524746 CHEMBL4445531 Cholinesterase 4300 ChEMBL 10.1016/j.ejmech.2019.05.062 10.7270/Q2RF5ZGP 31158754 Purgatorio, R; de Candia, M; Catto, M; Carrieri, A; Pisani, L; De Palma, A; Toma, M; Ivanova, OA; Voskressensky, LG; Altomare, CD University of Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524746 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524746&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155517763 440733328 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51287013 Cl.C(Cc1ccccc1)N1CCCc2[nH]c3ccccc3c2C1 InChI=1S/C20H22N2.ClH/c1-2-7-16(8-3-1)12-14-22-13-6-11-20-18(15-22)17-9-4-5-10-19(17)21-20;/h1-5,7-10,21H,6,11-15H2;1H YFJGSHHXRNGKCC-UHFFFAOYSA-N 50524747 CHEMBL4453569 Cholinesterase 700 ChEMBL 10.1016/j.ejmech.2019.05.062 10.7270/Q2RF5ZGP 31158754 Purgatorio, R; de Candia, M; Catto, M; Carrieri, A; Pisani, L; De Palma, A; Toma, M; Ivanova, OA; Voskressensky, LG; Altomare, CD University of Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524747 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524747&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155523117 440733329 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51287014 Cl.Cn1c2CCCN(CCc3ccccc3)Cc2c2ccccc12 InChI=1S/C21H24N2.ClH/c1-22-20-11-6-5-10-18(20)19-16-23(14-7-12-21(19)22)15-13-17-8-3-2-4-9-17;/h2-6,8-11H,7,12-16H2,1H3;1H ICTYKBWPIIODCB-UHFFFAOYSA-N 50524748 CHEMBL4452751 Cholinesterase 860 ChEMBL 10.1016/j.ejmech.2019.05.062 10.7270/Q2RF5ZGP 31158754 Purgatorio, R; de Candia, M; Catto, M; Carrieri, A; Pisani, L; De Palma, A; Toma, M; Ivanova, OA; Voskressensky, LG; Altomare, CD University of Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524748 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524748&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155522608 440733330 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51287015 Cl.C(CCc1ccccc1)CN1CCCc2[nH]c3ccccc3c2C1 InChI=1S/C22H26N2.ClH/c1-2-9-18(10-3-1)11-6-7-15-24-16-8-14-22-20(17-24)19-12-4-5-13-21(19)23-22;/h1-5,9-10,12-13,23H,6-8,11,14-17H2;1H LZSQOYVTOYGVCC-UHFFFAOYSA-N 50524749 CHEMBL4538834 Cholinesterase 170 ChEMBL 10.1016/j.ejmech.2019.05.062 10.7270/Q2RF5ZGP 31158754 Purgatorio, R; de Candia, M; Catto, M; Carrieri, A; Pisani, L; De Palma, A; Toma, M; Ivanova, OA; Voskressensky, LG; Altomare, CD University of Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524749 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524749&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155549427 440733331 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51287028 Fc1ccc2[nH]c3CCCNCc3c2c1 InChI=1S/C12H13FN2/c13-8-3-4-12-9(6-8)10-7-14-5-1-2-11(10)15-12/h3-4,6,14-15H,1-2,5,7H2 ZFHSVILTWVPKJW-UHFFFAOYSA-N 50524754 CHEMBL4440707 Cholinesterase 4300 ChEMBL 10.1016/j.ejmech.2019.05.062 10.7270/Q2RF5ZGP 31158754 Purgatorio, R; de Candia, M; Catto, M; Carrieri, A; Pisani, L; De Palma, A; Toma, M; Ivanova, OA; Voskressensky, LG; Altomare, CD University of Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524754 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524754&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 28744198 440733336 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51287029 CN1CCCc2[nH]c3ccc(C)cc3c2C1 InChI=1S/C14H18N2/c1-10-5-6-14-11(8-10)12-9-16(2)7-3-4-13(12)15-14/h5-6,8,15H,3-4,7,9H2,1-2H3 VYGKFRVQBRFNPW-UHFFFAOYSA-N 50524751 CHEMBL4518716 Cholinesterase 7100 ChEMBL 10.1016/j.ejmech.2019.05.062 10.7270/Q2RF5ZGP 31158754 Purgatorio, R; de Candia, M; Catto, M; Carrieri, A; Pisani, L; De Palma, A; Toma, M; Ivanova, OA; Voskressensky, LG; Altomare, CD University of Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524751 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524751&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 24899050 440733333 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51287030 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 2300 ChEMBL 10.1016/j.ejmech.2019.05.062 10.7270/Q2RF5ZGP 31158754 Purgatorio, R; de Candia, M; Catto, M; Carrieri, A; Pisani, L; De Palma, A; Toma, M; Ivanova, OA; Voskressensky, LG; Altomare, CD University of Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316634 Clc1ccc(OCCCCCN2CCCCCC2)cc1 InChI=1S/C17H26ClNO/c18-16-8-10-17(11-9-16)20-15-7-3-6-14-19-12-4-1-2-5-13-19/h8-11H,1-7,12-15H2 GRIAEUIELDSSBS-UHFFFAOYSA-N 50533197 CHEMBL3747894 Cholinesterase 3450 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533197 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533197&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127038670 440741779 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316635 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 2.0 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51287031 Cl.Cc1ccc2[nH]c3CCCN(Cc4ccccc4)Cc3c2c1 InChI=1S/C20H22N2.ClH/c1-15-9-10-20-17(12-15)18-14-22(11-5-8-19(18)21-20)13-16-6-3-2-4-7-16;/h2-4,6-7,9-10,12,21H,5,8,11,13-14H2,1H3;1H XTBSNYUIDSMONC-UHFFFAOYSA-N 50524755 CHEMBL4455138 Cholinesterase 1200 ChEMBL 10.1016/j.ejmech.2019.05.062 10.7270/Q2RF5ZGP 31158754 Purgatorio, R; de Candia, M; Catto, M; Carrieri, A; Pisani, L; De Palma, A; Toma, M; Ivanova, OA; Voskressensky, LG; Altomare, CD University of Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524755 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524755&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155524557 440733337 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51287036 CN1CCCc2[nH]c3ccccc3c2C1 InChI=1S/C13H16N2/c1-15-8-4-7-13-11(9-15)10-5-2-3-6-12(10)14-13/h2-3,5-6,14H,4,7-9H2,1H3 WGVSPPPAPBTTFU-UHFFFAOYSA-N 50524750 CHEMBL4591804 Cholinesterase 25000 ChEMBL 10.1016/j.ejmech.2019.05.062 10.7270/Q2RF5ZGP 31158754 Purgatorio, R; de Candia, M; Catto, M; Carrieri, A; Pisani, L; De Palma, A; Toma, M; Ivanova, OA; Voskressensky, LG; Altomare, CD University of Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524750 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524750&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10954584 440733332 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51287039 Cl.C(N1CCCc2[nH]c3ccccc3c2C1)c1ccccc1 InChI=1S/C19H20N2.ClH/c1-2-7-15(8-3-1)13-21-12-6-11-19-17(14-21)16-9-4-5-10-18(16)20-19;/h1-5,7-10,20H,6,11-14H2;1H KBABKGDMHRREKA-UHFFFAOYSA-N 50524752 CHEMBL4436327 Cholinesterase 2000 ChEMBL 10.1016/j.ejmech.2019.05.062 10.7270/Q2RF5ZGP 31158754 Purgatorio, R; de Candia, M; Catto, M; Carrieri, A; Pisani, L; De Palma, A; Toma, M; Ivanova, OA; Voskressensky, LG; Altomare, CD University of Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524752 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524752&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155511855 440733334 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51287040 Cl.Fc1ccc(CN2CCCc3[nH]c4ccccc4c3C2)cc1 InChI=1S/C19H19FN2.ClH/c20-15-9-7-14(8-10-15)12-22-11-3-6-19-17(13-22)16-4-1-2-5-18(16)21-19;/h1-2,4-5,7-10,21H,3,6,11-13H2;1H YPUKBBREUZVRIO-UHFFFAOYSA-N 50524757 CHEMBL4471250 Cholinesterase 1200 ChEMBL 10.1016/j.ejmech.2019.05.062 10.7270/Q2RF5ZGP 31158754 Purgatorio, R; de Candia, M; Catto, M; Carrieri, A; Pisani, L; De Palma, A; Toma, M; Ivanova, OA; Voskressensky, LG; Altomare, CD University of Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524757 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524757&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155534881 440733339 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51287041 Fc1ccc2[nH]c3CN(Cc4ccccc4)CCCc3c2c1 InChI=1S/C19H19FN2/c20-15-8-9-18-17(11-15)16-7-4-10-22(13-19(16)21-18)12-14-5-2-1-3-6-14/h1-3,5-6,8-9,11,21H,4,7,10,12-13H2 QYNXTONXAWXBJH-UHFFFAOYSA-N 50524756 CHEMBL4537928 Cholinesterase 3400 ChEMBL 10.1016/j.ejmech.2019.05.062 10.7270/Q2RF5ZGP 31158754 Purgatorio, R; de Candia, M; Catto, M; Carrieri, A; Pisani, L; De Palma, A; Toma, M; Ivanova, OA; Voskressensky, LG; Altomare, CD University of Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524756 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524756&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71425513 440733338 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51287042 Cl.C(CCc1ccccc1)CN1CCCc2[nH]c3ccccc3c2C1 InChI=1S/C22H26N2.ClH/c1-2-9-18(10-3-1)11-6-7-15-24-16-8-14-22-20(17-24)19-12-4-5-13-21(19)23-22;/h1-5,9-10,12-13,23H,6-8,11,14-17H2;1H LZSQOYVTOYGVCC-UHFFFAOYSA-N 50524749 CHEMBL4538834 Cholinesterase 98 ChEMBL 10.1016/j.ejmech.2019.05.062 10.7270/Q2RF5ZGP 31158754 Purgatorio, R; de Candia, M; Catto, M; Carrieri, A; Pisani, L; De Palma, A; Toma, M; Ivanova, OA; Voskressensky, LG; Altomare, CD University of Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524749 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524749&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155549427 440733331 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51287046 Cc1ccc2[nH]c3CCCNCc3c2c1 InChI=1S/C13H16N2/c1-9-4-5-13-10(7-9)11-8-14-6-2-3-12(11)15-13/h4-5,7,14-15H,2-3,6,8H2,1H3 AGYKCDXZESDFNO-UHFFFAOYSA-N 50524740 CHEMBL4451370 Cholinesterase 8000 ChEMBL 10.1016/j.ejmech.2019.05.062 10.7270/Q2RF5ZGP 31158754 Purgatorio, R; de Candia, M; Catto, M; Carrieri, A; Pisani, L; De Palma, A; Toma, M; Ivanova, OA; Voskressensky, LG; Altomare, CD University of Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524740 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524740&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 28744193 440733322 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51287047 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 12000 ChEMBL 10.1016/j.ejmech.2019.05.062 10.7270/Q2RF5ZGP 31158754 Purgatorio, R; de Candia, M; Catto, M; Carrieri, A; Pisani, L; De Palma, A; Toma, M; Ivanova, OA; Voskressensky, LG; Altomare, CD University of Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51287049 Fc1ccc2[nH]c3CCCN(Cc3c2c1)C(=O)c1ccccc1 InChI=1S/C19H17FN2O/c20-14-8-9-18-15(11-14)16-12-22(10-4-7-17(16)21-18)19(23)13-5-2-1-3-6-13/h1-3,5-6,8-9,11,21H,4,7,10,12H2 CHAQNPLLDMSFGR-UHFFFAOYSA-N 50524753 CHEMBL4565173 Cholinesterase 6000 ChEMBL 10.1016/j.ejmech.2019.05.062 10.7270/Q2RF5ZGP 31158754 Purgatorio, R; de Candia, M; Catto, M; Carrieri, A; Pisani, L; De Palma, A; Toma, M; Ivanova, OA; Voskressensky, LG; Altomare, CD University of Bari Aldo Moro http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50524753 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50524753&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155560170 440733335 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314533 Cl.Cc1c(C)c(=O)oc2cc(OCC3CCN(Cc4cccc(Cl)c4)CC3)ccc12 InChI=1S/C24H26ClNO3.ClH/c1-16-17(2)24(27)29-23-13-21(6-7-22(16)23)28-15-18-8-10-26(11-9-18)14-19-4-3-5-20(25)12-19;/h3-7,12-13,18H,8-11,14-15H2,1-2H3;1H GDJVHXJRIIZVEJ-UHFFFAOYSA-N 50532721 CHEMBL4539659 Cholinesterase 6070 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50532721 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50532721&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155550007 440741303 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314534 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 2310 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314535 Cc1c(C)c(=O)oc2cc(OCCCN3CCc4ccccc4C3)ccc12 InChI=1S/C23H25NO3/c1-16-17(2)23(25)27-22-14-20(8-9-21(16)22)26-13-5-11-24-12-10-18-6-3-4-7-19(18)15-24/h3-4,6-9,14H,5,10-13,15H2,1-2H3 CACNJUZLFSDMHF-UHFFFAOYSA-N 50506899 CHEMBL4574355 Cholinesterase 950 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50506899 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50506899&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155542981 440715484 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314547 Cl.Cc1c(C)c(=O)oc2cc(OCC3CCN(Cc4ccccc4)CC3)ccc12 InChI=1S/C24H27NO3.ClH/c1-17-18(2)24(26)28-23-14-21(8-9-22(17)23)27-16-20-10-12-25(13-11-20)15-19-6-4-3-5-7-19;/h3-9,14,20H,10-13,15-16H2,1-2H3;1H PQISJODIMAREMD-UHFFFAOYSA-N 50532726 CHEMBL4472789 Cholinesterase 4720 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50532726 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50532726&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155535904 440741308 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314559 Cc1c(C)c(=O)oc2cc(OC3CCN(CCc4ccccc4)CC3)ccc12 InChI=1S/C24H27NO3/c1-17-18(2)24(26)28-23-16-21(8-9-22(17)23)27-20-11-14-25(15-12-20)13-10-19-6-4-3-5-7-19/h3-9,16,20H,10-15H2,1-2H3 HIBJQIBFQCSPQC-UHFFFAOYSA-N 50532732 CHEMBL4473562 Cholinesterase 1770 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50532732 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50532732&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155536279 440741314 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51282393 CCn1ncc2c(NC3CCCCC3)c(cnc12)C(=O)NCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C35H47N7O/c1-2-42-34-28(24-39-42)33(40-25-15-7-6-8-16-25)29(23-38-34)35(43)37-22-14-5-3-4-13-21-36-32-26-17-9-11-19-30(26)41-31-20-12-10-18-27(31)32/h9,11,17,19,23-25H,2-8,10,12-16,18,20-22H2,1H3,(H,36,41)(H,37,43)(H,38,40) MXLBGHWQAVPECV-UHFFFAOYSA-N 50523000 CHEMBL4543665 Cholinesterase 324 ChEMBL 10.1016/j.bmcl.2019.06.056 10.7270/Q2GH9NBW 31281020 Pan, T; Xie, S; Zhou, Y; Hu, J; Luo, H; Li, X; Huang, L Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523000 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523000&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155552465 440731582 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51282403 CCn1ncc2c(NC3CCCCC3)c(cnc12)C(=O)NCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C30H37N7O/c1-2-37-29-23(19-34-37)28(35-20-10-4-3-5-11-20)24(18-33-29)30(38)32-17-16-31-27-21-12-6-8-14-25(21)36-26-15-9-7-13-22(26)27/h6,8,12,14,18-20H,2-5,7,9-11,13,15-17H2,1H3,(H,31,36)(H,32,38)(H,33,35) SBWPXDUGJRKADY-UHFFFAOYSA-N 50523003 CHEMBL4538132 Cholinesterase 891 ChEMBL 10.1016/j.bmcl.2019.06.056 10.7270/Q2GH9NBW 31281020 Pan, T; Xie, S; Zhou, Y; Hu, J; Luo, H; Li, X; Huang, L Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523003 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523003&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155548847 440731585 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51282404 CCn1ncc2c(NC3CCCCC3)c(cnc12)C(=O)NCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C32H41N7O/c1-2-39-31-25(21-36-39)30(37-22-12-4-3-5-13-22)26(20-35-31)32(40)34-19-11-10-18-33-29-23-14-6-8-16-27(23)38-28-17-9-7-15-24(28)29/h6,8,14,16,20-22H,2-5,7,9-13,15,17-19H2,1H3,(H,33,38)(H,34,40)(H,35,37) ULESJOXPFUVABR-UHFFFAOYSA-N 50523001 CHEMBL4466312 Cholinesterase 889 ChEMBL 10.1016/j.bmcl.2019.06.056 10.7270/Q2GH9NBW 31281020 Pan, T; Xie, S; Zhou, Y; Hu, J; Luo, H; Li, X; Huang, L Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523001 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523001&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155531701 440731583 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51282405 CCn1ncc2c(NC3CCCCC3)c(cnc12)C(=O)NCCNc1c2CCCCc2nc2cc(Cl)ccc12 InChI=1S/C30H36ClN7O/c1-2-38-29-23(18-35-38)28(36-20-8-4-3-5-9-20)24(17-34-29)30(39)33-15-14-32-27-21-10-6-7-11-25(21)37-26-16-19(31)12-13-22(26)27/h12-13,16-18,20H,2-11,14-15H2,1H3,(H,32,37)(H,33,39)(H,34,36) PUNJQTISEGWDHW-UHFFFAOYSA-N 50523002 CHEMBL4577198 Cholinesterase 713 ChEMBL 10.1016/j.bmcl.2019.06.056 10.7270/Q2GH9NBW 31281020 Pan, T; Xie, S; Zhou, Y; Hu, J; Luo, H; Li, X; Huang, L Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523002 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523002&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155553883 440731584 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51282406 CCn1ncc2c(NC3CCCCC3)c(cnc12)C(=O)NCCCCNc1c2CCCCc2nc2cc(Cl)ccc12 InChI=1S/C32H40ClN7O/c1-2-40-31-25(20-37-40)30(38-22-10-4-3-5-11-22)26(19-36-31)32(41)35-17-9-8-16-34-29-23-12-6-7-13-27(23)39-28-18-21(33)14-15-24(28)29/h14-15,18-20,22H,2-13,16-17H2,1H3,(H,34,39)(H,35,41)(H,36,38) REZMUAZEBVJSAG-UHFFFAOYSA-N 50523008 CHEMBL4454965 Cholinesterase 1283 ChEMBL 10.1016/j.bmcl.2019.06.056 10.7270/Q2GH9NBW 31281020 Pan, T; Xie, S; Zhou, Y; Hu, J; Luo, H; Li, X; Huang, L Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523008 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523008&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155523628 440731590 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51282407 CCn1ncc2c(NC3CCCCC3)c(cnc12)C(=O)NCCCCCNc1c2CCCCc2nc2ccc(Cl)cc12 InChI=1S/C33H42ClN7O/c1-2-41-32-26(21-38-41)31(39-23-11-5-3-6-12-23)27(20-37-32)33(42)36-18-10-4-9-17-35-30-24-13-7-8-14-28(24)40-29-16-15-22(34)19-25(29)30/h15-16,19-21,23H,2-14,17-18H2,1H3,(H,35,40)(H,36,42)(H,37,39) SRXAOMVRMPXVFI-UHFFFAOYSA-N 50523005 CHEMBL4589577 Cholinesterase 434 ChEMBL 10.1016/j.bmcl.2019.06.056 10.7270/Q2GH9NBW 31281020 Pan, T; Xie, S; Zhou, Y; Hu, J; Luo, H; Li, X; Huang, L Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523005 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523005&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155568658 440731587 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51282408 CCn1ncc2c(NC3CCCCC3)c(cnc12)C(=O)NCCCCCCCCNc1c2CCCCc2nc2cc(Cl)ccc12 InChI=1S/C36H48ClN7O/c1-2-44-35-29(24-41-44)34(42-26-14-8-7-9-15-26)30(23-40-35)36(45)39-21-13-6-4-3-5-12-20-38-33-27-16-10-11-17-31(27)43-32-22-25(37)18-19-28(32)33/h18-19,22-24,26H,2-17,20-21H2,1H3,(H,38,43)(H,39,45)(H,40,42) DIWOJIVCVPQWMA-UHFFFAOYSA-N 50523007 CHEMBL4443780 Cholinesterase 314 ChEMBL 10.1016/j.bmcl.2019.06.056 10.7270/Q2GH9NBW 31281020 Pan, T; Xie, S; Zhou, Y; Hu, J; Luo, H; Li, X; Huang, L Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523007 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523007&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155516849 440731589 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51282409 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 216 ChEMBL 10.1016/j.bmcl.2019.06.056 10.7270/Q2GH9NBW 31281020 Pan, T; Xie, S; Zhou, Y; Hu, J; Luo, H; Li, X; Huang, L Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51282417 CCn1ncc2c(NC3CCCCC3)c(cnc12)C(=O)NCCCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C36H49N7O/c1-2-43-35-29(25-40-43)34(41-26-16-8-7-9-17-26)30(24-39-35)36(44)38-23-15-6-4-3-5-14-22-37-33-27-18-10-12-20-31(27)42-32-21-13-11-19-28(32)33/h10,12,18,20,24-26H,2-9,11,13-17,19,21-23H2,1H3,(H,37,42)(H,38,44)(H,39,41) QDLFZSXYMYOCBX-UHFFFAOYSA-N 50523004 CHEMBL4445394 Cholinesterase 320 ChEMBL 10.1016/j.bmcl.2019.06.056 10.7270/Q2GH9NBW 31281020 Pan, T; Xie, S; Zhou, Y; Hu, J; Luo, H; Li, X; Huang, L Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523004 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523004&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155517795 440731586 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51282418 CCn1ncc2c(NC3CCCCC3)c(cnc12)C(=O)NCCCCCCCNc1c2CCCCc2nc2ccc(Cl)cc12 InChI=1S/C35H46ClN7O/c1-2-43-34-28(23-40-43)33(41-25-13-7-6-8-14-25)29(22-39-34)35(44)38-20-12-5-3-4-11-19-37-32-26-15-9-10-16-30(26)42-31-18-17-24(36)21-27(31)32/h17-18,21-23,25H,2-16,19-20H2,1H3,(H,37,42)(H,38,44)(H,39,41) WQXZKYQBALBJPZ-UHFFFAOYSA-N 50523006 CHEMBL4469202 Cholinesterase 245 ChEMBL 10.1016/j.bmcl.2019.06.056 10.7270/Q2GH9NBW 31281020 Pan, T; Xie, S; Zhou, Y; Hu, J; Luo, H; Li, X; Huang, L Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523006 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523006&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155533540 440731588 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51282427 CCn1ncc2c(NC3CCCCC3)c(cnc12)C(=O)NCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C33H43N7O/c1-2-40-32-26(22-37-40)31(38-23-13-5-3-6-14-23)27(21-36-32)33(41)35-20-12-4-11-19-34-30-24-15-7-9-17-28(24)39-29-18-10-8-16-25(29)30/h7,9,15,17,21-23H,2-6,8,10-14,16,18-20H2,1H3,(H,34,39)(H,35,41)(H,36,38) LAIYCRVPOJPNJO-UHFFFAOYSA-N 50523011 CHEMBL4576029 Cholinesterase 264 ChEMBL 10.1016/j.bmcl.2019.06.056 10.7270/Q2GH9NBW 31281020 Pan, T; Xie, S; Zhou, Y; Hu, J; Luo, H; Li, X; Huang, L Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523011 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523011&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155564375 440731593 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51282428 CCn1ncc2c(NC3CCCCC3)c(cnc12)C(=O)NCCCCCCNc1c2CCCCc2nc2cc(Cl)ccc12 InChI=1S/C34H44ClN7O/c1-2-42-33-27(22-39-42)32(40-24-12-6-5-7-13-24)28(21-38-33)34(43)37-19-11-4-3-10-18-36-31-25-14-8-9-15-29(25)41-30-20-23(35)16-17-26(30)31/h16-17,20-22,24H,2-15,18-19H2,1H3,(H,36,41)(H,37,43)(H,38,40) ISLRWTXXFRBTMH-UHFFFAOYSA-N 50523009 CHEMBL4549577 Cholinesterase 449 ChEMBL 10.1016/j.bmcl.2019.06.056 10.7270/Q2GH9NBW 31281020 Pan, T; Xie, S; Zhou, Y; Hu, J; Luo, H; Li, X; Huang, L Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523009 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523009&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155543476 440731591 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51282431 CCn1ncc2c(NC3CCCCC3)c(cnc12)C(=O)NCCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C34H45N7O/c1-2-41-33-27(23-38-41)32(39-24-14-6-5-7-15-24)28(22-37-33)34(42)36-21-13-4-3-12-20-35-31-25-16-8-10-18-29(25)40-30-19-11-9-17-26(30)31/h8,10,16,18,22-24H,2-7,9,11-15,17,19-21H2,1H3,(H,35,40)(H,36,42)(H,37,39) ZRYMWBZVLNRNSC-UHFFFAOYSA-N 50523010 CHEMBL4582090 Cholinesterase 332 ChEMBL 10.1016/j.bmcl.2019.06.056 10.7270/Q2GH9NBW 31281020 Pan, T; Xie, S; Zhou, Y; Hu, J; Luo, H; Li, X; Huang, L Sun Yat-sen University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50523010 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50523010&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155554299 440731592 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316565 Clc1ccc(OCCCCCN2CCCCC2)cc1 InChI=1S/C16H24ClNO/c17-15-7-9-16(10-8-15)19-14-6-2-5-13-18-11-3-1-4-12-18/h7-10H,1-6,11-14H2 CISLNJILBFCUJI-UHFFFAOYSA-N 50533182 CHEMBL3747891 Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533182 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533182&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 2843471 440741764 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316566 Clc1ccc(OCCCCCCCN2CCCCC2)cc1 InChI=1S/C18H28ClNO/c19-17-9-11-18(12-10-17)21-16-8-3-1-2-5-13-20-14-6-4-7-15-20/h9-12H,1-8,13-16H2 BNRCWTHOFLFDDE-UHFFFAOYSA-N 50508998 CHEMBL3747907 Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50508998 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50508998&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127040592 440717583 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316567 CC1CCCN(CCCCCOc2ccc(Cl)cc2)C1 InChI=1S/C17H26ClNO/c1-15-6-5-12-19(14-15)11-3-2-4-13-20-17-9-7-16(18)8-10-17/h7-10,15H,2-6,11-14H2,1H3 GPTIYOZHRGPQPV-UHFFFAOYSA-N 50533191 CHEMBL3747892 Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533191 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533191&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127040267 440741773 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316568 CC1CCCN(CCCCCCCOc2ccc(Cl)cc2)C1 InChI=1S/C19H30ClNO/c1-17-8-7-14-21(16-17)13-5-3-2-4-6-15-22-19-11-9-18(20)10-12-19/h9-12,17H,2-8,13-16H2,1H3 KCDBGISMCSMDRJ-UHFFFAOYSA-N 50533192 CHEMBL3747908 Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533192 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533192&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127038945 440741774 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316569 CC1CCN(CCCCCCOc2ccc(Cl)cc2)CC1 InChI=1S/C18H28ClNO/c1-16-10-13-20(14-11-16)12-4-2-3-5-15-21-18-8-6-17(19)7-9-18/h6-9,16H,2-5,10-15H2,1H3 QOQMTYKSXCQWFH-UHFFFAOYSA-N 50533187 CHEMBL3747901 Cholinesterase 5430 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533187 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533187&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127038686 440741769 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316570 CC1CCN(CCCCCCCOc2ccc(Cl)cc2)CC1 InChI=1S/C19H30ClNO/c1-17-11-14-21(15-12-17)13-5-3-2-4-6-16-22-19-9-7-18(20)8-10-19/h7-10,17H,2-6,11-16H2,1H3 XPZSFEKMWDEMKG-UHFFFAOYSA-N 50533183 CHEMBL3747909 Cholinesterase 2920 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533183 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533183&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127040256 440741765 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316571 Clc1ccc(OCCCCCCCN2CCCCCC2)cc1 InChI=1S/C19H30ClNO/c20-18-10-12-19(13-11-18)22-17-9-5-1-2-6-14-21-15-7-3-4-8-16-21/h10-13H,1-9,14-17H2 RIFYNBIQUGNAIX-UHFFFAOYSA-N 50533180 CHEMBL3747910 Cholinesterase 1640 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533180 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533180&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127041626 440741762 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316572 Clc1cccc(OCCCCCCN2CCCCC2)c1 InChI=1S/C17H26ClNO/c18-16-9-8-10-17(15-16)20-14-7-2-1-4-11-19-12-5-3-6-13-19/h8-10,15H,1-7,11-14H2 LXKXCCJFOWBMCZ-UHFFFAOYSA-N 50533193 CHEMBL3747895 Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533193 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533193&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 2057716 440741775 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316573 Clc1cccc(OCCCCCCCN2CCCCC2)c1 InChI=1S/C18H28ClNO/c19-17-10-9-11-18(16-17)21-15-8-3-1-2-5-12-20-13-6-4-7-14-20/h9-11,16H,1-8,12-15H2 INFPAWWZLAODKB-UHFFFAOYSA-N 50533194 CHEMBL3747903 Cholinesterase 4750 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533194 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533194&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127039029 440741776 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316574 CC1CCN(CCCCCCOc2cccc(Cl)c2)CC1 InChI=1S/C18H28ClNO/c1-16-9-12-20(13-10-16)11-4-2-3-5-14-21-18-8-6-7-17(19)15-18/h6-8,15-16H,2-5,9-14H2,1H3 UPPYCJOYNPALJZ-UHFFFAOYSA-N 50533188 CHEMBL3747897 Cholinesterase 3530 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533188 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533188&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127038675 440741770 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316575 CC1CCN(CCCCCCCOc2cccc(Cl)c2)CC1 InChI=1S/C19H30ClNO/c1-17-10-13-21(14-11-17)12-5-3-2-4-6-15-22-19-9-7-8-18(20)16-19/h7-9,16-17H,2-6,10-15H2,1H3 YSGPRIFLIJFIDY-UHFFFAOYSA-N 50533189 CHEMBL3747905 Cholinesterase 1660 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533189 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533189&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127039033 440741771 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316576 Clc1cccc(OCCCCCCCN2CCCCCC2)c1 InChI=1S/C19H30ClNO/c20-18-11-10-12-19(17-18)22-16-9-5-1-2-6-13-21-14-7-3-4-8-15-21/h10-12,17H,1-9,13-16H2 ZIDOLPDWARBWCM-UHFFFAOYSA-N 50533186 CHEMBL3747906 Cholinesterase 900 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533186 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533186&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127041329 440741768 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316577 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 1830 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316578 Clc1ccc(OCCCOCCCN2CCCCCC2)cc1 InChI=1S/C18H28ClNO2/c19-17-7-9-18(10-8-17)22-16-6-15-21-14-5-13-20-11-3-1-2-4-12-20/h7-10H,1-6,11-16H2 JGFWTZPEFKPIHN-UHFFFAOYSA-N 50533190 CHEMBL4452966 Cholinesterase 4970 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533190 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533190&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 42629970 440741772 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316591 C(COc1ccc2N=C3CCCN3Cc2c1)CN1CCCCC1 InChI=1S/C19H27N3O/c1-2-9-21(10-3-1)11-5-13-23-17-7-8-18-16(14-17)15-22-12-4-6-19(22)20-18/h7-8,14H,1-6,9-13,15H2 UVYNECUSQBZMSD-UHFFFAOYSA-N 50053435 CHEMBL3323035 Cholinesterase 8200 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053435 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053435&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710487 103950116 CHEMBL3323035 ZINC03815717 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316600 Clc1ccc(OCCCCCCN2CCCCC2)cc1 InChI=1S/C17H26ClNO/c18-16-8-10-17(11-9-16)20-15-7-2-1-4-12-19-13-5-3-6-14-19/h8-11H,1-7,12-15H2 SASRGIJMOUBETC-UHFFFAOYSA-N 50533179 CHEMBL3747899 Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533179 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533179&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 2057867 440741761 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316601 CC1CCCN(CCCCCCOc2ccc(Cl)cc2)C1 InChI=1S/C18H28ClNO/c1-16-7-6-13-20(15-16)12-4-2-3-5-14-21-18-10-8-17(19)9-11-18/h8-11,16H,2-7,12-15H2,1H3 LDQMGOJCUMEESA-UHFFFAOYSA-N 50533196 CHEMBL3747900 Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533196 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533196&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127038684 440741778 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316602 Clc1ccc(OCCCCCCN2CCCCCC2)cc1 InChI=1S/C18H28ClNO/c19-17-9-11-18(12-10-17)21-16-8-4-3-7-15-20-13-5-1-2-6-14-20/h9-12H,1-8,13-16H2 BFIRIFRGFKIGFT-UHFFFAOYSA-N 50533198 CHEMBL3747902 Cholinesterase 3740 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533198 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533198&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127039027 440741780 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316603 CC1CCCN(CCCCCCCOc2cccc(Cl)c2)C1 InChI=1S/C19H30ClNO/c1-17-9-8-13-21(16-17)12-5-3-2-4-6-14-22-19-11-7-10-18(20)15-19/h7,10-11,15,17H,2-6,8-9,12-14,16H2,1H3 QVTJBLMDJBZOAB-UHFFFAOYSA-N 50533195 CHEMBL3747904 Cholinesterase 5150 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533195 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533195&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127039031 440741777 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316604 Clc1cccc(OCCCCCCN2CCCCCC2)c1 InChI=1S/C18H28ClNO/c19-17-10-9-11-18(16-17)21-15-8-4-3-7-14-20-12-5-1-2-6-13-20/h9-11,16H,1-8,12-15H2 QDDJKEVJOXDPMT-UHFFFAOYSA-N 50533185 CHEMBL3747898 Cholinesterase 2430 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533185 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533185&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127038677 440741767 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316615 Clc1ccc(OCCCCCCN2CCCCC2)cc1 InChI=1S/C17H26ClNO/c18-16-8-10-17(11-9-16)20-15-7-2-1-4-12-19-13-5-3-6-14-19/h8-11H,1-7,12-15H2 SASRGIJMOUBETC-UHFFFAOYSA-N 50533179 CHEMBL3747899 Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533179 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533179&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 2057867 440741761 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316616 CC1CCCN(CCCCCCOc2ccc(Cl)cc2)C1 InChI=1S/C18H28ClNO/c1-16-7-6-13-20(15-16)12-4-2-3-5-14-21-18-10-8-17(19)9-11-18/h8-11,16H,2-7,12-15H2,1H3 LDQMGOJCUMEESA-UHFFFAOYSA-N 50533196 CHEMBL3747900 Cholinesterase >10000 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533196 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533196&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127038684 440741778 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316617 Clc1ccc(OCCCCCCN2CCCCCC2)cc1 InChI=1S/C18H28ClNO/c19-17-9-11-18(12-10-17)21-16-8-4-3-7-15-20-13-5-1-2-6-14-20/h9-12H,1-8,13-16H2 BFIRIFRGFKIGFT-UHFFFAOYSA-N 50533198 CHEMBL3747902 Cholinesterase 3740 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533198 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533198&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127039027 440741780 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316618 CC1CCCN(CCCCCCCOc2cccc(Cl)c2)C1 InChI=1S/C19H30ClNO/c1-17-9-8-13-21(16-17)12-5-3-2-4-6-14-22-19-11-7-10-18(20)15-19/h7,10-11,15,17H,2-6,8-9,12-14,16H2,1H3 QVTJBLMDJBZOAB-UHFFFAOYSA-N 50533195 CHEMBL3747904 Cholinesterase 5150 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533195 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533195&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127039031 440741777 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316619 Clc1cccc(OCCCCCCN2CCCCCC2)c1 InChI=1S/C18H28ClNO/c19-17-10-9-11-18(16-17)21-15-8-4-3-7-14-20-12-5-1-2-6-13-20/h9-11,16H,1-8,12-15H2 QDDJKEVJOXDPMT-UHFFFAOYSA-N 50533185 CHEMBL3747898 Cholinesterase 2430 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533185 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533185&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127038677 440741767 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316626 Clc1ccc(OCCCCCN2CCCCCC2)cc1 InChI=1S/C17H26ClNO/c18-16-8-10-17(11-9-16)20-15-7-3-6-14-19-12-4-1-2-5-13-19/h8-11H,1-7,12-15H2 GRIAEUIELDSSBS-UHFFFAOYSA-N 50533197 CHEMBL3747894 Cholinesterase 3450 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50533197 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50533197&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127038670 440741779 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51316627 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 2.0 ChEMBL 10.1016/j.bmcl.2016.04.054 10.7270/Q2XD155T 27445168 Łażewska, D; Jończyk, J; Bajda, M; Szałaj, N; Więckowska, A; Panek, D; Moore, C; Kuder, K; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314567 Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccccc4)C3)ccc12 InChI=1S/C24H27NO3/c1-17-18(2)24(26)28-23-13-21(10-11-22(17)23)27-16-20-9-6-12-25(15-20)14-19-7-4-3-5-8-19/h3-5,7-8,10-11,13,20H,6,9,12,14-16H2,1-2H3 HKIDXMKKZYHFEM-UHFFFAOYSA-N 50532731 CHEMBL4571763 Cholinesterase 2910 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50532731 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50532731&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155525760 440741313 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314568 Cc1c(C)c(=O)oc2cc(OCCCCN3CCc4ccccc4C3)ccc12 InChI=1S/C24H27NO3/c1-17-18(2)24(26)28-23-15-21(9-10-22(17)23)27-14-6-5-12-25-13-11-19-7-3-4-8-20(19)16-25/h3-4,7-10,15H,5-6,11-14,16H2,1-2H3 FIZCTLFFIOOEEU-UHFFFAOYSA-N 50506882 CHEMBL4474386 Cholinesterase 2610 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50506882 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50506882&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155536878 440715467 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314641 Cl.Cc1c(C)c(=O)oc2cc(OCC3CCN(Cc4ccccc4)CC3)ccc12 InChI=1S/C24H27NO3.ClH/c1-17-18(2)24(26)28-23-14-21(8-9-22(17)23)27-16-20-10-12-25(13-11-20)15-19-6-4-3-5-7-19;/h3-9,14,20H,10-13,15-16H2,1-2H3;1H PQISJODIMAREMD-UHFFFAOYSA-N 50532726 CHEMBL4472789 Cholinesterase 4720 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50532726 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50532726&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155535904 440741308 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314642 Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccccc4)C3)ccc12 InChI=1S/C24H27NO3/c1-17-18(2)24(26)28-23-13-21(10-11-22(17)23)27-16-20-9-6-12-25(15-20)14-19-7-4-3-5-8-19/h3-5,7-8,10-11,13,20H,6,9,12,14-16H2,1-2H3 HKIDXMKKZYHFEM-UHFFFAOYSA-N 50532731 CHEMBL4571763 Cholinesterase 3410 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50532731 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50532731&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155525760 440741313 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314643 Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccccc4)C3)ccc12 InChI=1S/C24H27NO3/c1-17-18(2)24(26)28-23-13-21(10-11-22(17)23)27-16-20-9-6-12-25(15-20)14-19-7-4-3-5-8-19/h3-5,7-8,10-11,13,20H,6,9,12,14-16H2,1-2H3 HKIDXMKKZYHFEM-UHFFFAOYSA-N 50532731 CHEMBL4571763 Cholinesterase 2910 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50532731 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50532731&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155525760 440741313 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314644 Cl.Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4cccc(Cl)c4)C3)ccc12 InChI=1S/C24H26ClNO3.ClH/c1-16-17(2)24(27)29-23-12-21(8-9-22(16)23)28-15-19-6-4-10-26(14-19)13-18-5-3-7-20(25)11-18;/h3,5,7-9,11-12,19H,4,6,10,13-15H2,1-2H3;1H DVHSQXOMDRSHCZ-UHFFFAOYSA-N 50532737 CHEMBL4447506 Cholinesterase 4690 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50532737 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50532737&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155519043 440741319 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314645 Cl.Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccc(Cl)cc4)C3)ccc12 InChI=1S/C24H26ClNO3.ClH/c1-16-17(2)24(27)29-23-12-21(9-10-22(16)23)28-15-19-4-3-11-26(14-19)13-18-5-7-20(25)8-6-18;/h5-10,12,19H,3-4,11,13-15H2,1-2H3;1H YWUJHMBDKFPLCN-UHFFFAOYSA-N 50532722 CHEMBL4446787 Cholinesterase 5900 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50532722 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50532722&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155518786 440741304 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314646 Cc1c(C)c(=O)oc2cc(OCCCCN3CCc4ccccc4C3)ccc12 InChI=1S/C24H27NO3/c1-17-18(2)24(26)28-23-15-21(9-10-22(17)23)27-14-6-5-12-25-13-11-19-7-3-4-8-20(19)16-25/h3-4,7-10,15H,5-6,11-14,16H2,1-2H3 FIZCTLFFIOOEEU-UHFFFAOYSA-N 50506882 CHEMBL4474386 Cholinesterase 2610 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50506882 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50506882&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155536878 440715467 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314662 Cc1c(C)c(=O)oc2cc(OC3CCN(Cc4ccccc4)CC3)ccc12 InChI=1S/C23H25NO3/c1-16-17(2)23(25)27-22-14-20(8-9-21(16)22)26-19-10-12-24(13-11-19)15-18-6-4-3-5-7-18/h3-9,14,19H,10-13,15H2,1-2H3 DCRCANSGLMNLEA-UHFFFAOYSA-N 50532718 CHEMBL4569054 Cholinesterase 9570 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50532718 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50532718&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155550841 440741300 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314663 Cl.Cc1c(C)c(=O)oc2cc(OCC3CCN(Cc4cccc(Cl)c4)CC3)ccc12 InChI=1S/C24H26ClNO3.ClH/c1-16-17(2)24(27)29-23-13-21(6-7-22(16)23)28-15-18-8-10-26(11-9-18)14-19-4-3-5-20(25)12-19;/h3-7,12-13,18H,8-11,14-15H2,1-2H3;1H GDJVHXJRIIZVEJ-UHFFFAOYSA-N 50532721 CHEMBL4539659 Cholinesterase 6070 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50532721 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50532721&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155550007 440741303 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314664 Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccccc4)C3)ccc12 InChI=1S/C24H27NO3/c1-17-18(2)24(26)28-23-13-21(10-11-22(17)23)27-16-20-9-6-12-25(15-20)14-19-7-4-3-5-8-19/h3-5,7-8,10-11,13,20H,6,9,12,14-16H2,1-2H3 HKIDXMKKZYHFEM-UHFFFAOYSA-N 50532731 CHEMBL4571763 Cholinesterase 3410 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50532731 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50532731&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155525760 440741313 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314665 Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccccc4)C3)ccc12 InChI=1S/C24H27NO3/c1-17-18(2)24(26)28-23-13-21(10-11-22(17)23)27-16-20-9-6-12-25(15-20)14-19-7-4-3-5-8-19/h3-5,7-8,10-11,13,20H,6,9,12,14-16H2,1-2H3 HKIDXMKKZYHFEM-UHFFFAOYSA-N 50532731 CHEMBL4571763 Cholinesterase 2910 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50532731 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50532731&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155525760 440741313 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314666 Cl.Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccc(F)cc4)C3)ccc12 InChI=1S/C24H26FNO3.ClH/c1-16-17(2)24(27)29-23-12-21(9-10-22(16)23)28-15-19-4-3-11-26(14-19)13-18-5-7-20(25)8-6-18;/h5-10,12,19H,3-4,11,13-15H2,1-2H3;1H YOWUEPXICGUKNK-UHFFFAOYSA-N 50532725 CHEMBL4439320 Cholinesterase 3690 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50532725 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50532725&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155513877 440741307 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314667 Cl.Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccc(Cl)cc4)C3)ccc12 InChI=1S/C24H26ClNO3.ClH/c1-16-17(2)24(27)29-23-12-21(9-10-22(16)23)28-15-19-4-3-11-26(14-19)13-18-5-7-20(25)8-6-18;/h5-10,12,19H,3-4,11,13-15H2,1-2H3;1H YWUJHMBDKFPLCN-UHFFFAOYSA-N 50532722 CHEMBL4446787 Cholinesterase 5900 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50532722 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50532722&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155518786 440741304 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314677 COc1ccc(CN2CCCC(COc3ccc4c(C)c(C)c(=O)oc4c3)C2)cc1OC InChI=1S/C26H31NO5/c1-17-18(2)26(28)32-24-13-21(8-9-22(17)24)31-16-20-6-5-11-27(15-20)14-19-7-10-23(29-3)25(12-19)30-4/h7-10,12-13,20H,5-6,11,14-16H2,1-4H3 KLZPNESZOSTZAJ-UHFFFAOYSA-N 50532733 CHEMBL4556552 Cholinesterase 6040 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50532733 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50532733&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155557097 440741315 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51314685 COc1ccc(CN2CCCC(COc3ccc4c(C)c(C)c(=O)oc4c3)C2)cc1OC InChI=1S/C26H31NO5/c1-17-18(2)26(28)32-24-13-21(8-9-22(17)24)31-16-20-6-5-11-27(15-20)14-19-7-10-23(29-3)25(12-19)30-4/h7-10,12-13,20H,5-6,11,14-16H2,1-4H3 KLZPNESZOSTZAJ-UHFFFAOYSA-N 50532733 CHEMBL4556552 Cholinesterase 6040 ChEMBL 10.1021/acs.jmedchem.6b00562 10.7270/Q25142Q8 27347731 Pisani, L; Farina, R; Catto, M; Iacobazzi, RM; Nicolotti, O; Cellamare, S; Mangiatordi, GF; Denora, N; Soto-Otero, R; Siragusa, L; Altomare, CD; Carotti, A Universit£ degli Studi di Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50532733 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50532733&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155557097 440741315 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51286404 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 2200 ChEMBL 10.1016/j.ejmech.2019.04.026 10.7270/Q2KW5KFM 31029943 Oliveira, C; Bagetta, D; Cagide, F; Teixeira, J; Amorim, R; Silva, T; Garrido, J; Remião, F; Uriarte, E; Oliveira, PJ; Alcaro, S; Ortuso, F; Borges, F University of Porto http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324216 Cc1ccc(cc1)-c1nc(NC(=O)C2CCN(Cc3ccc(cc3)[N+]([O-])=O)CC2)sc1-c1ccc(C)cc1 InChI=1S/C30H30N4O3S/c1-20-3-9-23(10-4-20)27-28(24-11-5-21(2)6-12-24)38-30(31-27)32-29(35)25-15-17-33(18-16-25)19-22-7-13-26(14-8-22)34(36)37/h3-14,25H,15-19H2,1-2H3,(H,31,32,35) NXEFSPQKVIRTBY-UHFFFAOYSA-N 50535920 CHEMBL4572079 Cholinesterase >10000 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535920 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535920&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155563567 440744502 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324219 Cc1ccc(cc1)-c1nc(NCC2CCN(Cc3ccc(F)cc3)CC2)sc1-c1ccc(C)cc1 InChI=1S/C30H32FN3S/c1-21-3-9-25(10-4-21)28-29(26-11-5-22(2)6-12-26)35-30(33-28)32-19-23-15-17-34(18-16-23)20-24-7-13-27(31)14-8-24/h3-14,23H,15-20H2,1-2H3,(H,32,33) VRNMNLPNRFRXDM-UHFFFAOYSA-N 50535923 CHEMBL4549453 Cholinesterase 1950 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535923 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535923&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155550463 440744505 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324220 COc1ccc(cc1)-c1nc(NC(=O)C2CCN(Cc3ccccc3C(F)(F)F)CC2)sc1-c1ccc(OC)cc1 InChI=1S/C31H30F3N3O3S/c1-39-24-11-7-20(8-12-24)27-28(21-9-13-25(40-2)14-10-21)41-30(35-27)36-29(38)22-15-17-37(18-16-22)19-23-5-3-4-6-26(23)31(32,33)34/h3-14,22H,15-19H2,1-2H3,(H,35,36,38) RLYFWJDIVYZVTH-UHFFFAOYSA-N 50535924 CHEMBL4527101 Cholinesterase 1920 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535924 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535924&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155544137 440744506 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324221 Clc1ccc(cc1)-c1nc(NC2CCN(Cc3ccccc3)CC2)sc1-c1ccc(Cl)cc1 InChI=1S/C27H25Cl2N3S/c28-22-10-6-20(7-11-22)25-26(21-8-12-23(29)13-9-21)33-27(31-25)30-24-14-16-32(17-15-24)18-19-4-2-1-3-5-19/h1-13,24H,14-18H2,(H,30,31) SWXGPRWGTHKINF-UHFFFAOYSA-N 50535925 CHEMBL4575730 Cholinesterase 3300 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535925 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535925&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155563905 440744507 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324222 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 10.0 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324227 Cc1ccc(CN2CCC(CC2)Nc2nc(c(s2)-c2ccc(Cl)cc2)-c2ccc(Cl)cc2)cc1 InChI=1S/C28H27Cl2N3S/c1-19-2-4-20(5-3-19)18-33-16-14-25(15-17-33)31-28-32-26(21-6-10-23(29)11-7-21)27(34-28)22-8-12-24(30)13-9-22/h2-13,25H,14-18H2,1H3,(H,31,32) CKIUOHBAAOVIJX-UHFFFAOYSA-N 50535930 CHEMBL4588487 Cholinesterase >10000 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535930 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535930&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155567334 440744512 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324228 COc1ccc(CN2CCC(CC2)Nc2nc(c(s2)-c2ccc(Cl)cc2)-c2ccc(Cl)cc2)cc1 InChI=1S/C28H27Cl2N3OS/c1-34-25-12-2-19(3-13-25)18-33-16-14-24(15-17-33)31-28-32-26(20-4-8-22(29)9-5-20)27(35-28)21-6-10-23(30)11-7-21/h2-13,24H,14-18H2,1H3,(H,31,32) NIYJGHRSFITDCK-UHFFFAOYSA-N 50535931 CHEMBL4551316 Cholinesterase 1570 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535931 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535931&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155554864 440744513 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324229 Clc1ccc(cc1)-c1nc(NC2CCN(Cc3ccc(cc3)C#N)CC2)sc1-c1ccc(Cl)cc1 InChI=1S/C28H24Cl2N4S/c29-23-9-5-21(6-10-23)26-27(22-7-11-24(30)12-8-22)35-28(33-26)32-25-13-15-34(16-14-25)18-20-3-1-19(17-31)2-4-20/h1-12,25H,13-16,18H2,(H,32,33) OLVVWVXHBQTZRY-UHFFFAOYSA-N 50535932 CHEMBL4593917 Cholinesterase 1720 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535932 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535932&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155569489 440744514 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324230 COc1ccc(cc1)-c1nc(NC2CCN(Cc3ccc(C)cc3)CC2)sc1-c1ccc(OC)cc1 InChI=1S/C30H33N3O2S/c1-21-4-6-22(7-5-21)20-33-18-16-25(17-19-33)31-30-32-28(23-8-12-26(34-2)13-9-23)29(36-30)24-10-14-27(35-3)15-11-24/h4-15,25H,16-20H2,1-3H3,(H,31,32) RCNPQETVOMKGRM-UHFFFAOYSA-N 50535933 CHEMBL4555730 Cholinesterase 2250 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535933 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535933&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155556946 440744515 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324231 COc1ccc(CN2CCC(CC2)Nc2nc(c(s2)-c2ccc(OC)cc2)-c2ccc(OC)cc2)cc1 InChI=1S/C30H33N3O3S/c1-34-25-10-4-21(5-11-25)20-33-18-16-24(17-19-33)31-30-32-28(22-6-12-26(35-2)13-7-22)29(37-30)23-8-14-27(36-3)15-9-23/h4-15,24H,16-20H2,1-3H3,(H,31,32) QBSKCKXTLASIRW-UHFFFAOYSA-N 50535921 CHEMBL4562938 Cholinesterase 2530 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535921 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535921&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155559209 440744503 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324232 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 1260 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324233 Cc1ccc(cc1)-c1nc(NC2CCN(Cc3ccccc3)CC2)sc1-c1ccc(C)cc1 InChI=1S/C29H31N3S/c1-21-8-12-24(13-9-21)27-28(25-14-10-22(2)11-15-25)33-29(31-27)30-26-16-18-32(19-17-26)20-23-6-4-3-5-7-23/h3-15,26H,16-20H2,1-2H3,(H,30,31) UFCCFJLCKHGETC-UHFFFAOYSA-N 50535934 CHEMBL4519072 Cholinesterase 3590 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535934 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535934&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155541705 440744516 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324234 COc1ccc(cc1)-c1nc(NCC2CCN(Cc3c(F)cccc3Cl)CC2)sc1-c1ccc(OC)cc1 InChI=1S/C30H31ClFN3O2S/c1-36-23-10-6-21(7-11-23)28-29(22-8-12-24(37-2)13-9-22)38-30(34-28)33-18-20-14-16-35(17-15-20)19-25-26(31)4-3-5-27(25)32/h3-13,20H,14-19H2,1-2H3,(H,33,34) GKVMJVDKXNJERX-UHFFFAOYSA-N 50535922 CHEMBL4559797 Cholinesterase 2150 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535922 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535922&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 132941377 440744504 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324235 Fc1ccc(CN2CCC(CNc3nc(c(s3)-c3ccc(Cl)cc3)-c3ccc(Cl)cc3)CC2)c(c1)C(F)(F)F InChI=1S/C29H25Cl2F4N3S/c30-22-6-1-19(2-7-22)26-27(20-3-8-23(31)9-4-20)39-28(37-26)36-16-18-11-13-38(14-12-18)17-21-5-10-24(32)15-25(21)29(33,34)35/h1-10,15,18H,11-14,16-17H2,(H,36,37) ZMMDRCZWLLXKFJ-UHFFFAOYSA-N 50535935 CHEMBL4533530 Cholinesterase 3300 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535935 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535935&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155547375 440744517 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324236 Fc1ccc(CN2CCC(CNc3nc(c(s3)-c3ccc(Cl)cc3)-c3ccc(Cl)cc3)CC2)c(Cl)c1 InChI=1S/C28H25Cl3FN3S/c29-22-6-1-19(2-7-22)26-27(20-3-8-23(30)9-4-20)36-28(34-26)33-16-18-11-13-35(14-12-18)17-21-5-10-24(32)15-25(21)31/h1-10,15,18H,11-14,16-17H2,(H,33,34) ZGYZYFFEQOIELG-UHFFFAOYSA-N 50535936 CHEMBL4554666 Cholinesterase 740 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535936 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535936&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155556231 440744518 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324237 Cc1ccc(cc1)-c1nc(NCC2CCN(Cc3cc(F)cc(F)c3)CC2)sc1-c1ccc(C)cc1 InChI=1S/C30H31F2N3S/c1-20-3-7-24(8-4-20)28-29(25-9-5-21(2)6-10-25)36-30(34-28)33-18-22-11-13-35(14-12-22)19-23-15-26(31)17-27(32)16-23/h3-10,15-17,22H,11-14,18-19H2,1-2H3,(H,33,34) QGKQRUPULPYQAC-UHFFFAOYSA-N 50535937 CHEMBL4532806 Cholinesterase 1840 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535937 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535937&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 139600209 440744519 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324238 Cc1ccc(cc1)-c1nc(NCC2CCN(Cc3ccccc3C(F)(F)F)CC2)sc1-c1ccc(C)cc1 InChI=1S/C31H32F3N3S/c1-21-7-11-24(12-8-21)28-29(25-13-9-22(2)10-14-25)38-30(36-28)35-19-23-15-17-37(18-16-23)20-26-5-3-4-6-27(26)31(32,33)34/h3-14,23H,15-20H2,1-2H3,(H,35,36) GEJGLTWIEMSGMI-UHFFFAOYSA-N 50535938 CHEMBL4532372 Cholinesterase 2200 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535938 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535938&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155547036 440744520 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324239 Cc1ccc(cc1)-c1nc(NCC2CCN(Cc3ccccc3C)CC2)sc1-c1ccc(C)cc1 InChI=1S/C31H35N3S/c1-22-8-12-26(13-9-22)29-30(27-14-10-23(2)11-15-27)35-31(33-29)32-20-25-16-18-34(19-17-25)21-28-7-5-4-6-24(28)3/h4-15,25H,16-21H2,1-3H3,(H,32,33) XSVXXWBXWMWODI-UHFFFAOYSA-N 50535939 CHEMBL4560673 Cholinesterase 2510 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535939 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535939&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155558235 440744521 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324240 COc1ccc(cc1)-c1nc(NC(=O)C2CCN(Cc3ccccc3C#N)CC2)sc1-c1ccc(OC)cc1 InChI=1S/C31H30N4O3S/c1-37-26-11-7-21(8-12-26)28-29(22-9-13-27(38-2)14-10-22)39-31(33-28)34-30(36)23-15-17-35(18-16-23)20-25-6-4-3-5-24(25)19-32/h3-14,23H,15-18,20H2,1-2H3,(H,33,34,36) FMOLUPOSSFZALR-UHFFFAOYSA-N 50535940 CHEMBL4587025 Cholinesterase 3580 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535940 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535940&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155566420 440744522 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324241 COc1ccc(cc1)-c1nc(NC(=O)C2CCN(Cc3ccc(F)cc3)CC2)sc1-c1ccc(OC)cc1 InChI=1S/C30H30FN3O3S/c1-36-25-11-5-21(6-12-25)27-28(22-7-13-26(37-2)14-8-22)38-30(32-27)33-29(35)23-15-17-34(18-16-23)19-20-3-9-24(31)10-4-20/h3-14,23H,15-19H2,1-2H3,(H,32,33,35) WEFFINQGWJQUMQ-UHFFFAOYSA-N 50535941 CHEMBL4520251 Cholinesterase 1730 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535941 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535941&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155542248 440744523 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324242 COc1ccc(cc1)-c1nc(NC(=O)C2CCN(Cc3cc(F)cc(F)c3)CC2)sc1-c1ccc(OC)cc1 InChI=1S/C30H29F2N3O3S/c1-37-25-7-3-20(4-8-25)27-28(21-5-9-26(38-2)10-6-21)39-30(33-27)34-29(36)22-11-13-35(14-12-22)18-19-15-23(31)17-24(32)16-19/h3-10,15-17,22H,11-14,18H2,1-2H3,(H,33,34,36) ZYKDPKHIJHFMSS-UHFFFAOYSA-N 50535942 CHEMBL4514685 Cholinesterase >10000 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535942 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535942&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155539421 440744524 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324243 FC(F)(F)Oc1ccc(CN2CCC(CC2)C(=O)Nc2nc(c(s2)-c2ccc(Cl)cc2)-c2ccc(Cl)cc2)cc1 InChI=1S/C29H24Cl2F3N3O2S/c30-22-7-3-19(4-8-22)25-26(20-5-9-23(31)10-6-20)40-28(35-25)36-27(38)21-13-15-37(16-14-21)17-18-1-11-24(12-2-18)39-29(32,33)34/h1-12,21H,13-17H2,(H,35,36,38) GLSFHIYDEXRABI-UHFFFAOYSA-N 50535943 CHEMBL4548499 Cholinesterase 2180 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535943 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535943&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155545413 440744525 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324244 Fc1ccc(CN2CCC(CC2)C(=O)Nc2nc(c(s2)-c2ccc(Cl)cc2)-c2ccc(Cl)cc2)c(Cl)c1 InChI=1S/C28H23Cl3FN3OS/c29-21-6-1-17(2-7-21)25-26(18-3-8-22(30)9-4-18)37-28(33-25)34-27(36)19-11-13-35(14-12-19)16-20-5-10-23(32)15-24(20)31/h1-10,15,19H,11-14,16H2,(H,33,34,36) HKCIOSFWIMKXKB-UHFFFAOYSA-N 50535927 CHEMBL4529976 Cholinesterase >10000 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535927 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535927&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155545842 440744509 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324245 Fc1cccc(CN2CCC(CC2)C(=O)Nc2nc(c(s2)-c2ccc(Cl)cc2)-c2ccc(Cl)cc2)c1 InChI=1S/C28H24Cl2FN3OS/c29-22-8-4-19(5-9-22)25-26(20-6-10-23(30)11-7-20)36-28(32-25)33-27(35)21-12-14-34(15-13-21)17-18-2-1-3-24(31)16-18/h1-11,16,21H,12-15,17H2,(H,32,33,35) UKWBRAIAVTYTRI-UHFFFAOYSA-N 50535944 CHEMBL4591964 Cholinesterase 720 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535944 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535944&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155568760 440744526 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324246 FC(F)(F)c1ccccc1CN1CCC(CC1)C(=O)Nc1nc(c(s1)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1 InChI=1S/C29H24Cl2F3N3OS/c30-22-9-5-18(6-10-22)25-26(19-7-11-23(31)12-8-19)39-28(35-25)36-27(38)20-13-15-37(16-14-20)17-21-3-1-2-4-24(21)29(32,33)34/h1-12,20H,13-17H2,(H,35,36,38) NHJYZIKZNHPFGM-UHFFFAOYSA-N 50535945 CHEMBL4592283 Cholinesterase 3360 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535945 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535945&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155568936 440744527 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324247 Cc1ccccc1CN1CCC(CC1)C(=O)Nc1nc(c(s1)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1 InChI=1S/C29H27Cl2N3OS/c1-19-4-2-3-5-23(19)18-34-16-14-22(15-17-34)28(35)33-29-32-26(20-6-10-24(30)11-7-20)27(36-29)21-8-12-25(31)13-9-21/h2-13,22H,14-18H2,1H3,(H,32,33,35) BMQDPDNXZLCIBS-UHFFFAOYSA-N 50535946 CHEMBL4566613 Cholinesterase 1040 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535946 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535946&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155560822 440744528 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324248 Cc1ccc(cc1)-c1nc(NC(=O)C2CCN(Cc3c(F)cccc3Cl)CC2)sc1-c1ccc(C)cc1 InChI=1S/C30H29ClFN3OS/c1-19-6-10-21(11-7-19)27-28(22-12-8-20(2)9-13-22)37-30(33-27)34-29(36)23-14-16-35(17-15-23)18-24-25(31)4-3-5-26(24)32/h3-13,23H,14-18H2,1-2H3,(H,33,34,36) BAIXDTONAFBRQB-UHFFFAOYSA-N 50535947 CHEMBL4573793 Cholinesterase 2770 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535947 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535947&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155563122 440744529 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324249 Cc1ccc(cc1)-c1nc(NC(=O)C2CCN(Cc3ccc(F)cc3Cl)CC2)sc1-c1ccc(C)cc1 InChI=1S/C30H29ClFN3OS/c1-19-3-7-21(8-4-19)27-28(22-9-5-20(2)6-10-22)37-30(33-27)34-29(36)23-13-15-35(16-14-23)18-24-11-12-25(32)17-26(24)31/h3-12,17,23H,13-16,18H2,1-2H3,(H,33,34,36) FMAFUXOIISRRLB-UHFFFAOYSA-N 50535948 CHEMBL4578266 Cholinesterase 1600 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535948 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535948&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155564792 440744530 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324250 Cc1ccc(cc1)-c1nc(NC(=O)C2CCN(Cc3ccccc3C(F)(F)F)CC2)sc1-c1ccc(C)cc1 InChI=1S/C31H30F3N3OS/c1-20-7-11-22(12-8-20)27-28(23-13-9-21(2)10-14-23)39-30(35-27)36-29(38)24-15-17-37(18-16-24)19-25-5-3-4-6-26(25)31(32,33)34/h3-14,24H,15-19H2,1-2H3,(H,35,36,38) WUTPTCKMWDKNCG-UHFFFAOYSA-N 50535949 CHEMBL4533844 Cholinesterase 1880 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535949 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535949&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155547042 440744531 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324251 Cc1ccc(cc1)-c1nc(NC(=O)C2CCN(Cc3ccccc3C)CC2)sc1-c1ccc(C)cc1 InChI=1S/C31H33N3OS/c1-21-8-12-24(13-9-21)28-29(25-14-10-22(2)11-15-25)36-31(32-28)33-30(35)26-16-18-34(19-17-26)20-27-7-5-4-6-23(27)3/h4-15,26H,16-20H2,1-3H3,(H,32,33,35) GWZNRZRRYCXGTB-UHFFFAOYSA-N 50535929 CHEMBL4570655 Cholinesterase 1500 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535929 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535929&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155562857 440744511 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324275 Cc1ccccc1CN1CCC(CNc2nc(c(s2)-c2ccc(Cl)cc2)-c2ccc(Cl)cc2)CC1 InChI=1S/C29H29Cl2N3S/c1-20-4-2-3-5-24(20)19-34-16-14-21(15-17-34)18-32-29-33-27(22-6-10-25(30)11-7-22)28(35-29)23-8-12-26(31)13-9-23/h2-13,21H,14-19H2,1H3,(H,32,33) KDHWXYCRFWFNAS-UHFFFAOYSA-N 50535956 CHEMBL4530559 Cholinesterase 1430 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535956 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535956&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155545951 440744538 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324276 COc1ccc(cc1)-c1nc(NC(=O)C2CCN(Cc3c(F)cccc3Cl)CC2)sc1-c1ccc(OC)cc1 InChI=1S/C30H29ClFN3O3S/c1-37-22-10-6-19(7-11-22)27-28(20-8-12-23(38-2)13-9-20)39-30(33-27)34-29(36)21-14-16-35(17-15-21)18-24-25(31)4-3-5-26(24)32/h3-13,21H,14-18H2,1-2H3,(H,33,34,36) HVNNYUJRWYOLPC-UHFFFAOYSA-N 50535952 CHEMBL4570156 Cholinesterase 1570 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535952 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535952&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 132941376 440744534 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324277 Clc1ccc(cc1)-c1nc(NC(=O)C2CCN(Cc3ccccc3C#N)CC2)sc1-c1ccc(Cl)cc1 InChI=1S/C29H24Cl2N4OS/c30-24-9-5-19(6-10-24)26-27(20-7-11-25(31)12-8-20)37-29(33-26)34-28(36)21-13-15-35(16-14-21)18-23-4-2-1-3-22(23)17-32/h1-12,21H,13-16,18H2,(H,33,34,36) RQSSUVAKXUVOBX-UHFFFAOYSA-N 50535957 CHEMBL4547993 Cholinesterase 1590 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535957 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535957&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155553797 440744539 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324284 COc1ccc(cc1)-c1nc(NCC2CCN(Cc3ccccc3C)CC2)sc1-c1ccc(OC)cc1 InChI=1S/C31H35N3O2S/c1-22-6-4-5-7-26(22)21-34-18-16-23(17-19-34)20-32-31-33-29(24-8-12-27(35-2)13-9-24)30(37-31)25-10-14-28(36-3)15-11-25/h4-15,23H,16-21H2,1-3H3,(H,32,33) LGYZVNPECLNTJE-UHFFFAOYSA-N 50535958 CHEMBL4566786 Cholinesterase 2210 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535958 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535958&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155543495 440744540 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324285 COc1ccc(cc1)-c1nc(NC(=O)C2CCN(Cc3cccc(F)c3)CC2)sc1-c1ccc(OC)cc1 InChI=1S/C30H30FN3O3S/c1-36-25-10-6-21(7-11-25)27-28(22-8-12-26(37-2)13-9-22)38-30(32-27)33-29(35)23-14-16-34(17-15-23)19-20-4-3-5-24(31)18-20/h3-13,18,23H,14-17,19H2,1-2H3,(H,32,33,35) GYNHZAHQEFAGJK-UHFFFAOYSA-N 50535959 CHEMBL4571742 Cholinesterase 1540 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535959 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535959&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155562879 440744541 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324286 Cc1ccc(cc1)-c1nc(NC(=O)C2CCN(Cc3cc(F)cc(F)c3)CC2)sc1-c1ccc(C)cc1 InChI=1S/C30H29F2N3OS/c1-19-3-7-22(8-4-19)27-28(23-9-5-20(2)6-10-23)37-30(33-27)34-29(36)24-11-13-35(14-12-24)18-21-15-25(31)17-26(32)16-21/h3-10,15-17,24H,11-14,18H2,1-2H3,(H,33,34,36) HOXPBZAZYWNBBS-UHFFFAOYSA-N 50535960 CHEMBL4535218 Cholinesterase 3510 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 132941375 440744542 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324290 Cc1ccc(CN2CCC(CC2)Nc2nc(c(s2)-c2ccc(C)cc2)-c2ccc(C)cc2)cc1 InChI=1S/C30H33N3S/c1-21-4-10-24(11-5-21)20-33-18-16-27(17-19-33)31-30-32-28(25-12-6-22(2)7-13-25)29(34-30)26-14-8-23(3)9-15-26/h4-15,27H,16-20H2,1-3H3,(H,31,32) BTQWMWXRHHEZLJ-UHFFFAOYSA-N 50535961 CHEMBL4540644 Cholinesterase 6030 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155549946 440744543 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324291 Fc1ccc(CN2CCC(CC2)Nc2nc(c(s2)-c2ccc(Cl)cc2)-c2ccc(Cl)cc2)c(Cl)c1 InChI=1S/C27H23Cl3FN3S/c28-20-6-1-17(2-7-20)25-26(18-3-8-21(29)9-4-18)35-27(33-25)32-23-11-13-34(14-12-23)16-19-5-10-22(31)15-24(19)30/h1-10,15,23H,11-14,16H2,(H,32,33) DCOKCSRXAPRZJS-UHFFFAOYSA-N 50535950 CHEMBL4516508 Cholinesterase 1970 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535950 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535950&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 132941378 440744532 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324292 COc1ccc(cc1)-c1nc(NC2CCN(Cc3ccc(cc3)C(F)(F)F)CC2)sc1-c1ccc(OC)cc1 InChI=1S/C30H30F3N3O2S/c1-37-25-11-5-21(6-12-25)27-28(22-7-13-26(38-2)14-8-22)39-29(35-27)34-24-15-17-36(18-16-24)19-20-3-9-23(10-4-20)30(31,32)33/h3-14,24H,15-19H2,1-2H3,(H,34,35) ARLFGJNFOMNXIQ-UHFFFAOYSA-N 50535963 CHEMBL4544950 Cholinesterase 1680 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535963 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535963&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155553161 440744545 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324293 COc1ccc(cc1)-c1nc(NCC2CCN(Cc3ccccc3C(F)(F)F)CC2)sc1-c1ccc(OC)cc1 InChI=1S/C31H32F3N3O2S/c1-38-25-11-7-22(8-12-25)28-29(23-9-13-26(39-2)14-10-23)40-30(36-28)35-19-21-15-17-37(18-16-21)20-24-5-3-4-6-27(24)31(32,33)34/h3-14,21H,15-20H2,1-2H3,(H,35,36) WYAAXMCFRXQPNY-UHFFFAOYSA-N 50535964 CHEMBL4527770 Cholinesterase 8010 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535964 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535964&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155544388 440744546 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324294 Fc1cc(F)cc(CN2CCC(CNc3nc(c(s3)-c3ccc(Cl)cc3)-c3ccc(Cl)cc3)CC2)c1 InChI=1S/C28H25Cl2F2N3S/c29-22-5-1-20(2-6-22)26-27(21-3-7-23(30)8-4-21)36-28(34-26)33-16-18-9-11-35(12-10-18)17-19-13-24(31)15-25(32)14-19/h1-8,13-15,18H,9-12,16-17H2,(H,33,34) AVJSOHMZQDCZLD-UHFFFAOYSA-N 50535951 CHEMBL4529936 Cholinesterase 820 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535951 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535951&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155545649 440744533 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324295 COc1ccc(cc1)-c1nc(NC(=O)C2CCN(Cc3ccc(F)cc3C(F)(F)F)CC2)sc1-c1ccc(OC)cc1 InChI=1S/C31H29F4N3O3S/c1-40-24-9-4-19(5-10-24)27-28(20-6-11-25(41-2)12-7-20)42-30(36-27)37-29(39)21-13-15-38(16-14-21)18-22-3-8-23(32)17-26(22)31(33,34)35/h3-12,17,21H,13-16,18H2,1-2H3,(H,36,37,39) CIHYPWXDKRZDGE-UHFFFAOYSA-N 50535926 CHEMBL4549599 Cholinesterase 1780 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535926 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535926&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155543560 440744508 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324296 COc1ccc(cc1)-c1nc(NC(=O)C2CCN(Cc3ccccc3C)CC2)sc1-c1ccc(OC)cc1 InChI=1S/C31H33N3O3S/c1-21-6-4-5-7-25(21)20-34-18-16-24(17-19-34)30(35)33-31-32-28(22-8-12-26(36-2)13-9-22)29(38-31)23-10-14-27(37-3)15-11-23/h4-15,24H,16-20H2,1-3H3,(H,32,33,35) CCXYJRSEOJUDQL-UHFFFAOYSA-N 50535953 CHEMBL4593583 Cholinesterase 1850 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535953 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535953&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155569448 440744535 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324297 Fc1cc(F)cc(CN2CCC(CC2)C(=O)Nc2nc(c(s2)-c2ccc(Cl)cc2)-c2ccc(Cl)cc2)c1 InChI=1S/C28H23Cl2F2N3OS/c29-21-5-1-18(2-6-21)25-26(19-3-7-22(30)8-4-19)37-28(33-25)34-27(36)20-9-11-35(12-10-20)16-17-13-23(31)15-24(32)14-17/h1-8,13-15,20H,9-12,16H2,(H,33,34,36) NYIVZAOAOSABAD-UHFFFAOYSA-N 50535954 CHEMBL4532149 Cholinesterase 3030 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535954 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535954&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155546416 440744536 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324298 Cc1ccc(cc1)-c1nc(NC(=O)C2CCN(Cc3ccc(cc3)C(F)(F)F)CC2)sc1-c1ccc(C)cc1 InChI=1S/C31H30F3N3OS/c1-20-3-9-23(10-4-20)27-28(24-11-5-21(2)6-12-24)39-30(35-27)36-29(38)25-15-17-37(18-16-25)19-22-7-13-26(14-8-22)31(32,33)34/h3-14,25H,15-19H2,1-2H3,(H,35,36,38) OAIBHPDMYPWSFW-UHFFFAOYSA-N 50535962 CHEMBL4548883 Cholinesterase 2780 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535962 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535962&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155549491 440744544 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324299 Cc1ccc(cc1)-c1nc(NC(=O)C2CCN(Cc3cccc(F)c3)CC2)sc1-c1ccc(C)cc1 InChI=1S/C30H30FN3OS/c1-20-6-10-23(11-7-20)27-28(24-12-8-21(2)9-13-24)36-30(32-27)33-29(35)25-14-16-34(17-15-25)19-22-4-3-5-26(31)18-22/h3-13,18,25H,14-17,19H2,1-2H3,(H,32,33,35) PPTLIBORLIKETA-UHFFFAOYSA-N 50535928 CHEMBL4554172 Cholinesterase 1970 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535928 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535928&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155555974 440744510 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51324308 Cc1ccc(cc1)-c1nc(NC(=O)C2CCN(Cc3ccc(cc3)C#N)CC2)sc1-c1ccc(C)cc1 InChI=1S/C31H30N4OS/c1-21-3-11-25(12-4-21)28-29(26-13-5-22(2)6-14-26)37-31(33-28)34-30(36)27-15-17-35(18-16-27)20-24-9-7-23(19-32)8-10-24/h3-14,27H,15-18,20H2,1-2H3,(H,33,34,36) FQGHHVRMNYDPNO-UHFFFAOYSA-N 50535955 CHEMBL4535748 Cholinesterase 5320 ChEMBL 10.1021/acs.jmedchem.6b00426 10.7270/Q2SJ1Q44 27253679 Shidore, M; Machhi, J; Shingala, K; Murumkar, P; Sharma, MK; Agrawal, N; Tripathi, A; Parikh, Z; Pillai, P; Yadav, MR The Maharaja Sayajirao University of Baroda http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50535955 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50535955&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155547781 440744537 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51320882 Cc1cc2nc([nH]c2cc1C)[C@@H]1CCCN1C(=O)[C@H]1C[C@@H](O)CN1Cc1ccccc1 InChI=1S/C25H30N4O2/c1-16-11-20-21(12-17(16)2)27-24(26-20)22-9-6-10-29(22)25(31)23-13-19(30)15-28(23)14-18-7-4-3-5-8-18/h3-5,7-8,11-12,19,22-23,30H,6,9-10,13-15H2,1-2H3,(H,26,27)/t19-,22+,23-/m1/s1 UBBCHHRFFWUMLM-WTIAFYNJSA-N 50534410 CHEMBL4520824 Cholinesterase 46800 ChEMBL 10.1021/acs.jmedchem.6b00356 10.7270/Q2959N29 27405689 Dighe, SN; Deora, GS; De la Mora, E; Nachon, F; Chan, S; Parat, MO; Brazzolotto, X; Ross, BP The University of Queensland http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50534410 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50534410&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 124364827 440742992 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51320884 CCn1c2ccccc2c2cc(ccc12)C1C(C(=O)OCC2CCCO2)=C(C)NC2=C1C(=O)CCC2 InChI=1S/C30H32N2O4/c1-3-32-24-11-5-4-9-21(24)22-16-19(13-14-25(22)32)28-27(30(34)36-17-20-8-7-15-35-20)18(2)31-23-10-6-12-26(33)29(23)28/h4-5,9,11,13-14,16,20,28,31H,3,6-8,10,12,15,17H2,1-2H3 SHBFRAVLHSPWTB-UHFFFAOYSA-N 50534411 CHEMBL4578033 Cholinesterase 763 ChEMBL 10.1021/acs.jmedchem.6b00356 10.7270/Q2959N29 27405689 Dighe, SN; Deora, GS; De la Mora, E; Nachon, F; Chan, S; Parat, MO; Brazzolotto, X; Ross, BP The University of Queensland http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50534411 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50534411&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 6QS 5K5E 2891624 440742993 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51320885 CN(C)CCN(Cc1c(C)nn(c1C)-c1ccccc1C)Cc1ccccn1 InChI=1S/C23H31N5/c1-18-10-6-7-12-23(18)28-20(3)22(19(2)25-28)17-27(15-14-26(4)5)16-21-11-8-9-13-24-21/h6-13H,14-17H2,1-5H3 DUDFWOXEBUYBFR-UHFFFAOYSA-N 50534412 CHEMBL4545740 Cholinesterase 19200 ChEMBL 10.1021/acs.jmedchem.6b00356 10.7270/Q2959N29 27405689 Dighe, SN; Deora, GS; De la Mora, E; Nachon, F; Chan, S; Parat, MO; Brazzolotto, X; Ross, BP The University of Queensland http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50534412 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50534412&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46961963 440742994 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51320886 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 5910 ChEMBL 10.1021/acs.jmedchem.6b00356 10.7270/Q2959N29 27405689 Dighe, SN; Deora, GS; De la Mora, E; Nachon, F; Chan, S; Parat, MO; Brazzolotto, X; Ross, BP The University of Queensland http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51320887 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 14 ChEMBL 10.1021/acs.jmedchem.6b00356 10.7270/Q2959N29 27405689 Dighe, SN; Deora, GS; De la Mora, E; Nachon, F; Chan, S; Parat, MO; Brazzolotto, X; Ross, BP The University of Queensland http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51320893 CCn1c2ccccc2c2cc(ccc12)[C@@H]1C(C(=O)OCCOC)=C(C)NC2=C1C(=O)CCC2 InChI=1S/C28H30N2O4/c1-4-30-22-10-6-5-8-19(22)20-16-18(12-13-23(20)30)26-25(28(32)34-15-14-33-3)17(2)29-21-9-7-11-24(31)27(21)26/h5-6,8,10,12-13,16,26,29H,4,7,9,11,14-15H2,1-3H3/t26-/m1/s1 WZDQGHZESJPTAI-AREMUKBSSA-N 50534413 CHEMBL4451368 Cholinesterase 9720 ChEMBL 10.1021/acs.jmedchem.6b00356 10.7270/Q2959N29 27405689 Dighe, SN; Deora, GS; De la Mora, E; Nachon, F; Chan, S; Parat, MO; Brazzolotto, X; Ross, BP The University of Queensland http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50534413 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50534413&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 51419652 440742995 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51320894 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 11682 2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::Rivastigmine.tartrate::US9586925, Rivastigmine Cholinesterase 495 ChEMBL 10.1021/acs.jmedchem.6b00356 10.7270/Q2959N29 27405689 Dighe, SN; Deora, GS; De la Mora, E; Nachon, F; Chan, S; Parat, MO; Brazzolotto, X; Ross, BP The University of Queensland http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=11682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=11682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46512204 DB00989 C11766 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51320895 Cc1cccc(c1)C1(O)CCN(Cc2c([nH]c3ncccc23)-c2cccs2)CC1 InChI=1S/C24H25N3OS/c1-17-5-2-6-18(15-17)24(28)9-12-27(13-10-24)16-20-19-7-3-11-25-23(19)26-22(20)21-8-4-14-29-21/h2-8,11,14-15,28H,9-10,12-13,16H2,1H3,(H,25,26) MEDYKEOZOYNTGI-UHFFFAOYSA-N 50534414 CHEMBL4452331 Cholinesterase 48900 ChEMBL 10.1021/acs.jmedchem.6b00356 10.7270/Q2959N29 27405689 Dighe, SN; Deora, GS; De la Mora, E; Nachon, F; Chan, S; Parat, MO; Brazzolotto, X; Ross, BP The University of Queensland http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50534414 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50534414&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46954836 440742996 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297118 Cc1nn(c2OS(=O)(=O)CC(c12)c1ccc(C)c(Br)c1)-c1ccccc1 InChI=1S/C19H17BrN2O3S/c1-12-8-9-14(10-17(12)20)16-11-26(23,24)25-19-18(16)13(2)21-22(19)15-6-4-3-5-7-15/h3-10,16H,11H2,1-2H3 CQVPBGMNLQENHZ-UHFFFAOYSA-N 50528677 CHEMBL4449553 Cholinesterase 18280 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528677 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528677&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155520821 440737259 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297119 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 10380 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297120 Cc1cc(ccc1Br)C1CS(=O)(=O)Oc2c1c(nn2-c1ccccc1Cl)C1CC1 InChI=1S/C21H18BrClN2O3S/c1-12-10-14(8-9-16(12)22)15-11-29(26,27)28-21-19(15)20(13-6-7-13)24-25(21)18-5-3-2-4-17(18)23/h2-5,8-10,13,15H,6-7,11H2,1H3 FFKPRPJWNICEBD-UHFFFAOYSA-N 50528678 CHEMBL4539779 Cholinesterase 3770 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528678 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528678&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155550062 440737260 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297121 COc1ccc(cc1)C1CS(=O)(=O)Oc2c1c(C)nn2-c1ccccc1 InChI=1S/C19H18N2O4S/c1-13-18-17(14-8-10-16(24-2)11-9-14)12-26(22,23)25-19(18)21(20-13)15-6-4-3-5-7-15/h3-11,17H,12H2,1-2H3 DMONOVWBBJCHRW-UHFFFAOYSA-N 50528679 CHEMBL4463401 Cholinesterase 9350 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528679 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528679&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155529396 440737261 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297122 Cc1nn(c2OS(=O)(=O)CC(c12)c1cccc(F)c1)-c1ccccc1 InChI=1S/C18H15FN2O3S/c1-12-17-16(13-6-5-7-14(19)10-13)11-25(22,23)24-18(17)21(20-12)15-8-3-2-4-9-15/h2-10,16H,11H2,1H3 VQKGCFOMIAUJJP-UHFFFAOYSA-N 50528680 CHEMBL4536663 Cholinesterase 9820 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528680 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528680&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155548503 440737262 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297123 Cc1nn(c2OS(=O)(=O)CC(c12)c1cccc(C)c1)-c1ccccc1 InChI=1S/C19H18N2O3S/c1-13-7-6-8-15(11-13)17-12-25(22,23)24-19-18(17)14(2)20-21(19)16-9-4-3-5-10-16/h3-11,17H,12H2,1-2H3 ZEFYSNINSJVGJT-UHFFFAOYSA-N 50528681 CHEMBL4470984 Cholinesterase 17710 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528681 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528681&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155535009 440737263 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297124 Cc1nn(c2OS(=O)(=O)CC(c3cc4ccccc4o3)c12)-c1ccccc1 InChI=1S/C20H16N2O4S/c1-13-19-16(18-11-14-7-5-6-10-17(14)25-18)12-27(23,24)26-20(19)22(21-13)15-8-3-2-4-9-15/h2-11,16H,12H2,1H3 ZDILEPZHIMZIJG-UHFFFAOYSA-N 50528682 CHEMBL4461045 Cholinesterase 2600 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155528222 440737264 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297125 Cc1nn(c2OS(=O)(=O)CC(\C=C\c3cccc(C)c3)c12)-c1ccccc1 InChI=1S/C21H20N2O3S/c1-15-7-6-8-17(13-15)11-12-18-14-27(24,25)26-21-20(18)16(2)22-23(21)19-9-4-3-5-10-19/h3-13,18H,14H2,1-2H3/b12-11+ JGARFMVZWNPCBX-VAWYXSNFSA-N 50528683 CHEMBL4448386 Cholinesterase 10060 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528683 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528683&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155519646 440737265 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297126 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 11682 2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::Rivastigmine.tartrate::US9586925, Rivastigmine Cholinesterase 560 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=11682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=11682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46512204 DB00989 C11766 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297127 Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F InChI=1S/C12H11FN2O3S/c1-8-9-6-7-19(16,17)18-12(9)15(14-8)11-5-3-2-4-10(11)13/h2-5H,6-7H2,1H3 SMSFRYXCFRZWAE-UHFFFAOYSA-N 50528684 CHEMBL4560302 Cholinesterase 1800 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528684 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528684&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155558388 440737266 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297128 Fc1ccccc1-n1nc(C2CC2)c2CCS(=O)(=O)Oc12 InChI=1S/C14H13FN2O3S/c15-11-3-1-2-4-12(11)17-14-10(7-8-21(18,19)20-14)13(16-17)9-5-6-9/h1-4,9H,5-8H2 CTMADYVHIUYPPF-UHFFFAOYSA-N 50528685 CHEMBL4457213 Cholinesterase 199 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528685 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528685&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 154722373 440737267 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297129 Fc1ccc(cc1)C1CS(=O)(=O)Oc2c1c(nn2-c1ccccc1F)C1CC1 InChI=1S/C20H16F2N2O3S/c21-14-9-7-12(8-10-14)15-11-28(25,26)27-20-18(15)19(13-5-6-13)23-24(20)17-4-2-1-3-16(17)22/h1-4,7-10,13,15H,5-6,11H2 BPSCNTHGMCIERI-UHFFFAOYSA-N 50528686 CHEMBL4452132 Cholinesterase 7760 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528686 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528686&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155522249 440737268 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297130 Fc1cccc(c1)C1CS(=O)(=O)Oc2c1c(nn2-c1ccccc1F)C1CC1 InChI=1S/C20H16F2N2O3S/c21-14-5-3-4-13(10-14)15-11-28(25,26)27-20-18(15)19(12-8-9-12)23-24(20)17-7-2-1-6-16(17)22/h1-7,10,12,15H,8-9,11H2 KUKOXQJBXQDWQJ-UHFFFAOYSA-N 50528687 CHEMBL4587583 Cholinesterase 4010 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528687 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528687&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155566402 440737269 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297131 Cc1cc(ccc1Br)C1CS(=O)(=O)Oc2c1c(nn2-c1cccc(F)c1)C1CC1 InChI=1S/C21H18BrFN2O3S/c1-12-9-14(7-8-18(12)22)17-11-29(26,27)28-21-19(17)20(13-5-6-13)24-25(21)16-4-2-3-15(23)10-16/h2-4,7-10,13,17H,5-6,11H2,1H3 DQQFHGDXFMCOHM-UHFFFAOYSA-N 50528688 CHEMBL4547095 Cholinesterase 11450 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528688 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528688&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155552368 440737270 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297132 Fc1cccc(c1)-n1nc(C2CC2)c2C(CS(=O)(=O)Oc12)c1cccc(c1)C(F)(F)F InChI=1S/C21H16F4N2O3S/c22-15-5-2-6-16(10-15)27-20-18(19(26-27)12-7-8-12)17(11-31(28,29)30-20)13-3-1-4-14(9-13)21(23,24)25/h1-6,9-10,12,17H,7-8,11H2 ICOHSQZYWBIERG-UHFFFAOYSA-N 50528689 CHEMBL4443049 Cholinesterase 4620 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528689 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528689&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155516100 440737271 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297133 COc1ccc(cc1)-c1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F InChI=1S/C18H15FN2O4S/c1-24-13-8-6-12(7-9-13)17-14-10-11-26(22,23)25-18(14)21(20-17)16-5-3-2-4-15(16)19/h2-9H,10-11H2,1H3 ORBAWCWPKRGFKA-UHFFFAOYSA-N 50528690 CHEMBL4545271 Cholinesterase 460 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528690 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528690&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 154722374 440737272 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297134 COc1ccc(cc1)-c1nn(c2OS(=O)(=O)CC(c12)c1ccc(Br)c(C)c1)-c1ccccc1F InChI=1S/C25H20BrFN2O4S/c1-15-13-17(9-12-20(15)26)19-14-34(30,31)33-25-23(19)24(16-7-10-18(32-2)11-8-16)28-29(25)22-6-4-3-5-21(22)27/h3-13,19H,14H2,1-2H3 IVAUBIBAXIONGR-UHFFFAOYSA-N 50528691 CHEMBL4556638 Cholinesterase 4330 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528691 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528691&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155556932 440737273 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297135 COc1ccc(cc1)-c1nn(c2OS(=O)(=O)CC(c12)c1ccc(Br)c(C)c1)-c1ccc(Cl)cc1 InChI=1S/C25H20BrClN2O4S/c1-15-13-17(5-12-22(15)26)21-14-34(30,31)33-25-23(21)24(16-3-10-20(32-2)11-4-16)28-29(25)19-8-6-18(27)7-9-19/h3-13,21H,14H2,1-2H3 FJTCNGSKMGLHMK-UHFFFAOYSA-N 50528692 CHEMBL4565603 Cholinesterase 13290 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528692 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528692&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155554239 440737274 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297136 COc1ccc(cc1)-c1nn(c2OS(=O)(=O)CCc12)-c1ccccc1Cl InChI=1S/C18H15ClN2O4S/c1-24-13-8-6-12(7-9-13)17-14-10-11-26(22,23)25-18(14)21(20-17)16-5-3-2-4-15(16)19/h2-9H,10-11H2,1H3 KDBPSMFJVTWLGA-UHFFFAOYSA-N 50528693 CHEMBL4513389 Cholinesterase 60 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528693 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528693&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 154722375 440737275 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297137 CC1=NN2C(C1)c1cc(Cl)cc(Cl)c1OC2=O InChI=1S/C11H8Cl2N2O2/c1-5-2-9-7-3-6(12)4-8(13)10(7)17-11(16)15(9)14-5/h3-4,9H,2H2,1H3 ZKFLDLVFWUDQGG-UHFFFAOYSA-N 50528694 CHEMBL4440216 Cholinesterase 1060 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528694 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528694&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155514347 440737276 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297139 Cc1nn(c2OS(=O)(=O)CC(c12)c1ccc(F)cc1)-c1ccccc1F InChI=1S/C18H14F2N2O3S/c1-11-17-14(12-6-8-13(19)9-7-12)10-26(23,24)25-18(17)22(21-11)16-5-3-2-4-15(16)20/h2-9,14H,10H2,1H3 KUZUJHHUXPATNO-UHFFFAOYSA-N 50528695 CHEMBL4522656 Cholinesterase 6100 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528695 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528695&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155543638 440737277 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297140 Fc1ccc(cc1)C1CS(=O)(=O)Oc2c1c(nn2-c1ccccc1Cl)C1CC1 InChI=1S/C20H16ClFN2O3S/c21-16-3-1-2-4-17(16)24-20-18(19(23-24)13-5-6-13)15(11-28(25,26)27-20)12-7-9-14(22)10-8-12/h1-4,7-10,13,15H,5-6,11H2 PFXODHSEFAYGFU-UHFFFAOYSA-N 50528696 CHEMBL4451107 Cholinesterase 6020 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528696 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528696&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155521723 440737278 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297141 COc1ccc(cc1)-c1nn(c2OS(=O)(=O)CCc12)-c1ccccc1Cl InChI=1S/C18H15ClN2O4S/c1-24-13-8-6-12(7-9-13)17-14-10-11-26(22,23)25-18(14)21(20-17)16-5-3-2-4-15(16)19/h2-9H,10-11H2,1H3 KDBPSMFJVTWLGA-UHFFFAOYSA-N 50528693 CHEMBL4513389 Cholinesterase 420 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528693 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528693&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 154722375 440737275 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297144 Cc1nn(c2OS(=O)(=O)CC(c3ccsc3)c12)-c1ccccc1 InChI=1S/C16H14N2O3S2/c1-11-15-14(12-7-8-22-9-12)10-23(19,20)21-16(15)18(17-11)13-5-3-2-4-6-13/h2-9,14H,10H2,1H3 LTDOKKOCHUSJME-UHFFFAOYSA-N 50528698 CHEMBL4565000 Cholinesterase 10120 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528698 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528698&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155544722 440737280 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297145 COc1cccc(c1)C1CS(=O)(=O)Oc2c1c(nn2-c1ccccc1F)C1CC1 InChI=1S/C21H19FN2O4S/c1-27-15-6-4-5-14(11-15)16-12-29(25,26)28-21-19(16)20(13-9-10-13)23-24(21)18-8-3-2-7-17(18)22/h2-8,11,13,16H,9-10,12H2,1H3 JDYMQNQPWRPNLQ-UHFFFAOYSA-N 50528699 CHEMBL4549779 Cholinesterase 3470 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528699 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528699&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155550908 440737281 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297146 COc1cccc(c1)C1CS(=O)(=O)Oc2c1c(C)nn2-c1ccccc1 InChI=1S/C19H18N2O4S/c1-13-18-17(14-7-6-10-16(11-14)24-2)12-26(22,23)25-19(18)21(20-13)15-8-4-3-5-9-15/h3-11,17H,12H2,1-2H3 UPMCMHNJWBLBMF-UHFFFAOYSA-N 50528700 CHEMBL4466602 Cholinesterase 10980 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528700 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528700&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155532141 440737282 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297147 Cc1nn(c2OS(=O)(=O)CC(\C=C\c3cccc(c3)C#N)c12)-c1ccccc1 InChI=1S/C21H17N3O3S/c1-15-20-18(11-10-16-6-5-7-17(12-16)13-22)14-28(25,26)27-21(20)24(23-15)19-8-3-2-4-9-19/h2-12,18H,14H2,1H3/b11-10+ VOUNLHMMTHEDPL-ZHACJKMWSA-N 50528697 CHEMBL4463274 Cholinesterase 10630 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528697 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528697&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155529467 440737279 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297148 Cc1nn(c2OS(=O)(=O)CC(c12)c1ccc(Br)c(C)c1)-c1ccccc1F InChI=1S/C19H16BrFN2O3S/c1-11-9-13(7-8-15(11)20)14-10-27(24,25)26-19-18(14)12(2)22-23(19)17-6-4-3-5-16(17)21/h3-9,14H,10H2,1-2H3 CYIYHDKSJPUTCB-UHFFFAOYSA-N 50528701 CHEMBL4464316 Cholinesterase 3830 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528701 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528701&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155530635 440737283 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297149 Cc1cc(ccc1Br)C1CS(=O)(=O)Oc2c1c(nn2-c1ccccc1F)C1CC1 InChI=1S/C21H18BrFN2O3S/c1-12-10-14(8-9-16(12)22)15-11-29(26,27)28-21-19(15)20(13-6-7-13)24-25(21)18-5-3-2-4-17(18)23/h2-5,8-10,13,15H,6-7,11H2,1H3 GQJJADGNSROQEW-UHFFFAOYSA-N 50528702 CHEMBL4470686 Cholinesterase 5710 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528702 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528702&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155534757 440737284 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297150 COc1cccc(c1)C1CS(=O)(=O)Oc2c1c(nn2-c1cccc(F)c1)C1CC1 InChI=1S/C21H19FN2O4S/c1-27-17-7-2-4-14(10-17)18-12-29(25,26)28-21-19(18)20(13-8-9-13)23-24(21)16-6-3-5-15(22)11-16/h2-7,10-11,13,18H,8-9,12H2,1H3 XXOULTLHZZQCCS-UHFFFAOYSA-N 50528703 CHEMBL4574172 Cholinesterase 14310 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528703 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528703&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155564176 440737285 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297151 COc1ccc(cc1)-c1nn(c2OS(=O)(=O)CC(c12)c1ccc(cc1)C#N)-c1ccc(Cl)cc1 InChI=1S/C25H18ClN3O4S/c1-32-21-12-6-18(7-13-21)24-23-22(17-4-2-16(14-27)3-5-17)15-34(30,31)33-25(23)29(28-24)20-10-8-19(26)9-11-20/h2-13,22H,15H2,1H3 YDLQLZPMLKXCQW-UHFFFAOYSA-N 50528704 CHEMBL4468896 Cholinesterase 21000 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528704 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528704&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155533294 440737286 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297152 COc1ccc(cc1)-c1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F InChI=1S/C18H15FN2O4S/c1-24-13-8-6-12(7-9-13)17-14-10-11-26(22,23)25-18(14)21(20-17)16-5-3-2-4-15(16)19/h2-9H,10-11H2,1H3 ORBAWCWPKRGFKA-UHFFFAOYSA-N 50528690 CHEMBL4545271 Cholinesterase 145 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528690 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528690&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 154722374 440737272 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297153 Cc1nn(c2OS(=O)(=O)CC(c12)c1cccc(c1)C(F)(F)F)-c1ccccc1 InChI=1S/C19H15F3N2O3S/c1-12-17-16(13-6-5-7-14(10-13)19(20,21)22)11-28(25,26)27-18(17)24(23-12)15-8-3-2-4-9-15/h2-10,16H,11H2,1H3 VUIFQCLGLTVSJF-UHFFFAOYSA-N 50528705 CHEMBL4445890 Cholinesterase 16440 ChEMBL 10.1016/j.ejmech.2019.111598 10.7270/Q24F1V59 31415981 Xu, Y; Zhang, Z; Jiang, X; Chen, X; Wang, Z; Alsulami, H; Qin, HL; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528705 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528705&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155518341 440737287 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297188 Nc1ccc2oc(nc2c1)N1CCN(Cc2ccccc2)CC1 InChI=1S/C18H20N4O/c19-15-6-7-17-16(12-15)20-18(23-17)22-10-8-21(9-11-22)13-14-4-2-1-3-5-14/h1-7,12H,8-11,13,19H2 KICGZMCEVMIAFY-UHFFFAOYSA-N 50528726 CHEMBL4451956 Cholinesterase 6757 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528726 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528726&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155521577 440737308 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297192 Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1cccc(F)c1 InChI=1S/C18H17FN4O2/c19-13-3-1-2-12(10-13)17(24)22-6-8-23(9-7-22)18-21-15-11-14(20)4-5-16(15)25-18/h1-5,10-11H,6-9,20H2 LRULWXJWLVHMDS-UHFFFAOYSA-N 50528730 CHEMBL4450353 Cholinesterase 5539 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528730 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528730&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155521434 440737312 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297193 COc1ccc(CN2CCN(CC2)c2nc3cc(N)ccc3o2)cc1 InChI=1S/C19H22N4O2/c1-24-16-5-2-14(3-6-16)13-22-8-10-23(11-9-22)19-21-17-12-15(20)4-7-18(17)25-19/h2-7,12H,8-11,13,20H2,1H3 CYRDOTHILGSCAA-UHFFFAOYSA-N 50528731 CHEMBL4442752 Cholinesterase 6327 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528731 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528731&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155516154 440737313 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297211 Nc1ccc2oc(nc2c1)N1CCOCC1 InChI=1S/C11H13N3O2/c12-8-1-2-10-9(7-8)13-11(16-10)14-3-5-15-6-4-14/h1-2,7H,3-6,12H2 QOLUHUNFWRRDQW-UHFFFAOYSA-N 50528732 CHEMBL4558783 Cholinesterase 32296 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528732 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528732&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 16768943 440737314 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297212 Nc1ccc2oc(nc2c1)N1CCN(CC1)c1ccc(Cl)cc1 InChI=1S/C17H17ClN4O/c18-12-1-4-14(5-2-12)21-7-9-22(10-8-21)17-20-15-11-13(19)3-6-16(15)23-17/h1-6,11H,7-10,19H2 MPTNQPCZDPIREH-UHFFFAOYSA-N 50528733 CHEMBL4565910 Cholinesterase 11102 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528733 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528733&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155550714 440737315 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297213 Nc1ccc2oc(nc2c1)N1CCN(CC1)c1ccc(Br)cc1 InChI=1S/C17H17BrN4O/c18-12-1-4-14(5-2-12)21-7-9-22(10-8-21)17-20-15-11-13(19)3-6-16(15)23-17/h1-6,11H,7-10,19H2 YWLNNRGBGJWZNN-UHFFFAOYSA-N 50528734 CHEMBL4575964 Cholinesterase 8762 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528734 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528734&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155564261 440737316 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297214 Nc1ccc2oc(nc2c1)N1CCN(CC1)c1ccc(F)cc1 InChI=1S/C17H17FN4O/c18-12-1-4-14(5-2-12)21-7-9-22(10-8-21)17-20-15-11-13(19)3-6-16(15)23-17/h1-6,11H,7-10,19H2 ZBLUZDMCWVXSDP-UHFFFAOYSA-N 50528747 CHEMBL4474675 Cholinesterase 6476 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528747 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528747&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155537193 440737329 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297215 Nc1ccc2oc(NC3CCN(Cc4ccccc4)CC3)nc2c1 InChI=1S/C19H22N4O/c20-15-6-7-18-17(12-15)22-19(24-18)21-16-8-10-23(11-9-16)13-14-4-2-1-3-5-14/h1-7,12,16H,8-11,13,20H2,(H,21,22) XTJDENGCGQYVRU-UHFFFAOYSA-N 50528737 CHEMBL4545023 Cholinesterase 2272 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528737 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528737&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 113252206 440737319 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297216 Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1ccccc1 InChI=1S/C18H18N4O2/c19-14-6-7-16-15(12-14)20-18(24-16)22-10-8-21(9-11-22)17(23)13-4-2-1-3-5-13/h1-7,12H,8-11,19H2 PAQYQFMEENTNLF-UHFFFAOYSA-N 50528738 CHEMBL4589809 Cholinesterase 6052 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528738 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528738&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155568713 440737320 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297217 Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1cccc(Cl)c1 InChI=1S/C18H17ClN4O2/c19-13-3-1-2-12(10-13)17(24)22-6-8-23(9-7-22)18-21-15-11-14(20)4-5-16(15)25-18/h1-5,10-11H,6-9,20H2 LFUODYJQQZZUOJ-UHFFFAOYSA-N 50528728 CHEMBL4474948 Cholinesterase 4562 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528728 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528728&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155537608 440737310 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297218 Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1ccccc1Br InChI=1S/C18H17BrN4O2/c19-14-4-2-1-3-13(14)17(24)22-7-9-23(10-8-22)18-21-15-11-12(20)5-6-16(15)25-18/h1-6,11H,7-10,20H2 MNHUDBRYWZKGLU-UHFFFAOYSA-N 50528739 CHEMBL4588952 Cholinesterase 6193 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528739 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528739&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155567361 440737321 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297219 Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1cccc(Br)c1 InChI=1S/C18H17BrN4O2/c19-13-3-1-2-12(10-13)17(24)22-6-8-23(9-7-22)18-21-15-11-14(20)4-5-16(15)25-18/h1-5,10-11H,6-9,20H2 UFEIFQHRSUQYMJ-UHFFFAOYSA-N 50528748 CHEMBL4442490 Cholinesterase 2676 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528748 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528748&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155515812 440737330 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297220 Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1ccccc1F InChI=1S/C18H17FN4O2/c19-14-4-2-1-3-13(14)17(24)22-7-9-23(10-8-22)18-21-15-11-12(20)5-6-16(15)25-18/h1-6,11H,7-10,20H2 NSSSJRCYPMEFCN-UHFFFAOYSA-N 50528741 CHEMBL4435341 Cholinesterase 8392 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528741 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528741&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155511024 440737323 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297221 Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1ccc(F)cc1 InChI=1S/C18H17FN4O2/c19-13-3-1-12(2-4-13)17(24)22-7-9-23(10-8-22)18-21-15-11-14(20)5-6-16(15)25-18/h1-6,11H,7-10,20H2 XXFQHFFMBQQVLR-UHFFFAOYSA-N 50528749 CHEMBL4462677 Cholinesterase 817 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528749 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528749&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155529145 440737331 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297222 COc1cccc(c1)C(=O)N1CCN(CC1)c1nc2cc(N)ccc2o1 InChI=1S/C19H20N4O3/c1-25-15-4-2-3-13(11-15)18(24)22-7-9-23(10-8-22)19-21-16-12-14(20)5-6-17(16)26-19/h2-6,11-12H,7-10,20H2,1H3 UEODAJCUTWAUHT-UHFFFAOYSA-N 50528743 CHEMBL4439615 Cholinesterase 11736 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528743 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528743&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155513893 440737325 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297223 Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1ccc2OCOc2c1 InChI=1S/C19H18N4O4/c20-13-2-4-15-14(10-13)21-19(27-15)23-7-5-22(6-8-23)18(24)12-1-3-16-17(9-12)26-11-25-16/h1-4,9-10H,5-8,11,20H2 YKGMAZAGUZSYLG-UHFFFAOYSA-N 50528750 CHEMBL4453853 Cholinesterase 1517 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528750 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528750&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155524165 440737332 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297224 Nc1ccc2oc(nc2c1)N1CCN(Cc2ccc(Cl)cc2)CC1 InChI=1S/C18H19ClN4O/c19-14-3-1-13(2-4-14)12-22-7-9-23(10-8-22)18-21-16-11-15(20)5-6-17(16)24-18/h1-6,11H,7-10,12,20H2 WQKQRQOPCMJJSB-UHFFFAOYSA-N 50528751 CHEMBL4476086 Cholinesterase 3852 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528751 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528751&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155538191 440737333 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297225 Cc1ccc(CN2CCN(CC2)c2nc3cc(N)ccc3o2)cc1 InChI=1S/C19H22N4O/c1-14-2-4-15(5-3-14)13-22-8-10-23(11-9-22)19-21-17-12-16(20)6-7-18(17)24-19/h2-7,12H,8-11,13,20H2,1H3 PGHDPQWRVZUOFI-UHFFFAOYSA-N 50528746 CHEMBL4566824 Cholinesterase 5186 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528746 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528746&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155543515 440737328 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297226 CC(C)c1ccc(CN2CCN(CC2)c2nc3cc(N)ccc3o2)cc1 InChI=1S/C21H26N4O/c1-15(2)17-5-3-16(4-6-17)14-24-9-11-25(12-10-24)21-23-19-13-18(22)7-8-20(19)26-21/h3-8,13,15H,9-12,14,22H2,1-2H3 XFVIEGMDZJQTNS-UHFFFAOYSA-N 50528752 CHEMBL4457720 Cholinesterase 11274 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528752 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528752&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155525514 440737334 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297227 Nc1ccc2oc(nc2c1)N1CCN(CCc2ccccc2)CC1 InChI=1S/C19H22N4O/c20-16-6-7-18-17(14-16)21-19(24-18)23-12-10-22(11-13-23)9-8-15-4-2-1-3-5-15/h1-7,14H,8-13,20H2 VJAGVFWJPAWBKZ-UHFFFAOYSA-N 50528725 CHEMBL4518306 Cholinesterase 957 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528725 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528725&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155541351 440737307 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297234 Nc1ccc2oc(nc2c1)N1CCCCC1 InChI=1S/C12H15N3O/c13-9-4-5-11-10(8-9)14-12(16-11)15-6-2-1-3-7-15/h4-5,8H,1-3,6-7,13H2 HUBLYOMFVGUXJJ-UHFFFAOYSA-N 50528753 CHEMBL4463270 Cholinesterase 24212 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528753 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528753&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 79884607 440737335 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297235 Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1ccc(Cl)cc1 InChI=1S/C18H17ClN4O2/c19-13-3-1-12(2-4-13)17(24)22-7-9-23(10-8-22)18-21-15-11-14(20)5-6-16(15)25-18/h1-6,11H,7-10,20H2 FOIIPCLEUFNPDK-UHFFFAOYSA-N 50528754 CHEMBL4522175 Cholinesterase 3317 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528754 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528754&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155542931 440737336 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297236 COc1ccccc1C(=O)N1CCN(CC1)c1nc2cc(N)ccc2o1 InChI=1S/C19H20N4O3/c1-25-16-5-3-2-4-14(16)18(24)22-8-10-23(11-9-22)19-21-15-12-13(20)6-7-17(15)26-19/h2-7,12H,8-11,20H2,1H3 LDRPVFAWHGHJGP-UHFFFAOYSA-N 50528742 CHEMBL4515408 Cholinesterase 7379 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528742 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528742&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155539846 440737324 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297237 Nc1ccc2oc(nc2c1)N1CCN(Cc2ccc(F)cc2)CC1 InChI=1S/C18H19FN4O/c19-14-3-1-13(2-4-14)12-22-7-9-23(10-8-22)18-21-16-11-15(20)5-6-17(16)24-18/h1-6,11H,7-10,12,20H2 CWYLPIOQQGOCHQ-UHFFFAOYSA-N 50528755 CHEMBL4557653 Cholinesterase 3112 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528755 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528755&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155554797 440737337 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297240 Nc1ccc2oc(nc2c1)N1CCN(CC1)c1ccccn1 InChI=1S/C16H17N5O/c17-12-4-5-14-13(11-12)19-16(22-14)21-9-7-20(8-10-21)15-3-1-2-6-18-15/h1-6,11H,7-10,17H2 JXSDMTJVZRVJHI-UHFFFAOYSA-N 50528736 CHEMBL4529285 Cholinesterase 15126 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528736 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528736&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155545177 440737318 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297241 COc1ccc(cc1)C(=O)N1CCN(CC1)c1nc2cc(N)ccc2o1 InChI=1S/C19H20N4O3/c1-25-15-5-2-13(3-6-15)18(24)22-8-10-23(11-9-22)19-21-16-12-14(20)4-7-17(16)26-19/h2-7,12H,8-11,20H2,1H3 HPOPEDIRONALSG-UHFFFAOYSA-N 50528729 CHEMBL4472865 Cholinesterase 7327 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528729 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528729&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155535929 440737311 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297242 Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1ccc(Br)cc1 InChI=1S/C18H17BrN4O2/c19-13-3-1-12(2-4-13)17(24)22-7-9-23(10-8-22)18-21-15-11-14(20)5-6-16(15)25-18/h1-6,11H,7-10,20H2 HJVNOHKPHOZTQU-UHFFFAOYSA-N 50528740 CHEMBL4536953 Cholinesterase 860 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528740 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528740&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155548299 440737322 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297251 Nc1ccc2oc(nc2c1)N1CCN(CC1)c1ccccc1 InChI=1S/C17H18N4O/c18-13-6-7-16-15(12-13)19-17(22-16)21-10-8-20(9-11-21)14-4-2-1-3-5-14/h1-7,12H,8-11,18H2 MIUYMEBXWLYKQI-UHFFFAOYSA-N 50528727 CHEMBL4437417 Cholinesterase 16763 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528727 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528727&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 39203409 440737309 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297252 Cc1ccc(cc1)N1CCN(CC1)c1nc2cc(N)ccc2o1 InChI=1S/C18H20N4O/c1-13-2-5-15(6-3-13)21-8-10-22(11-9-21)18-20-16-12-14(19)4-7-17(16)23-18/h2-7,12H,8-11,19H2,1H3 JLLLTJRYNNJMAK-UHFFFAOYSA-N 50528757 CHEMBL4450342 Cholinesterase 9012 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528757 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528757&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155521329 440737339 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297253 Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1ccccc1Cl InChI=1S/C18H17ClN4O2/c19-14-4-2-1-3-13(14)17(24)22-7-9-23(10-8-22)18-21-15-11-12(20)5-6-16(15)25-18/h1-6,11H,7-10,20H2 BDZFLCRXNSMYNA-UHFFFAOYSA-N 50528758 CHEMBL4574930 Cholinesterase 4856 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528758 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528758&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155560941 440737340 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297254 Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1ccc(Br)cc1 InChI=1S/C18H17BrN4O2/c19-13-3-1-12(2-4-13)17(24)22-7-9-23(10-8-22)18-21-15-11-14(20)5-6-16(15)25-18/h1-6,11H,7-10,20H2 HJVNOHKPHOZTQU-UHFFFAOYSA-N 50528740 CHEMBL4536953 Cholinesterase 1085 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528740 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528740&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155548299 440737322 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297255 COc1ccc(Cl)cc1C(=O)N1CCN(CC1)c1nc2cc(N)ccc2o1 InChI=1S/C19H19ClN4O3/c1-26-16-4-2-12(20)10-14(16)18(25)23-6-8-24(9-7-23)19-22-15-11-13(21)3-5-17(15)27-19/h2-5,10-11H,6-9,21H2,1H3 MVXPHXFZRRBPIE-UHFFFAOYSA-N 50528744 CHEMBL4569192 Cholinesterase 1365 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528744 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528744&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155560456 440737326 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297256 Nc1ccc2oc(nc2c1)N1CCN(Cc2ccc(Br)cc2)CC1 InChI=1S/C18H19BrN4O/c19-14-3-1-13(2-4-14)12-22-7-9-23(10-8-22)18-21-16-11-15(20)5-6-17(16)24-18/h1-6,11H,7-10,12,20H2 VZWUGIYWZYTICV-UHFFFAOYSA-N 50528745 CHEMBL4473288 Cholinesterase 2972 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528745 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528745&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155536426 440737327 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297257 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 941 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51297259 COc1ccc(cc1)N1CCN(CC1)c1nc2cc(N)ccc2o1 InChI=1S/C18H20N4O2/c1-23-15-5-3-14(4-6-15)21-8-10-22(11-9-21)18-20-16-12-13(19)2-7-17(16)24-18/h2-7,12H,8-11,19H2,1H3 RYAZBVUTEHCVEP-UHFFFAOYSA-N 50528735 CHEMBL4439886 Cholinesterase 12971 ChEMBL 10.1016/j.ejmech.2019.111613 10.7270/Q2GQ726C 31437780 Gutti, G; Kakarla, R; Kumar, D; Beohar, M; Ganeshpurkar, A; Kumar, A; Krishnamurthy, S; Singh, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528735 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528735&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155514206 440737317 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51288939 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OS(=O)(=O)NC(c1ccccc1)c1ccccc1 InChI=1S/C23H31NO3S/c1-17(2)21-15-14-18(3)16-22(21)27-28(25,26)24-23(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-13,17-18,21-24H,14-16H2,1-3H3/t18-,21+,22-/m1/s1 XFDISOWFDDDBCL-BVYCBKJFSA-N 50525468 CHEMBL4463022 Cholinesterase 246 ChEMBL 10.1016/j.ejmech.2019.06.052 10.7270/Q2B27ZQ2 31255926 Zaraei, SO; Abduelkarem, AR; Anbar, HS; Kobeissi, S; Mohammad, M; Ossama, A; El-Gamal, MI University of Sharjah http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50525468 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50525468&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155529422 440734050 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51333186 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 8.0 ChEMBL 10.1021/acs.jnatprod.9b00469 10.7270/Q27H1P4D 32150413 Klein-Júnior, LC; Cretton, S; Vander Heyden, Y; Gasper, AL; Nejad-Ebrahimi, S; Christen, P; Henriques, AT Universidade Federal do Rio Grande do Sul-UFRGS http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51334601 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 11682 2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::Rivastigmine.tartrate::US9586925, Rivastigmine Cholinesterase 1510 ChEMBL 10.1016/j.bmc.2019.115190 10.7270/Q2FX7F1F 31744779 Luo, W; Lv, JW; Wang, T; Zhang, ZY; Guo, HY; Song, ZY; Wang, CJ; Ma, J; Chen, YP Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=11682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=11682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46512204 DB00989 C11766 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51334602 COc1cc(nc2ccccc12)-c1ccc2OCOc2c1 InChI=1S/C17H13NO3/c1-19-16-9-14(18-13-5-3-2-4-12(13)16)11-6-7-15-17(8-11)21-10-20-15/h2-9H,10H2,1H3 QGCORDIPOBZNKC-UHFFFAOYSA-N 50540148 Graveolinine Cholinesterase 28200 ChEMBL 10.1016/j.bmc.2019.115190 10.7270/Q2FX7F1F 31744779 Luo, W; Lv, JW; Wang, T; Zhang, ZY; Guo, HY; Song, ZY; Wang, CJ; Ma, J; Chen, YP Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50540148 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50540148&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11044132 442141711 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51334603 C1CCN(C1)c1cc(nc2ccccc12)-c1ccccc1 InChI=1S/C19H18N2/c1-2-8-15(9-3-1)18-14-19(21-12-6-7-13-21)16-10-4-5-11-17(16)20-18/h1-5,8-11,14H,6-7,12-13H2 YTUIYBMAIYEAER-UHFFFAOYSA-N 50540149 CHEMBL4639799 Cholinesterase 430 ChEMBL 10.1016/j.bmc.2019.115190 10.7270/Q2FX7F1F 31744779 Luo, W; Lv, JW; Wang, T; Zhang, ZY; Guo, HY; Song, ZY; Wang, CJ; Ma, J; Chen, YP Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50540149 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50540149&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3438772 442141712 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51334604 C(CNc1cc(nc2ccccc12)-c1ccccc1)CN1CCOCC1 InChI=1S/C22H25N3O/c1-2-7-18(8-3-1)21-17-22(19-9-4-5-10-20(19)24-21)23-11-6-12-25-13-15-26-16-14-25/h1-5,7-10,17H,6,11-16H2,(H,23,24) UUCHZVXLNVRFIC-UHFFFAOYSA-N 50540150 CHEMBL3559961::US11220486, Compound I179 Cholinesterase 4440 ChEMBL 10.1016/j.bmc.2019.115190 10.7270/Q2FX7F1F 31744779 Luo, W; Lv, JW; Wang, T; Zhang, ZY; Guo, HY; Song, ZY; Wang, CJ; Ma, J; Chen, YP Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50540150 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50540150&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73050869 442141713 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51334605 C(CNc1cc(nc2ccccc12)-c1ccccc1)CN1CCCCC1 InChI=1S/C23H27N3/c1-3-10-19(11-4-1)22-18-23(20-12-5-6-13-21(20)25-22)24-14-9-17-26-15-7-2-8-16-26/h1,3-6,10-13,18H,2,7-9,14-17H2,(H,24,25) XCMUNUSWRUCQQS-UHFFFAOYSA-N 50540151 CHEMBL3580417 Cholinesterase 1190 ChEMBL 10.1016/j.bmc.2019.115190 10.7270/Q2FX7F1F 31744779 Luo, W; Lv, JW; Wang, T; Zhang, ZY; Guo, HY; Song, ZY; Wang, CJ; Ma, J; Chen, YP Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50540151 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50540151&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 73050879 442141714 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51334606 OCCCCCCNc1cc(nc2ccccc12)-c1ccccc1 InChI=1S/C21H24N2O/c24-15-9-2-1-8-14-22-21-16-20(17-10-4-3-5-11-17)23-19-13-7-6-12-18(19)21/h3-7,10-13,16,24H,1-2,8-9,14-15H2,(H,22,23) NPGJCZHVUHBUPA-UHFFFAOYSA-N 50540152 CHEMBL4638069 Cholinesterase 2960 ChEMBL 10.1016/j.bmc.2019.115190 10.7270/Q2FX7F1F 31744779 Luo, W; Lv, JW; Wang, T; Zhang, ZY; Guo, HY; Song, ZY; Wang, CJ; Ma, J; Chen, YP Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50540152 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50540152&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156011608 442141715 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51334607 OCCCCNc1cc(nc2ccccc12)-c1ccccc1 InChI=1S/C19H20N2O/c22-13-7-6-12-20-19-14-18(15-8-2-1-3-9-15)21-17-11-5-4-10-16(17)19/h1-5,8-11,14,22H,6-7,12-13H2,(H,20,21) KIDVGKQSENQBSJ-UHFFFAOYSA-N 50540153 CHEMBL4642989 Cholinesterase 4310 ChEMBL 10.1016/j.bmc.2019.115190 10.7270/Q2FX7F1F 31744779 Luo, W; Lv, JW; Wang, T; Zhang, ZY; Guo, HY; Song, ZY; Wang, CJ; Ma, J; Chen, YP Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50540153 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50540153&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 68607943 442141716 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51334608 OCCCNc1cc(nc2ccccc12)-c1ccccc1 InChI=1S/C18H18N2O/c21-12-6-11-19-18-13-17(14-7-2-1-3-8-14)20-16-10-5-4-9-15(16)18/h1-5,7-10,13,21H,6,11-12H2,(H,19,20) CUOAJTWWAXWPJS-UHFFFAOYSA-N 50540154 CHEMBL327412 Cholinesterase >10000 ChEMBL 10.1016/j.bmc.2019.115190 10.7270/Q2FX7F1F 31744779 Luo, W; Lv, JW; Wang, T; Zhang, ZY; Guo, HY; Song, ZY; Wang, CJ; Ma, J; Chen, YP Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50540154 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50540154&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44321831 442141717 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51334609 CCCCNc1cc(nc2ccccc12)-c1ccc2OCOc2c1 InChI=1S/C20H20N2O2/c1-2-3-10-21-18-12-17(22-16-7-5-4-6-15(16)18)14-8-9-19-20(11-14)24-13-23-19/h4-9,11-12H,2-3,10,13H2,1H3,(H,21,22) ITYCJIGIEDXSRM-UHFFFAOYSA-N 50540155 CHEMBL4634689 Cholinesterase 7850 ChEMBL 10.1016/j.bmc.2019.115190 10.7270/Q2FX7F1F 31744779 Luo, W; Lv, JW; Wang, T; Zhang, ZY; Guo, HY; Song, ZY; Wang, CJ; Ma, J; Chen, YP Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50540155 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50540155&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156013977 442141718 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51334610 C1Oc2ccc(cc2O1)-c1cc(N2CCCCC2)c2ccccc2n1 InChI=1S/C21H20N2O2/c1-4-10-23(11-5-1)19-13-18(22-17-7-3-2-6-16(17)19)15-8-9-20-21(12-15)25-14-24-20/h2-3,6-9,12-13H,1,4-5,10-11,14H2 ZIRWEISZRGNSNN-UHFFFAOYSA-N 50540156 CHEMBL4642522 Cholinesterase 2090 ChEMBL 10.1016/j.bmc.2019.115190 10.7270/Q2FX7F1F 31744779 Luo, W; Lv, JW; Wang, T; Zhang, ZY; Guo, HY; Song, ZY; Wang, CJ; Ma, J; Chen, YP Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50540156 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50540156&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156016942 442141719 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51334611 C1CCN(C1)c1cc(nc2ccccc12)-c1ccc2OCOc2c1 InChI=1S/C20H18N2O2/c1-2-6-16-15(5-1)18(22-9-3-4-10-22)12-17(21-16)14-7-8-19-20(11-14)24-13-23-19/h1-2,5-8,11-12H,3-4,9-10,13H2 BJQZRZYHRTZRQE-UHFFFAOYSA-N 50540157 CHEMBL4641481 Cholinesterase 160 ChEMBL 10.1016/j.bmc.2019.115190 10.7270/Q2FX7F1F 31744779 Luo, W; Lv, JW; Wang, T; Zhang, ZY; Guo, HY; Song, ZY; Wang, CJ; Ma, J; Chen, YP Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50540157 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50540157&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156017275 442141720 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51334612 C(CNc1cc(nc2ccccc12)-c1ccc2OCOc2c1)CN1CCOCC1 InChI=1S/C23H25N3O3/c1-2-5-19-18(4-1)21(24-8-3-9-26-10-12-27-13-11-26)15-20(25-19)17-6-7-22-23(14-17)29-16-28-22/h1-2,4-7,14-15H,3,8-13,16H2,(H,24,25) YWDYJVYTAREDEU-UHFFFAOYSA-N 50540158 CHEMBL4634509 Cholinesterase 8150 ChEMBL 10.1016/j.bmc.2019.115190 10.7270/Q2FX7F1F 31744779 Luo, W; Lv, JW; Wang, T; Zhang, ZY; Guo, HY; Song, ZY; Wang, CJ; Ma, J; Chen, YP Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50540158 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50540158&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156009765 442141721 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51334613 C(CNc1cc(nc2ccccc12)-c1ccc2OCOc2c1)CN1CCCCC1 InChI=1S/C24H27N3O2/c1-4-12-27(13-5-1)14-6-11-25-22-16-21(26-20-8-3-2-7-19(20)22)18-9-10-23-24(15-18)29-17-28-23/h2-3,7-10,15-16H,1,4-6,11-14,17H2,(H,25,26) PFEMKWMYFFJDAG-UHFFFAOYSA-N 50540159 CHEMBL4642757 Cholinesterase 1450 ChEMBL 10.1016/j.bmc.2019.115190 10.7270/Q2FX7F1F 31744779 Luo, W; Lv, JW; Wang, T; Zhang, ZY; Guo, HY; Song, ZY; Wang, CJ; Ma, J; Chen, YP Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50540159 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50540159&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156017139 442141722 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51334614 OCCCCCCNc1cc(nc2ccccc12)-c1ccc2OCOc2c1 InChI=1S/C22H24N2O3/c25-12-6-2-1-5-11-23-20-14-19(24-18-8-4-3-7-17(18)20)16-9-10-21-22(13-16)27-15-26-21/h3-4,7-10,13-14,25H,1-2,5-6,11-12,15H2,(H,23,24) MJXWPWYXCVTZGQ-UHFFFAOYSA-N 50540160 CHEMBL4646479 Cholinesterase 6490 ChEMBL 10.1016/j.bmc.2019.115190 10.7270/Q2FX7F1F 31744779 Luo, W; Lv, JW; Wang, T; Zhang, ZY; Guo, HY; Song, ZY; Wang, CJ; Ma, J; Chen, YP Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50540160 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50540160&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156019296 442141723 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51334615 OCCCCNc1cc(nc2ccccc12)-c1ccc2OCOc2c1 InChI=1S/C20H20N2O3/c23-10-4-3-9-21-18-12-17(22-16-6-2-1-5-15(16)18)14-7-8-19-20(11-14)25-13-24-19/h1-2,5-8,11-12,23H,3-4,9-10,13H2,(H,21,22) ZXKDYTQGEDZDCS-UHFFFAOYSA-N 50540161 CHEMBL4641208 Cholinesterase 9780 ChEMBL 10.1016/j.bmc.2019.115190 10.7270/Q2FX7F1F 31744779 Luo, W; Lv, JW; Wang, T; Zhang, ZY; Guo, HY; Song, ZY; Wang, CJ; Ma, J; Chen, YP Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50540161 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50540161&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156016833 442141724 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51334616 OCCCNc1cc(nc2ccccc12)-c1ccc2OCOc2c1 InChI=1S/C19H18N2O3/c22-9-3-8-20-17-11-16(21-15-5-2-1-4-14(15)17)13-6-7-18-19(10-13)24-12-23-18/h1-2,4-7,10-11,22H,3,8-9,12H2,(H,20,21) UEEVVMWPAYHEIR-UHFFFAOYSA-N 50540162 CHEMBL4634179 Cholinesterase >10000 ChEMBL 10.1016/j.bmc.2019.115190 10.7270/Q2FX7F1F 31744779 Luo, W; Lv, JW; Wang, T; Zhang, ZY; Guo, HY; Song, ZY; Wang, CJ; Ma, J; Chen, YP Henan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50540162 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50540162&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156009557 442141725 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332523 COc1ccc(cc1)C1CC(=O)Oc2cc(O)ccc12 InChI=1S/C16H14O4/c1-19-12-5-2-10(3-6-12)14-9-16(18)20-15-8-11(17)4-7-13(14)15/h2-8,14,17H,9H2,1H3 TVTWPOIVJDSMAX-UHFFFAOYSA-N 50539403 CHEMBL1701725 Cholinesterase >300000 ChEMBL 10.1016/j.bmcl.2019.126900 10.7270/Q2PR80JM 31882295 Yun, Y; Yang, J; Miao, Y; Wang, X; Sun, J University of Jinan-Shandong Academy of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50539403 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50539403&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 13842402 442140966 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332524 COc1cc(ccc1O)C1CC(=O)Oc2cc(O)ccc12 InChI=1S/C16H14O5/c1-20-15-6-9(2-5-13(15)18)12-8-16(19)21-14-7-10(17)3-4-11(12)14/h2-7,12,17-18H,8H2,1H3 KIMRZPTWCZEUBK-UHFFFAOYSA-N 50539404 CHEMBL4634554 Cholinesterase >300000 ChEMBL 10.1016/j.bmcl.2019.126900 10.7270/Q2PR80JM 31882295 Yun, Y; Yang, J; Miao, Y; Wang, X; Sun, J University of Jinan-Shandong Academy of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50539404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50539404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 78101649 442140967 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332525 COc1ccc(cc1OC)C1CC(=O)Oc2ccc(O)cc12 InChI=1S/C17H16O5/c1-20-15-5-3-10(7-16(15)21-2)12-9-17(19)22-14-6-4-11(18)8-13(12)14/h3-8,12,18H,9H2,1-2H3 KHSMGTGMAKODQR-UHFFFAOYSA-N 50539405 CHEMBL4639087 Cholinesterase >300000 ChEMBL 10.1016/j.bmcl.2019.126900 10.7270/Q2PR80JM 31882295 Yun, Y; Yang, J; Miao, Y; Wang, X; Sun, J University of Jinan-Shandong Academy of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50539405 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50539405&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 51347734 442140968 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332526 COc1ccc(cc1)C1CC(=O)Oc2c(O)c(O)ccc12 InChI=1S/C16H14O5/c1-20-10-4-2-9(3-5-10)12-8-14(18)21-16-11(12)6-7-13(17)15(16)19/h2-7,12,17,19H,8H2,1H3 BKFBPPFARHLQJX-UHFFFAOYSA-N 50539406 CHEMBL4646836 Cholinesterase 148655 ChEMBL 10.1016/j.bmcl.2019.126900 10.7270/Q2PR80JM 31882295 Yun, Y; Yang, J; Miao, Y; Wang, X; Sun, J University of Jinan-Shandong Academy of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50539406 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50539406&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12026495 442140969 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332527 COc1cc(ccc1O)C1CC(=O)Oc2c(O)c(O)ccc12 InChI=1S/C16H14O6/c1-21-13-6-8(2-4-11(13)17)10-7-14(19)22-16-9(10)3-5-12(18)15(16)20/h2-6,10,17-18,20H,7H2,1H3 WIMGVDLHIAPOJO-UHFFFAOYSA-N 50539407 CHEMBL4644936 Cholinesterase 134045 ChEMBL 10.1016/j.bmcl.2019.126900 10.7270/Q2PR80JM 31882295 Yun, Y; Yang, J; Miao, Y; Wang, X; Sun, J University of Jinan-Shandong Academy of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50539407 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50539407&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 132280908 442140970 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332528 Oc1ccc(cc1O)C1CC(=O)Oc2c(O)c(O)ccc12 InChI=1S/C15H12O6/c16-10-3-1-7(5-12(10)18)9-6-13(19)21-15-8(9)2-4-11(17)14(15)20/h1-5,9,16-18,20H,6H2 WTLOQAHFRCNVDH-UHFFFAOYSA-N 50539408 CHEMBL4641356 Cholinesterase 72533 ChEMBL 10.1016/j.bmcl.2019.126900 10.7270/Q2PR80JM 31882295 Yun, Y; Yang, J; Miao, Y; Wang, X; Sun, J University of Jinan-Shandong Academy of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50539408 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50539408&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156016259 442140971 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332529 COc1ccc(cc1)C1CC(=O)Oc2cc(O)cc(O)c12 InChI=1S/C16H14O5/c1-20-11-4-2-9(3-5-11)12-8-15(19)21-14-7-10(17)6-13(18)16(12)14/h2-7,12,17-18H,8H2,1H3 OKBWVJGQTFYYQA-UHFFFAOYSA-N 50539409 CHEMBL1462855 Cholinesterase >300000 ChEMBL 10.1016/j.bmcl.2019.126900 10.7270/Q2PR80JM 31882295 Yun, Y; Yang, J; Miao, Y; Wang, X; Sun, J University of Jinan-Shandong Academy of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50539409 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50539409&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11460348 442140972 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332530 COc1ccc(cc1OC)C1CC(=O)Oc2cc(O)cc(O)c12 InChI=1S/C17H16O6/c1-21-13-4-3-9(5-14(13)22-2)11-8-16(20)23-15-7-10(18)6-12(19)17(11)15/h3-7,11,18-19H,8H2,1-2H3 IJRIILUNNYWYSX-UHFFFAOYSA-N 50539410 CHEMBL4645630 Cholinesterase >300000 ChEMBL 10.1016/j.bmcl.2019.126900 10.7270/Q2PR80JM 31882295 Yun, Y; Yang, J; Miao, Y; Wang, X; Sun, J University of Jinan-Shandong Academy of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50539410 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50539410&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11267048 442140973 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332531 COc1cc(ccc1O)C1CC(=O)Oc2cc(O)cc(O)c12 InChI=1S/C16H14O6/c1-21-13-4-8(2-3-11(13)18)10-7-15(20)22-14-6-9(17)5-12(19)16(10)14/h2-6,10,17-19H,7H2,1H3 NLRZBGHGSUWXSH-UHFFFAOYSA-N 50539411 CHEMBL4633087 Cholinesterase >300000 ChEMBL 10.1016/j.bmcl.2019.126900 10.7270/Q2PR80JM 31882295 Yun, Y; Yang, J; Miao, Y; Wang, X; Sun, J University of Jinan-Shandong Academy of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50539411 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50539411&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 78101616 442140974 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332532 Oc1ccc(cc1)C1CC(=O)Oc2cc(O)cc(O)c12 InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)11-7-14(19)20-13-6-10(17)5-12(18)15(11)13/h1-6,11,16-18H,7H2 YFBYVGLTPVOMJI-UHFFFAOYSA-N 50539412 CHEMBL4645767 Cholinesterase >300000 ChEMBL 10.1016/j.bmcl.2019.126900 10.7270/Q2PR80JM 31882295 Yun, Y; Yang, J; Miao, Y; Wang, X; Sun, J University of Jinan-Shandong Academy of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50539412 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50539412&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 13803350 442140975 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332533 COc1ccc(cc1)C1CC(=O)Oc2c(O)cc(O)cc12 InChI=1S/C16H14O5/c1-20-11-4-2-9(3-5-11)12-8-15(19)21-16-13(12)6-10(17)7-14(16)18/h2-7,12,17-18H,8H2,1H3 WPDXGRAJEYQZGH-UHFFFAOYSA-N 50539413 CHEMBL4641957 Cholinesterase >300000 ChEMBL 10.1016/j.bmcl.2019.126900 10.7270/Q2PR80JM 31882295 Yun, Y; Yang, J; Miao, Y; Wang, X; Sun, J University of Jinan-Shandong Academy of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50539413 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50539413&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156016857 442140976 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332534 COc1ccc(cc1OC)C1CC(=O)Oc2c(O)cc(O)cc12 InChI=1S/C17H16O6/c1-21-14-4-3-9(5-15(14)22-2)11-8-16(20)23-17-12(11)6-10(18)7-13(17)19/h3-7,11,18-19H,8H2,1-2H3 WZZVRZDNNLLXFW-UHFFFAOYSA-N 50539414 CHEMBL4649316 Cholinesterase >300000 ChEMBL 10.1016/j.bmcl.2019.126900 10.7270/Q2PR80JM 31882295 Yun, Y; Yang, J; Miao, Y; Wang, X; Sun, J University of Jinan-Shandong Academy of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50539414 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50539414&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156021662 442140977 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332535 COc1ccc(cc1OC)-c1cc(=O)oc2c(O)c(O)ccc12 InChI=1S/C17H14O6/c1-21-13-6-3-9(7-14(13)22-2)11-8-15(19)23-17-10(11)4-5-12(18)16(17)20/h3-8,18,20H,1-2H3 UMKDYUUNPVMWJZ-UHFFFAOYSA-N 50539415 CHEMBL4638045 Cholinesterase >300000 ChEMBL 10.1016/j.bmcl.2019.126900 10.7270/Q2PR80JM 31882295 Yun, Y; Yang, J; Miao, Y; Wang, X; Sun, J University of Jinan-Shandong Academy of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50539415 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50539415&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 53233419 442140978 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332536 COc1cc(cc(OC)c1OC)-c1cc(=O)oc2c(O)c(O)ccc12 InChI=1S/C18H16O7/c1-22-13-6-9(7-14(23-2)18(13)24-3)11-8-15(20)25-17-10(11)4-5-12(19)16(17)21/h4-8,19,21H,1-3H3 AVJGHUOMLXVETQ-UHFFFAOYSA-N 50539416 CHEMBL4644520 Cholinesterase >300000 ChEMBL 10.1016/j.bmcl.2019.126900 10.7270/Q2PR80JM 31882295 Yun, Y; Yang, J; Miao, Y; Wang, X; Sun, J University of Jinan-Shandong Academy of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50539416 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50539416&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155676685 442140979 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332537 COc1ccc(cc1OC)-c1cc(=O)oc2cc(O)cc(O)c12 InChI=1S/C17H14O6/c1-21-13-4-3-9(5-14(13)22-2)11-8-16(20)23-15-7-10(18)6-12(19)17(11)15/h3-8,18-19H,1-2H3 VAUOBSBRAXZXPP-UHFFFAOYSA-N 50539417 CHEMBL4635225 Cholinesterase >300000 ChEMBL 10.1016/j.bmcl.2019.126900 10.7270/Q2PR80JM 31882295 Yun, Y; Yang, J; Miao, Y; Wang, X; Sun, J University of Jinan-Shandong Academy of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50539417 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50539417&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11289976 442140980 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332538 Oc1ccc2c(cc(=O)oc2c1)-c1ccc(O)c(O)c1 InChI=1S/C15H10O5/c16-9-2-3-10-11(7-15(19)20-14(10)6-9)8-1-4-12(17)13(18)5-8/h1-7,16-18H ALEFPQLBPWJUOQ-UHFFFAOYSA-N 50539418 CHEMBL4642621 Cholinesterase >300000 ChEMBL 10.1016/j.bmcl.2019.126900 10.7270/Q2PR80JM 31882295 Yun, Y; Yang, J; Miao, Y; Wang, X; Sun, J University of Jinan-Shandong Academy of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50539418 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50539418&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 129685938 442140981 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332539 Oc1ccc(cc1)-c1cc(=O)oc2c(O)c(O)ccc12 InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)11-7-13(18)20-15-10(11)5-6-12(17)14(15)19/h1-7,16-17,19H CFXQYAICOYLJJQ-UHFFFAOYSA-N 50539419 CHEMBL4647022 Cholinesterase >300000 ChEMBL 10.1016/j.bmcl.2019.126900 10.7270/Q2PR80JM 31882295 Yun, Y; Yang, J; Miao, Y; Wang, X; Sun, J University of Jinan-Shandong Academy of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50539419 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50539419&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 141463557 442140982 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332540 Oc1ccc(cc1O)-c1cc(=O)oc2c(O)c(O)ccc12 InChI=1S/C15H10O6/c16-10-3-1-7(5-12(10)18)9-6-13(19)21-15-8(9)2-4-11(17)14(15)20/h1-6,16-18,20H RZBBRKRHUMTJTC-UHFFFAOYSA-N 50539420 CHEMBL4646786 Cholinesterase 188414 ChEMBL 10.1016/j.bmcl.2019.126900 10.7270/Q2PR80JM 31882295 Yun, Y; Yang, J; Miao, Y; Wang, X; Sun, J University of Jinan-Shandong Academy of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50539420 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50539420&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 85706708 442140983 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332541 Oc1ccc2c(cc(=O)oc2c1O)-c1cc(O)c(O)c(O)c1 InChI=1S/C15H10O7/c16-9-2-1-7-8(5-12(19)22-15(7)14(9)21)6-3-10(17)13(20)11(18)4-6/h1-5,16-18,20-21H RMBPKVAAYUHIGZ-UHFFFAOYSA-N 50539421 CHEMBL4634355 Cholinesterase 106183 ChEMBL 10.1016/j.bmcl.2019.126900 10.7270/Q2PR80JM 31882295 Yun, Y; Yang, J; Miao, Y; Wang, X; Sun, J University of Jinan-Shandong Academy of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50539421 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50539421&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156010615 442140984 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332542 Oc1cc(O)c2oc(=O)cc(-c3ccc(O)c(O)c3)c2c1 InChI=1S/C15H10O6/c16-8-4-10-9(7-1-2-11(17)12(18)3-7)6-14(20)21-15(10)13(19)5-8/h1-6,16-19H JTMLVAWTQJIGBR-UHFFFAOYSA-N 50539422 CHEMBL4639627 Cholinesterase 207984 ChEMBL 10.1016/j.bmcl.2019.126900 10.7270/Q2PR80JM 31882295 Yun, Y; Yang, J; Miao, Y; Wang, X; Sun, J University of Jinan-Shandong Academy of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50539422 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50539422&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156013433 442140985 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332543 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 2600 ChEMBL 10.1016/j.bmcl.2019.126900 10.7270/Q2PR80JM 31882295 Yun, Y; Yang, J; Miao, Y; Wang, X; Sun, J University of Jinan-Shandong Academy of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332897 Oc1cc(OCCN2CCCC2)cc2oc3cc(OCCN4CCCC4)ccc3c(=O)c12 InChI=1S/C25H30N2O5/c28-21-15-19(31-14-12-27-9-3-4-10-27)17-23-24(21)25(29)20-6-5-18(16-22(20)32-23)30-13-11-26-7-1-2-8-26/h5-6,15-17,28H,1-4,7-14H2 MIYYUTVRKWENFL-UHFFFAOYSA-N 50539579 CHEMBL4644113 Cholinesterase 3699 ChEMBL 10.1016/j.bmcl.2019.126927 10.7270/Q2SJ1Q5K 31901382 Kou, X; Song, L; Wang, Y; Yu, Q; Ju, H; Yang, A; Shen, R Tianjin University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50539579 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50539579&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156017945 442141142 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332898 Oc1cc(OCCN2CCCCC2)cc2oc3cc(OCCN4CCCCC4)ccc3c(=O)c12 InChI=1S/C27H34N2O5/c30-23-17-21(33-16-14-29-11-5-2-6-12-29)19-25-26(23)27(31)22-8-7-20(18-24(22)34-25)32-15-13-28-9-3-1-4-10-28/h7-8,17-19,30H,1-6,9-16H2 NZGQUNIPKNIUQU-UHFFFAOYSA-N 50539580 CHEMBL4639828 Cholinesterase 4023 ChEMBL 10.1016/j.bmcl.2019.126927 10.7270/Q2SJ1Q5K 31901382 Kou, X; Song, L; Wang, Y; Yu, Q; Ju, H; Yang, A; Shen, R Tianjin University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50539580 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50539580&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156015661 442141143 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332899 CN(C)CCOc1ccc2c(c1)oc1cc(OCCN(C)C)cc(O)c1c2=O InChI=1S/C21H26N2O5/c1-22(2)7-9-26-14-5-6-16-18(12-14)28-19-13-15(27-10-8-23(3)4)11-17(24)20(19)21(16)25/h5-6,11-13,24H,7-10H2,1-4H3 KOVIIJFFRICWMK-UHFFFAOYSA-N 50539581 CHEMBL4635631 Cholinesterase 18007 ChEMBL 10.1016/j.bmcl.2019.126927 10.7270/Q2SJ1Q5K 31901382 Kou, X; Song, L; Wang, Y; Yu, Q; Ju, H; Yang, A; Shen, R Tianjin University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50539581 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50539581&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156013893 442141144 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332900 Oc1cc(OCCN2CCOCC2)cc2oc3cc(OCCN4CCOCC4)ccc3c(=O)c12 InChI=1S/C25H30N2O7/c28-21-15-19(33-14-8-27-5-11-31-12-6-27)17-23-24(21)25(29)20-2-1-18(16-22(20)34-23)32-13-7-26-3-9-30-10-4-26/h1-2,15-17,28H,3-14H2 RMFZLQQEDXNDBS-UHFFFAOYSA-N 50539582 CHEMBL4649489 Cholinesterase >300000 ChEMBL 10.1016/j.bmcl.2019.126927 10.7270/Q2SJ1Q5K 31901382 Kou, X; Song, L; Wang, Y; Yu, Q; Ju, H; Yang, A; Shen, R Tianjin University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50539582 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50539582&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156022153 442141145 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51332901 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 45 ChEMBL 10.1016/j.bmcl.2019.126927 10.7270/Q2SJ1Q5K 31901382 Kou, X; Song, L; Wang, Y; Yu, Q; Ju, H; Yang, A; Shen, R Tianjin University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51343460 CCOP(=O)(OCC)Oc1c(C(CC(C)=O)c2ccccc2)c(=O)oc2ccccc12 InChI=1S/C23H25O7P/c1-4-27-31(26,28-5-2)30-22-18-13-9-10-14-20(18)29-23(25)21(22)19(15-16(3)24)17-11-7-6-8-12-17/h6-14,19H,4-5,15H2,1-3H3 CFPGUTVYTVHWMP-UHFFFAOYSA-N 50543804 CHEMBL4635250 Cholinesterase 11200 ChEMBL 10.1016/j.bmcl.2020.127213 10.7270/Q2TX3JX7 32381396 Macklin, LJ; Schwans, JP California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50543804 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50543804&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156013946 442145367 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51343461 CCOP(=S)(OCC)Oc1c(C(CC(C)=O)c2ccccc2)c(=O)oc2ccccc12 InChI=1S/C23H25O6PS/c1-4-26-30(31,27-5-2)29-22-18-13-9-10-14-20(18)28-23(25)21(22)19(15-16(3)24)17-11-7-6-8-12-17/h6-14,19H,4-5,15H2,1-3H3 UAEGITXOKGJTNB-UHFFFAOYSA-N 50543805 CHEMBL4637678 Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2020.127213 10.7270/Q2TX3JX7 32381396 Macklin, LJ; Schwans, JP California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50543805 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50543805&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156012688 442145368 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51343462 CCCCOP(=O)(OCCCC)Oc1c(C(CC(C)=O)c2ccccc2)c(=O)oc2ccccc12 InChI=1S/C27H33O7P/c1-4-6-17-31-35(30,32-18-7-5-2)34-26-22-15-11-12-16-24(22)33-27(29)25(26)23(19-20(3)28)21-13-9-8-10-14-21/h8-16,23H,4-7,17-19H2,1-3H3 IHKTZCQBTFMFRZ-UHFFFAOYSA-N 50543806 CHEMBL4633026 Cholinesterase 1520 ChEMBL 10.1016/j.bmcl.2020.127213 10.7270/Q2TX3JX7 32381396 Macklin, LJ; Schwans, JP California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50543806 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50543806&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156010477 442145369 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51343463 Oc1ccc(Cc2cc3ccccc3oc2=O)cc1 InChI=1S/C16H12O3/c17-14-7-5-11(6-8-14)9-13-10-12-3-1-2-4-15(12)19-16(13)18/h1-8,10,17H,9H2 WYBZDBQRDQXQGF-UHFFFAOYSA-N 50543807 CHEMBL4646157 Cholinesterase 51200 ChEMBL 10.1016/j.bmcl.2020.127213 10.7270/Q2TX3JX7 32381396 Macklin, LJ; Schwans, JP California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50543807 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50543807&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10332430 442145370 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51343464 CCOP(=O)(OCC)Oc1ccc(Cc2cc3ccccc3oc2=O)cc1 InChI=1S/C20H21O6P/c1-3-23-27(22,24-4-2)26-18-11-9-15(10-12-18)13-17-14-16-7-5-6-8-19(16)25-20(17)21/h5-12,14H,3-4,13H2,1-2H3 ZRSLQVFUDQVRPU-UHFFFAOYSA-N 50543808 CHEMBL4636601 Cholinesterase 30200 ChEMBL 10.1016/j.bmcl.2020.127213 10.7270/Q2TX3JX7 32381396 Macklin, LJ; Schwans, JP California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50543808 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50543808&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156011241 442145371 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51343465 CCOP(=S)(OCC)Oc1ccc(Cc2cc3ccccc3oc2=O)cc1 InChI=1S/C20H21O5PS/c1-3-22-26(27,23-4-2)25-18-11-9-15(10-12-18)13-17-14-16-7-5-6-8-19(16)24-20(17)21/h5-12,14H,3-4,13H2,1-2H3 CZDGERYLMCSVEG-UHFFFAOYSA-N 50543809 CHEMBL4636875 Cholinesterase 53000 ChEMBL 10.1016/j.bmcl.2020.127213 10.7270/Q2TX3JX7 32381396 Macklin, LJ; Schwans, JP California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50543809 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50543809&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156011459 442145372 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51343466 Oc1cccc2oc(=O)c(Cc3ccccc3)cc12 InChI=1S/C16H12O3/c17-14-7-4-8-15-13(14)10-12(16(18)19-15)9-11-5-2-1-3-6-11/h1-8,10,17H,9H2 MVFFYIFEUZGLKA-UHFFFAOYSA-N 50434892 CHEMBL2387745 Cholinesterase >700000 ChEMBL 10.1016/j.bmcl.2020.127213 10.7270/Q2TX3JX7 32381396 Macklin, LJ; Schwans, JP California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50434892 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50434892&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71682638 175447209 CHEMBL2387745 ZINC96270892 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51343467 CCOP(=O)(OCC)Oc1cccc2oc(=O)c(Cc3ccccc3)cc12 InChI=1S/C20H21O6P/c1-3-23-27(22,24-4-2)26-19-12-8-11-18-17(19)14-16(20(21)25-18)13-15-9-6-5-7-10-15/h5-12,14H,3-4,13H2,1-2H3 DYLSYEPOJSVQRE-UHFFFAOYSA-N 50543810 CHEMBL4638278 Cholinesterase 363 ChEMBL 10.1016/j.bmcl.2020.127213 10.7270/Q2TX3JX7 32381396 Macklin, LJ; Schwans, JP California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50543810 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50543810&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156011814 442145373 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51343468 Oc1ccc(Cc2cc3c(O)cccc3oc2=O)cc1 InChI=1S/C16H12O4/c17-12-6-4-10(5-7-12)8-11-9-13-14(18)2-1-3-15(13)20-16(11)19/h1-7,9,17-18H,8H2 KZNMSFLFTUVDAL-UHFFFAOYSA-N 50543811 CHEMBL4646097 Cholinesterase 32000 ChEMBL 10.1016/j.bmcl.2020.127213 10.7270/Q2TX3JX7 32381396 Macklin, LJ; Schwans, JP California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50543811 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50543811&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156019893 442145374 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51343469 CCOP(=O)(OCC)Oc1cccc2ccccc12 InChI=1S/C14H17O4P/c1-3-16-19(15,17-4-2)18-14-11-7-9-12-8-5-6-10-13(12)14/h5-11H,3-4H2,1-2H3 GTLTVBNVOHZJHA-UHFFFAOYSA-N 50543812 CHEMBL4646822 Cholinesterase 54000 ChEMBL 10.1016/j.bmcl.2020.127213 10.7270/Q2TX3JX7 32381396 Macklin, LJ; Schwans, JP California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50543812 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50543812&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 97573 442145375 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51343470 CCS(=O)(=O)Oc1cccc2ccccc12 InChI=1S/C12H12O3S/c1-2-16(13,14)15-12-9-5-7-10-6-3-4-8-11(10)12/h3-9H,2H2,1H3 HWLRYEWWNVJBAZ-UHFFFAOYSA-N 50543813 CHEMBL4633322 Cholinesterase 71500 ChEMBL 10.1016/j.bmcl.2020.127213 10.7270/Q2TX3JX7 32381396 Macklin, LJ; Schwans, JP California State University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50543813 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50543813&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1722140 442145376 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51345643 COc1ccc(cc1OC)-c1cccc(c1)-n1cncc1C(=O)N1Cc2ccccc2C1 InChI=1S/C26H23N3O3/c1-31-24-11-10-19(13-25(24)32-2)18-8-5-9-22(12-18)29-17-27-14-23(29)26(30)28-15-20-6-3-4-7-21(20)16-28/h3-14,17H,15-16H2,1-2H3 XUEIFFFFFHLQBF-UHFFFAOYSA-N 50544538 CHEMBL4646860 Cholinesterase 17310 ChEMBL 10.1021/acs.jmedchem.0c01129 10.7270/Q2BP06C1 32787113 Li, Q; Xing, S; Chen, Y; Liao, Q; Xiong, B; He, S; Lu, W; Liu, Y; Yang, H; Li, Q; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50544538 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50544538&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46103074 442146101 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51345644 CC(C)CN(Cc1csc(COc2ccc(C)cc2)n1)C(=O)c1ccc2OCOc2c1 InChI=1S/C24H26N2O4S/c1-16(2)11-26(24(27)18-6-9-21-22(10-18)30-15-29-21)12-19-14-31-23(25-19)13-28-20-7-4-17(3)5-8-20/h4-10,14,16H,11-13,15H2,1-3H3 UAPCMRKWPQQSKI-UHFFFAOYSA-N 50544537 CHEMBL4642183 Cholinesterase 17690 ChEMBL 10.1021/acs.jmedchem.0c01129 10.7270/Q2BP06C1 32787113 Li, Q; Xing, S; Chen, Y; Liao, Q; Xiong, B; He, S; Lu, W; Liu, Y; Yang, H; Li, Q; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50544537 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50544537&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46009274 442146100 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51345646 Cc1ccc2cc(NC(=O)Cn3c(nc4ccccc34)-c3nonc3N)ccc2n1 InChI=1S/C21H17N7O2/c1-12-6-7-13-10-14(8-9-15(13)23-12)24-18(29)11-28-17-5-3-2-4-16(17)25-21(28)19-20(22)27-30-26-19/h2-10H,11H2,1H3,(H2,22,27)(H,24,29) LESZNGMDDFKRPH-UHFFFAOYSA-N 50544536 CHEMBL4638758 Cholinesterase 180 ChEMBL 10.1021/acs.jmedchem.0c01129 10.7270/Q2BP06C1 32787113 Li, Q; Xing, S; Chen, Y; Liao, Q; Xiong, B; He, S; Lu, W; Liu, Y; Yang, H; Li, Q; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50544536 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50544536&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1259483 442146099 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51345648 Cc1ccc2cc(NC(=O)Cn3c(nc4ccccc34)-c3nonc3N)ccc2n1 InChI=1S/C21H17N7O2/c1-12-6-7-13-10-14(8-9-15(13)23-12)24-18(29)11-28-17-5-3-2-4-16(17)25-21(28)19-20(22)27-30-26-19/h2-10H,11H2,1H3,(H2,22,27)(H,24,29) LESZNGMDDFKRPH-UHFFFAOYSA-N 50544536 CHEMBL4638758 Cholinesterase 232 ChEMBL 10.1021/acs.jmedchem.0c01129 10.7270/Q2BP06C1 32787113 Li, Q; Xing, S; Chen, Y; Liao, Q; Xiong, B; He, S; Lu, W; Liu, Y; Yang, H; Li, Q; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50544536 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50544536&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1259483 442146099 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51345649 CCCN(Cc1csc(COc2ccc(C)cc2)n1)C(=O)c1ccc2OCOc2c1 InChI=1S/C23H24N2O4S/c1-3-10-25(23(26)17-6-9-20-21(11-17)29-15-28-20)12-18-14-30-22(24-18)13-27-19-7-4-16(2)5-8-19/h4-9,11,14H,3,10,12-13,15H2,1-2H3 BXZWSYGJTYSMPC-UHFFFAOYSA-N 50544540 CHEMBL4642790 Cholinesterase 14270 ChEMBL 10.1021/acs.jmedchem.0c01129 10.7270/Q2BP06C1 32787113 Li, Q; Xing, S; Chen, Y; Liao, Q; Xiong, B; He, S; Lu, W; Liu, Y; Yang, H; Li, Q; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50544540 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50544540&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46009353 442146103 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51337544 CCN(C)C(=O)Oc1ccc2CC[C@@H](NCC#C)c2c1 InChI=1S/C16H20N2O2/c1-4-10-17-15-9-7-12-6-8-13(11-14(12)15)20-16(19)18(3)5-2/h1,6,8,11,15,17H,5,7,9-10H2,2-3H3/t15-/m1/s1 LHXOCOHMBFOVJS-OAHLLOKOSA-N 10750 (3R)-3-(prop-2-yn-1-ylamino)-2,3-dihydro-1H-inden-5-yl N-ethyl-N-methylcarbamate hydrochloride::Aminoindan deriv. (R)18b::Aminoindan deriv. (R)18b.HCl::N-propargylaminoindan (R)18b.HCl::R-CPAI Cholinesterase 1980 ChEMBL 10.1021/acs.jmedchem.9b01617 10.7270/Q2CN77FZ 32031378 Talele, TT St. John's University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10750 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10750&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 208907 46511332 ZINC27623417 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51337546 CN(CC#C)c1nc(NCCCCC2CCN(Cc3ccccc3)CC2)c(cc1C#N)C#N InChI=1S/C27H32N6/c1-3-15-32(2)27-25(20-29)18-24(19-28)26(31-27)30-14-8-7-9-22-12-16-33(17-13-22)21-23-10-5-4-6-11-23/h1,4-6,10-11,18,22H,7-9,12-17,21H2,2H3,(H,30,31) WCDDKWWOUYHUDU-UHFFFAOYSA-N 50541071 CHEMBL4528766 Cholinesterase 600 ChEMBL 10.1021/acs.jmedchem.9b01617 10.7270/Q2CN77FZ 32031378 Talele, TT St. John's University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50541071 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50541071&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155544923 442142634 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51346909 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 11682 2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::Rivastigmine.tartrate::US9586925, Rivastigmine Cholinesterase 785 ChEMBL 10.1016/j.bmc.2020.115324 10.7270/Q2VH5SDB 32008882 Wu, J; Pistolozzi, M; Liu, S; Tan, W Jinan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=11682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=11682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46512204 DB00989 C11766 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51346910 Cl.CN(C)C(=O)Oc1cccc(c1)C(O)CNC(C)(C)C InChI=1S/C15H24N2O3.ClH/c1-15(2,3)16-10-13(18)11-7-6-8-12(9-11)20-14(19)17(4)5;/h6-9,13,16,18H,10H2,1-5H3;1H ZXFNRTGUWOTYQM-UHFFFAOYSA-N 50544909 CHEMBL4639837 Cholinesterase 383 ChEMBL 10.1016/j.bmc.2020.115324 10.7270/Q2VH5SDB 32008882 Wu, J; Pistolozzi, M; Liu, S; Tan, W Jinan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50544909 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50544909&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156015668 442146472 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51346911 Cl.CCC(C)(C)NCC(O)c1cccc(OC(=O)N(C)C)c1 InChI=1S/C16H26N2O3.ClH/c1-6-16(2,3)17-11-14(19)12-8-7-9-13(10-12)21-15(20)18(4)5;/h7-10,14,17,19H,6,11H2,1-5H3;1H ZQQMJIWIROIAED-UHFFFAOYSA-N 50544910 CHEMBL4636669 Cholinesterase 180 ChEMBL 10.1016/j.bmc.2020.115324 10.7270/Q2VH5SDB 32008882 Wu, J; Pistolozzi, M; Liu, S; Tan, W Jinan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50544910 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50544910&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156012642 442146473 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51346912 Cl.CN(C)C(=O)Oc1cccc(c1)C(O)CNC1CCCCC1 InChI=1S/C17H26N2O3.ClH/c1-19(2)17(21)22-15-10-6-7-13(11-15)16(20)12-18-14-8-4-3-5-9-14;/h6-7,10-11,14,16,18,20H,3-5,8-9,12H2,1-2H3;1H DVPYPUDNYFLPHM-UHFFFAOYSA-N 50544911 CHEMBL4635686 Cholinesterase 8.0 ChEMBL 10.1016/j.bmc.2020.115324 10.7270/Q2VH5SDB 32008882 Wu, J; Pistolozzi, M; Liu, S; Tan, W Jinan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50544911 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50544911&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156014495 442146474 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51346913 Cl.CN(C)C(=O)Oc1cccc(c1)C(O)CNC1CCCC1 InChI=1S/C16H24N2O3.ClH/c1-18(2)16(20)21-14-9-5-6-12(10-14)15(19)11-17-13-7-3-4-8-13;/h5-6,9-10,13,15,17,19H,3-4,7-8,11H2,1-2H3;1H YQTSVUUKORJTMR-UHFFFAOYSA-N 50544912 CHEMBL4637581 Cholinesterase 57 ChEMBL 10.1016/j.bmc.2020.115324 10.7270/Q2VH5SDB 32008882 Wu, J; Pistolozzi, M; Liu, S; Tan, W Jinan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50544912 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50544912&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156011691 442146475 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51346914 Cl.CN(C)C(=O)Oc1cccc(c1)C(O)CNc1ccccc1 InChI=1S/C17H20N2O3.ClH/c1-19(2)17(21)22-15-10-6-7-13(11-15)16(20)12-18-14-8-4-3-5-9-14;/h3-11,16,18,20H,12H2,1-2H3;1H YQGLZBOMEWLMMW-UHFFFAOYSA-N 50544913 CHEMBL4647501 Cholinesterase 282 ChEMBL 10.1016/j.bmc.2020.115324 10.7270/Q2VH5SDB 32008882 Wu, J; Pistolozzi, M; Liu, S; Tan, W Jinan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50544913 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50544913&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156019983 442146476 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51346915 Cl.CN(C)C(=O)Oc1cccc(c1)C(O)CNc1ccc(F)cc1 InChI=1S/C17H19FN2O3.ClH/c1-20(2)17(22)23-15-5-3-4-12(10-15)16(21)11-19-14-8-6-13(18)7-9-14;/h3-10,16,19,21H,11H2,1-2H3;1H NLRKSQCSXRPSQY-UHFFFAOYSA-N 50544914 CHEMBL4641695 Cholinesterase 194 ChEMBL 10.1016/j.bmc.2020.115324 10.7270/Q2VH5SDB 32008882 Wu, J; Pistolozzi, M; Liu, S; Tan, W Jinan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50544914 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50544914&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156016440 442146477 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51348070 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 110 ChEMBL 10.1016/j.bmcl.2020.127075 10.7270/Q22V2KQ2 32165042 Joubert, J; Kapp, E University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51348071 COc1cc(ccc1OS(=O)(=O)c1ccc(C)cc1)C1C2=C(CCCC2=O)NC2=C1C(=O)CCC2 InChI=1S/C27H27NO6S/c1-16-9-12-18(13-10-16)35(31,32)34-23-14-11-17(15-24(23)33-2)25-26-19(5-3-7-21(26)29)28-20-6-4-8-22(30)27(20)25/h9-15,25,28H,3-8H2,1-2H3 BBRXKEVIJRFXNT-UHFFFAOYSA-N 50545323 CHEMBL4649753 Cholinesterase 959 ChEMBL 10.1016/j.bmcl.2020.127075 10.7270/Q22V2KQ2 32165042 Joubert, J; Kapp, E University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50545323 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50545323&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 2921250 442111134 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51348072 CN1C2=C(C(C3=C1CCCC3=O)c1ccc(OCc3ccc(Cl)cc3)c(Cl)c1)C(=O)CCC2 InChI=1S/C27H25Cl2NO3/c1-30-20-4-2-6-22(31)26(20)25(27-21(30)5-3-7-23(27)32)17-10-13-24(19(29)14-17)33-15-16-8-11-18(28)12-9-16/h8-14,25H,2-7,15H2,1H3 VVPQPGOKTGNGKM-UHFFFAOYSA-N 50545324 CHEMBL4639610 Cholinesterase 1658 ChEMBL 10.1016/j.bmcl.2020.127075 10.7270/Q22V2KQ2 32165042 Joubert, J; Kapp, E University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50545324 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50545324&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1326347 442111135 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51348073 Fc1cccc(COc2ccc(cc2Br)C2C3=C(CCCC3=O)NC3=C2C(=O)CCC3)c1 InChI=1S/C26H23BrFNO3/c27-18-13-16(10-11-23(18)32-14-15-4-1-5-17(28)12-15)24-25-19(6-2-8-21(25)30)29-20-7-3-9-22(31)26(20)24/h1,4-5,10-13,24,29H,2-3,6-9,14H2 LBGBZNIPLODINR-UHFFFAOYSA-N 50545325 CHEMBL4173961 Cholinesterase 388 ChEMBL 10.1016/j.bmcl.2020.127075 10.7270/Q22V2KQ2 32165042 Joubert, J; Kapp, E University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50545325 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50545325&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1232088 442111136 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51348074 Brc1cc(ccc1OCc1ccccc1)C1C2=C(CCCC2=O)NC2=C1C(=O)CCC2 InChI=1S/C26H24BrNO3/c27-18-14-17(12-13-23(18)31-15-16-6-2-1-3-7-16)24-25-19(8-4-10-21(25)29)28-20-9-5-11-22(30)26(20)24/h1-3,6-7,12-14,24,28H,4-5,8-11,15H2 UNYVNPMWKFYNBK-UHFFFAOYSA-N 50545326 CHEMBL4648589 Cholinesterase 633 ChEMBL 10.1016/j.bmcl.2020.127075 10.7270/Q22V2KQ2 32165042 Joubert, J; Kapp, E University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50545326 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50545326&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 2921293 442111137 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51348075 COc1cc(ccc1OCc1ccc(F)cc1)C1C2=C(CCCC2=O)N(C)C2=C1C(=O)CCC2 InChI=1S/C28H28FNO4/c1-30-20-5-3-7-22(31)27(20)26(28-21(30)6-4-8-23(28)32)18-11-14-24(25(15-18)33-2)34-16-17-9-12-19(29)13-10-17/h9-15,26H,3-8,16H2,1-2H3 AKOISQVLWMHDAZ-UHFFFAOYSA-N 50545327 CHEMBL4632494 Cholinesterase 2440 ChEMBL 10.1016/j.bmcl.2020.127075 10.7270/Q22V2KQ2 32165042 Joubert, J; Kapp, E University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50545327 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50545327&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1327505 442111138 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51348076 COc1cc(ccc1OCc1ccc(F)cc1)C1C2=C(CCCC2=O)NC2=C1C(=O)CCC2 InChI=1S/C27H26FNO4/c1-32-24-14-17(10-13-23(24)33-15-16-8-11-18(28)12-9-16)25-26-19(4-2-6-21(26)30)29-20-5-3-7-22(31)27(20)25/h8-14,25,29H,2-7,15H2,1H3 VXFZTYCXOSXQLQ-UHFFFAOYSA-N 50545328 CHEMBL4640608 Cholinesterase 242 ChEMBL 10.1016/j.bmcl.2020.127075 10.7270/Q22V2KQ2 32165042 Joubert, J; Kapp, E University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50545328 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50545328&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1081255 442111139 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51348077 CCOc1cc(ccc1OCc1ccccc1)C1C2=C(CCCC2=O)NC2=C1C(=O)CCC2 InChI=1S/C28H29NO4/c1-2-32-25-16-19(14-15-24(25)33-17-18-8-4-3-5-9-18)26-27-20(10-6-12-22(27)30)29-21-11-7-13-23(31)28(21)26/h3-5,8-9,14-16,26,29H,2,6-7,10-13,17H2,1H3 WBYPPWIYOVLUKO-UHFFFAOYSA-N 50545329 CHEMBL4636114 Cholinesterase 752 ChEMBL 10.1016/j.bmcl.2020.127075 10.7270/Q22V2KQ2 32165042 Joubert, J; Kapp, E University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50545329 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50545329&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1022997 442111140 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51346916 Cl.CN(C)C(=O)Oc1cccc(c1)C(O)CNc1ccc(I)cc1 InChI=1S/C17H19IN2O3.ClH/c1-20(2)17(22)23-15-5-3-4-12(10-15)16(21)11-19-14-8-6-13(18)7-9-14;/h3-10,16,19,21H,11H2,1-2H3;1H LDJYYHAIOOOJBV-UHFFFAOYSA-N 50544915 CHEMBL4649567 Cholinesterase 381 ChEMBL 10.1016/j.bmc.2020.115324 10.7270/Q2VH5SDB 32008882 Wu, J; Pistolozzi, M; Liu, S; Tan, W Jinan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50544915 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50544915&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156022001 442146478 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51346917 Cl.CN(C)C(=O)Oc1cccc(c1)C(O)CNc1cccc(c1)C#C InChI=1S/C19H20N2O3.ClH/c1-4-14-7-5-9-16(11-14)20-13-18(22)15-8-6-10-17(12-15)24-19(23)21(2)3;/h1,5-12,18,20,22H,13H2,2-3H3;1H FYFTWWWMIYITQE-UHFFFAOYSA-N 50544916 CHEMBL4649182 Cholinesterase 154 ChEMBL 10.1016/j.bmc.2020.115324 10.7270/Q2VH5SDB 32008882 Wu, J; Pistolozzi, M; Liu, S; Tan, W Jinan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50544916 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50544916&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156020085 442146479 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51346918 Cl.CN(C)C(=O)Oc1cccc(c1)C(O)CN1CCCCC1 InChI=1S/C16H24N2O3.ClH/c1-17(2)16(20)21-14-8-6-7-13(11-14)15(19)12-18-9-4-3-5-10-18;/h6-8,11,15,19H,3-5,9-10,12H2,1-2H3;1H UEGCLZKIEVRDPN-UHFFFAOYSA-N 50544917 CHEMBL4643291 Cholinesterase 97 ChEMBL 10.1016/j.bmc.2020.115324 10.7270/Q2VH5SDB 32008882 Wu, J; Pistolozzi, M; Liu, S; Tan, W Jinan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50544917 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50544917&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156017771 442146480 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51346919 Cl.CN(C)C(=O)Oc1cccc(c1)C(O)CN1CCCC1 InChI=1S/C15H22N2O3.ClH/c1-16(2)15(19)20-13-7-5-6-12(10-13)14(18)11-17-8-3-4-9-17;/h5-7,10,14,18H,3-4,8-9,11H2,1-2H3;1H GUHOEXUSMYPGHR-UHFFFAOYSA-N 50544918 CHEMBL4636101 Cholinesterase 179 ChEMBL 10.1016/j.bmc.2020.115324 10.7270/Q2VH5SDB 32008882 Wu, J; Pistolozzi, M; Liu, S; Tan, W Jinan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50544918 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50544918&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156014591 442146481 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51346920 Cl.CN(C)C(=O)Oc1cccc(c1)C(O)CN1CCOCC1 InChI=1S/C15H22N2O4.ClH/c1-16(2)15(19)21-13-5-3-4-12(10-13)14(18)11-17-6-8-20-9-7-17;/h3-5,10,14,18H,6-9,11H2,1-2H3;1H UXWZQYAMEXOHMD-UHFFFAOYSA-N 50544919 CHEMBL4644935 Cholinesterase 2190 ChEMBL 10.1016/j.bmc.2020.115324 10.7270/Q2VH5SDB 32008882 Wu, J; Pistolozzi, M; Liu, S; Tan, W Jinan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50544919 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50544919&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156017975 442146482 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51346921 Cl.CN(C)C(=O)Oc1cccc(c1)C(O)CNC(C)(C)c1ccccc1 InChI=1S/C20H26N2O3.ClH/c1-20(2,16-10-6-5-7-11-16)21-14-18(23)15-9-8-12-17(13-15)25-19(24)22(3)4;/h5-13,18,21,23H,14H2,1-4H3;1H CVGVEFHYHBBASN-UHFFFAOYSA-N 50544920 CHEMBL4636418 Cholinesterase 303 ChEMBL 10.1016/j.bmc.2020.115324 10.7270/Q2VH5SDB 32008882 Wu, J; Pistolozzi, M; Liu, S; Tan, W Jinan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50544920 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50544920&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156012636 442146483 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51346922 Cl.CN(C)C(=O)Oc1ccc(cc1)C(O)CNC(C)(C)C InChI=1S/C15H24N2O3.ClH/c1-15(2,3)16-10-13(18)11-6-8-12(9-7-11)20-14(19)17(4)5;/h6-9,13,16,18H,10H2,1-5H3;1H VYBHMNJMPQBEKX-UHFFFAOYSA-N 50544921 CHEMBL4646421 Cholinesterase 5370 ChEMBL 10.1016/j.bmc.2020.115324 10.7270/Q2VH5SDB 32008882 Wu, J; Pistolozzi, M; Liu, S; Tan, W Jinan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50544921 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50544921&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156019735 442146484 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51346923 Cl.CCC(C)(C)NCC(O)c1ccc(OC(=O)N(C)C)cc1 InChI=1S/C16H26N2O3.ClH/c1-6-16(2,3)17-11-14(19)12-7-9-13(10-8-12)21-15(20)18(4)5;/h7-10,14,17,19H,6,11H2,1-5H3;1H PGVSZUOHULXSFX-UHFFFAOYSA-N 50544922 CHEMBL4645441 Cholinesterase 1570 ChEMBL 10.1016/j.bmc.2020.115324 10.7270/Q2VH5SDB 32008882 Wu, J; Pistolozzi, M; Liu, S; Tan, W Jinan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50544922 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50544922&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156009446 442146485 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51346924 Cl.CN(C)C(=O)Oc1ccc(cc1)C(O)CN1CCCCC1 InChI=1S/C16H24N2O3.ClH/c1-17(2)16(20)21-14-8-6-13(7-9-14)15(19)12-18-10-4-3-5-11-18;/h6-9,15,19H,3-5,10-12H2,1-2H3;1H JIKNPIOQBNGBIM-UHFFFAOYSA-N 50544923 CHEMBL4635200 Cholinesterase 245 ChEMBL 10.1016/j.bmc.2020.115324 10.7270/Q2VH5SDB 32008882 Wu, J; Pistolozzi, M; Liu, S; Tan, W Jinan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50544923 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50544923&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156014468 442146486 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51346925 Cl.CN(C)C(=O)Oc1ccc(cc1)C(O)CNC1CCCCC1 InChI=1S/C17H26N2O3.ClH/c1-19(2)17(21)22-15-10-8-13(9-11-15)16(20)12-18-14-6-4-3-5-7-14;/h8-11,14,16,18,20H,3-7,12H2,1-2H3;1H WOLBEDFXKGMGDS-UHFFFAOYSA-N 50544924 CHEMBL4645476 Cholinesterase 27 ChEMBL 10.1016/j.bmc.2020.115324 10.7270/Q2VH5SDB 32008882 Wu, J; Pistolozzi, M; Liu, S; Tan, W Jinan University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50544924 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50544924&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156019178 442146487 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51348078 O=C1CCCC2=C1C(C1=C(CCCC1=O)N2)c1ccc(OCc2ccccc2)cc1 InChI=1S/C26H25NO3/c28-22-10-4-8-20-25(22)24(26-21(27-20)9-5-11-23(26)29)18-12-14-19(15-13-18)30-16-17-6-2-1-3-7-17/h1-3,6-7,12-15,24,27H,4-5,8-11,16H2 HKYPXOMYYLFODP-UHFFFAOYSA-N 50545330 CHEMBL4647527 Cholinesterase 6010 ChEMBL 10.1016/j.bmcl.2020.127075 10.7270/Q22V2KQ2 32165042 Joubert, J; Kapp, E University of the Western Cape http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50545330 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50545330&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3569420 442111141 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51336830 C#CCNc1c2CCCCc2nc2ccccc12 InChI=1S/C16H16N2/c1-2-11-17-16-12-7-3-5-9-14(12)18-15-10-6-4-8-13(15)16/h1,3,5,7,9H,4,6,8,10-11H2,(H,17,18) IPSUZAWLWZPFLA-UHFFFAOYSA-N 50541051 CHEMBL4633540 Cholinesterase 78 ChEMBL 10.1016/j.bmcl.2019.126880 10.7270/Q2639T8F 31864798 do Carmo Carreiras, M; Ismaili, L; Marco-Contelles, J Universidade de Lisboa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50541051 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50541051&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 101166035 442142614 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51336833 Clc1ccc2c(NCC#C)c3CCCCc3nc2c1 InChI=1S/C16H15ClN2/c1-2-9-18-16-12-5-3-4-6-14(12)19-15-10-11(17)7-8-13(15)16/h1,7-8,10H,3-6,9H2,(H,18,19) YRJBUPQHBMBODA-UHFFFAOYSA-N 50541052 CHEMBL4632951 Cholinesterase 84 ChEMBL 10.1016/j.bmcl.2019.126880 10.7270/Q2639T8F 31864798 do Carmo Carreiras, M; Ismaili, L; Marco-Contelles, J Universidade de Lisboa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50541052 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50541052&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156010578 442142615 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51336836 Clc1ccc2c(N(CC#C)CC#C)c3CCCCc3nc2c1 InChI=1S/C19H17ClN2/c1-3-11-22(12-4-2)19-15-7-5-6-8-17(15)21-18-13-14(20)9-10-16(18)19/h1-2,9-10,13H,5-8,11-12H2 QBCUMVLXCNHZSS-UHFFFAOYSA-N 50541053 CHEMBL4642125 Cholinesterase 5375 ChEMBL 10.1016/j.bmcl.2019.126880 10.7270/Q2639T8F 31864798 do Carmo Carreiras, M; Ismaili, L; Marco-Contelles, J Universidade de Lisboa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50541053 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50541053&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156016577 442142616 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51336839 C#CCN(CCNc1c2CCCCc2nc2ccccc12)CC#C InChI=1S/C21H23N3/c1-3-14-24(15-4-2)16-13-22-21-17-9-5-7-11-19(17)23-20-12-8-6-10-18(20)21/h1-2,5,7,9,11H,6,8,10,12-16H2,(H,22,23) UNBIBGYWDSLDCL-UHFFFAOYSA-N 50541055 CHEMBL4647462 Cholinesterase 353 ChEMBL 10.1016/j.bmcl.2019.126880 10.7270/Q2639T8F 31864798 do Carmo Carreiras, M; Ismaili, L; Marco-Contelles, J Universidade de Lisboa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50541055 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50541055&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156021577 442142618 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51336866 CN(CC#C)c1nc(NCCCCC2CCN(Cc3ccccc3)CC2)c(cc1C#N)C#N InChI=1S/C27H32N6/c1-3-15-32(2)27-25(20-29)18-24(19-28)26(31-27)30-14-8-7-9-22-12-16-33(17-13-22)21-23-10-5-4-6-11-23/h1,4-6,10-11,18,22H,7-9,12-17,21H2,2H3,(H,30,31) WCDDKWWOUYHUDU-UHFFFAOYSA-N 50541071 CHEMBL4528766 Cholinesterase 600 ChEMBL 10.1016/j.bmcl.2019.126880 10.7270/Q2639T8F 31864798 do Carmo Carreiras, M; Ismaili, L; Marco-Contelles, J Universidade de Lisboa http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50541071 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50541071&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155544923 442142634 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51338051 C[C@@H]([C@H]1[C@H](O)C[C@@]2(C)[C@@H]3CC[C@@H]4[C@]5(C[C@@]35CC[C@]12C)C=CC(=O)C4(C)C)N(C)C InChI=1S/C26H41NO2/c1-16(27(6)7)21-17(28)14-24(5)19-9-8-18-22(2,3)20(29)10-11-25(18)15-26(19,25)13-12-23(21,24)4/h10-11,16-19,21,28H,8-9,12-15H2,1-7H3/t16-,17+,18-,19-,21-,23+,24-,25+,26-/m0/s1 NZZQZWQHKWTQRO-QPJKTJHZSA-N 50541569 CHEMBL4638699 Cholinesterase 1100 ChEMBL 10.1021/acs.jnatprod.9b00561 10.7270/Q2XG9VQ0 32309949 Maříková, J; Ritomská, A; Korábečný, J; Peřinová, R; Al Mamun, A; Kučera, T; Kohelová, E; Hulcová, D; Kobrlová, T; Kuneš, J; Nováková, L; Cahlíková, L University of Defence http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50541569 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50541569&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 101904933 442143132 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51338052 C[C@@H]([C@H]1CC[C@@]2(C)[C@@H]3CC[C@@H]4C(C=C[C@H](NC(=O)c5ccccc5)C4(C)C)=CC3=CC[C@]12C)N(C)C InChI=1S/C33H46N2O/c1-22(35(6)7)26-18-20-33(5)28-15-14-27-24(21-25(28)17-19-32(26,33)4)13-16-29(31(27,2)3)34-30(36)23-11-9-8-10-12-23/h8-13,16-17,21-22,26-29H,14-15,18-20H2,1-7H3,(H,34,36)/t22-,26+,27+,28+,29-,32+,33-/m0/s1 ACYRLFNCLPYZIA-DVSQZFJSSA-N 50541570 CHEMBL4638459 Cholinesterase 1700 ChEMBL 10.1021/acs.jnatprod.9b00561 10.7270/Q2XG9VQ0 32309949 Maříková, J; Ritomská, A; Korábečný, J; Peřinová, R; Al Mamun, A; Kučera, T; Kohelová, E; Hulcová, D; Kobrlová, T; Kuneš, J; Nováková, L; Cahlíková, L University of Defence http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50541570 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50541570&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156011727 442143133 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51384527 Clc1ccc(C(Cn2ccnc2)OCc2csc3c(Cl)cccc23)c(Cl)c1 InChI=1S/C20H15Cl3N2OS/c21-14-4-5-16(18(23)8-14)19(9-25-7-6-24-12-25)26-10-13-11-27-20-15(13)2-1-3-17(20)22/h1-8,11-12,19H,9-10H2 JLGKQTAYUIMGRK-UHFFFAOYSA-N 50051842 CHEBI:83682::Demofix::Ertaczo::Sertaconazole Cholinesterase 7400 ChEMBL 10.1016/j.bmcl.2020.127756 10.7270/Q2CF9TS5 33359445 Zhou, Y; Lu, X; Du, C; Liu, Y; Wang, Y; Hong, KH; Chen, Y; Sun, H Southwest University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051842 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051842&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 65863 313069476 DB01153 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51384528 Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)c(Cl)c1 InChI=1S/C18H14Cl4N2O/c19-13-2-1-12(16(21)7-13)10-25-18(9-24-6-5-23-11-24)15-4-3-14(20)8-17(15)22/h1-8,11,18H,9-10H2 BYBLEWFAAKGYCD-UHFFFAOYSA-N 31772 1-[2-(2,4-dichlorobenzyl)oxy-2-(2,4-dichlorophenyl)ethyl]imidazole;nitric acid::Brentan::CHEMBL91::Dactarin::Miconazole::US9138393, Miconazole Nitrate::US9144538, Miconazole Nitrate::cid_4189 Cholinesterase 4300 ChEMBL 10.1016/j.bmcl.2020.127756 10.7270/Q2CF9TS5 33359445 Zhou, Y; Lu, X; Du, C; Liu, Y; Wang, Y; Hong, KH; Chen, Y; Sun, H Southwest University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=31772 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=31772&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search X89 3OZU 4189 85240398 6923 CHEMBL91 DB01110 2449 C08070 ZINC00896740 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51384529 Brc1cccc(c1)C(Cn1ccnc1)OCc1nc2ccccc2s1 InChI=1S/C19H16BrN3OS/c20-15-5-3-4-14(10-15)17(11-23-9-8-21-13-23)24-12-19-22-16-6-1-2-7-18(16)25-19/h1-10,13,17H,11-12H2 VIKITUOGPNUKFY-UHFFFAOYSA-N 50559349 CHEMBL4792640 Cholinesterase 15100 ChEMBL 10.1016/j.bmcl.2020.127756 10.7270/Q2CF9TS5 33359445 Zhou, Y; Lu, X; Du, C; Liu, Y; Wang, Y; Hong, KH; Chen, Y; Sun, H Southwest University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50559349 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50559349&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156700969 461829741 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51384530 Brc1ccc(cc1)C(Cn1ccnc1)OCc1nc2ccccc2s1 InChI=1S/C19H16BrN3OS/c20-15-7-5-14(6-8-15)17(11-23-10-9-21-13-23)24-12-19-22-16-3-1-2-4-18(16)25-19/h1-10,13,17H,11-12H2 KEYWUAMILBORIV-UHFFFAOYSA-N 50559350 CHEMBL4741786 Cholinesterase 10000 ChEMBL 10.1016/j.bmcl.2020.127756 10.7270/Q2CF9TS5 33359445 Zhou, Y; Lu, X; Du, C; Liu, Y; Wang, Y; Hong, KH; Chen, Y; Sun, H Southwest University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50559350 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50559350&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156700973 461829742 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51384531 Fc1cc(ccc1Cl)C(Cn1ccnc1)OCc1nc2ccccc2s1 InChI=1S/C19H15ClFN3OS/c20-14-6-5-13(9-15(14)21)17(10-24-8-7-22-12-24)25-11-19-23-16-3-1-2-4-18(16)26-19/h1-9,12,17H,10-11H2 VZIIGDQFNOKUFT-UHFFFAOYSA-N 50559351 CHEMBL4759974 Cholinesterase 6200 ChEMBL 10.1016/j.bmcl.2020.127756 10.7270/Q2CF9TS5 33359445 Zhou, Y; Lu, X; Du, C; Liu, Y; Wang, Y; Hong, KH; Chen, Y; Sun, H Southwest University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50559351 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50559351&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156700975 461829743 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51384532 Clc1ccc(cc1Cl)C(Cn1ccnc1)OCc1nc2ccccc2s1 InChI=1S/C19H15Cl2N3OS/c20-14-6-5-13(9-15(14)21)17(10-24-8-7-22-12-24)25-11-19-23-16-3-1-2-4-18(16)26-19/h1-9,12,17H,10-11H2 FRKPTZYGLIKONH-UHFFFAOYSA-N 50559352 CHEMBL4785129 Cholinesterase 1000 ChEMBL 10.1016/j.bmcl.2020.127756 10.7270/Q2CF9TS5 33359445 Zhou, Y; Lu, X; Du, C; Liu, Y; Wang, Y; Hong, KH; Chen, Y; Sun, H Southwest University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50559352 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50559352&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156700981 461829744 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51384533 Clc1ccccc1C(Cn1ccnc1)OCc1nc2ccccc2s1 InChI=1S/C19H16ClN3OS/c20-15-6-2-1-5-14(15)17(11-23-10-9-21-13-23)24-12-19-22-16-7-3-4-8-18(16)25-19/h1-10,13,17H,11-12H2 OSDHSVXCXYPTBC-UHFFFAOYSA-N 50559353 CHEMBL4787968 Cholinesterase 11300 ChEMBL 10.1016/j.bmcl.2020.127756 10.7270/Q2CF9TS5 33359445 Zhou, Y; Lu, X; Du, C; Liu, Y; Wang, Y; Hong, KH; Chen, Y; Sun, H Southwest University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50559353 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50559353&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156700982 461829745 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51384534 Clc1cccc(c1)C(Cn1ccnc1)OCc1nc2ccccc2s1 InChI=1S/C19H16ClN3OS/c20-15-5-3-4-14(10-15)17(11-23-9-8-21-13-23)24-12-19-22-16-6-1-2-7-18(16)25-19/h1-10,13,17H,11-12H2 LGYOTGVBFVXZBT-UHFFFAOYSA-N 50559354 CHEMBL4740250 Cholinesterase 6000 ChEMBL 10.1016/j.bmcl.2020.127756 10.7270/Q2CF9TS5 33359445 Zhou, Y; Lu, X; Du, C; Liu, Y; Wang, Y; Hong, KH; Chen, Y; Sun, H Southwest University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50559354 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50559354&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156700976 461829746 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51384535 Clc1ccc(cc1)C(Cn1ccnc1)OCc1nc2ccccc2s1 InChI=1S/C19H16ClN3OS/c20-15-7-5-14(6-8-15)17(11-23-10-9-21-13-23)24-12-19-22-16-3-1-2-4-18(16)25-19/h1-10,13,17H,11-12H2 XNBNJRWSRUFVTF-UHFFFAOYSA-N 50559355 CHEMBL4782238 Cholinesterase 7900 ChEMBL 10.1016/j.bmcl.2020.127756 10.7270/Q2CF9TS5 33359445 Zhou, Y; Lu, X; Du, C; Liu, Y; Wang, Y; Hong, KH; Chen, Y; Sun, H Southwest University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50559355 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50559355&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156700980 461829747 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51384536 Fc1ccc(cc1F)C(Cn1ccnc1)OCc1nc2ccccc2s1 InChI=1S/C19H15F2N3OS/c20-14-6-5-13(9-15(14)21)17(10-24-8-7-22-12-24)25-11-19-23-16-3-1-2-4-18(16)26-19/h1-9,12,17H,10-11H2 BNQXCIUECRAWBD-UHFFFAOYSA-N 50559356 CHEMBL4740576 Cholinesterase 1100 ChEMBL 10.1016/j.bmcl.2020.127756 10.7270/Q2CF9TS5 33359445 Zhou, Y; Lu, X; Du, C; Liu, Y; Wang, Y; Hong, KH; Chen, Y; Sun, H Southwest University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50559356 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50559356&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156700977 461829748 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51384537 Fc1ccc(C(Cn2ccnc2)OCc2nc3ccccc3s2)c(F)c1 InChI=1S/C19H15F2N3OS/c20-13-5-6-14(15(21)9-13)17(10-24-8-7-22-12-24)25-11-19-23-16-3-1-2-4-18(16)26-19/h1-9,12,17H,10-11H2 UJMVPXXTQPZCBP-UHFFFAOYSA-N 50559357 CHEMBL4749685 Cholinesterase 5700 ChEMBL 10.1016/j.bmcl.2020.127756 10.7270/Q2CF9TS5 33359445 Zhou, Y; Lu, X; Du, C; Liu, Y; Wang, Y; Hong, KH; Chen, Y; Sun, H Southwest University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50559357 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50559357&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156700979 461829749 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51384538 Fc1ccc(cc1)C(Cn1ccnc1)OCc1nc2ccccc2s1 InChI=1S/C19H16FN3OS/c20-15-7-5-14(6-8-15)17(11-23-10-9-21-13-23)24-12-19-22-16-3-1-2-4-18(16)25-19/h1-10,13,17H,11-12H2 OLSQVCOYAGWUNV-UHFFFAOYSA-N 50559358 CHEMBL4776465 Cholinesterase 3900 ChEMBL 10.1016/j.bmcl.2020.127756 10.7270/Q2CF9TS5 33359445 Zhou, Y; Lu, X; Du, C; Liu, Y; Wang, Y; Hong, KH; Chen, Y; Sun, H Southwest University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50559358 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50559358&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162643137 461829750 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51384539 Clc1ccc(C(Cn2ccnc2)OCc2cccnc2)c(Cl)c1 InChI=1S/C17H15Cl2N3O/c18-14-3-4-15(16(19)8-14)17(10-22-7-6-21-12-22)23-11-13-2-1-5-20-9-13/h1-9,12,17H,10-11H2 LZLUUFLNJANHEW-UHFFFAOYSA-N 50051837 CHEMBL3318359 Cholinesterase 41700 ChEMBL 10.1016/j.bmcl.2020.127756 10.7270/Q2CF9TS5 33359445 Zhou, Y; Lu, X; Du, C; Liu, Y; Wang, Y; Hong, KH; Chen, Y; Sun, H Southwest University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50051837 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50051837&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118708818 313069471 CHEMBL3318359 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51384540 Clc1ccc(C(Cn2ccnc2)OCc2ccsc2)c(Cl)c1 InChI=1S/C16H14Cl2N2OS/c17-13-1-2-14(15(18)7-13)16(8-20-5-4-19-11-20)21-9-12-3-6-22-10-12/h1-7,10-11,16H,8-9H2 WSCZZAJFIDKWCY-UHFFFAOYSA-N 50559359 CHEMBL4747120 Cholinesterase 31900 ChEMBL 10.1016/j.bmcl.2020.127756 10.7270/Q2CF9TS5 33359445 Zhou, Y; Lu, X; Du, C; Liu, Y; Wang, Y; Hong, KH; Chen, Y; Sun, H Southwest University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50559359 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50559359&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14178483 461829751 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51384541 Clc1ccc(C(Cn2ccnc2)OCc2cccc3ccccc23)c(Cl)c1 InChI=1S/C22H18Cl2N2O/c23-18-8-9-20(21(24)12-18)22(13-26-11-10-25-15-26)27-14-17-6-3-5-16-4-1-2-7-19(16)17/h1-12,15,22H,13-14H2 VZIRLMHQFQNKNN-UHFFFAOYSA-N 50559360 CHEMBL4778194 Cholinesterase 4000 ChEMBL 10.1016/j.bmcl.2020.127756 10.7270/Q2CF9TS5 33359445 Zhou, Y; Lu, X; Du, C; Liu, Y; Wang, Y; Hong, KH; Chen, Y; Sun, H Southwest University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50559360 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50559360&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 487078 461829752 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51384542 Clc1ccc(C(Cn2ccnc2)OCc2ccc3ccccc3c2)c(Cl)c1 InChI=1S/C22H18Cl2N2O/c23-19-7-8-20(21(24)12-19)22(13-26-10-9-25-15-26)27-14-16-5-6-17-3-1-2-4-18(17)11-16/h1-12,15,22H,13-14H2 ZUXSELAXQKMNOD-UHFFFAOYSA-N 50559361 CHEMBL4782213 Cholinesterase 90 ChEMBL 10.1016/j.bmcl.2020.127756 10.7270/Q2CF9TS5 33359445 Zhou, Y; Lu, X; Du, C; Liu, Y; Wang, Y; Hong, KH; Chen, Y; Sun, H Southwest University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50559361 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50559361&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3009082 461829753 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51384543 Clc1ccc(C(Cn2ccnc2)OCc2nc3ccccc3s2)c(Cl)c1 InChI=1S/C19H15Cl2N3OS/c20-13-5-6-14(15(21)9-13)17(10-24-8-7-22-12-24)25-11-19-23-16-3-1-2-4-18(16)26-19/h1-9,12,17H,10-11H2 SPEWLNAZXQOQLI-UHFFFAOYSA-N 50559362 CHEMBL4744876 Cholinesterase 3900 ChEMBL 10.1016/j.bmcl.2020.127756 10.7270/Q2CF9TS5 33359445 Zhou, Y; Lu, X; Du, C; Liu, Y; Wang, Y; Hong, KH; Chen, Y; Sun, H Southwest University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50559362 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50559362&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156700974 461829754 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51384544 Clc1ccc(C(Cn2ccnc2)OCc2nc3ccccc3o2)c(Cl)c1 InChI=1S/C19H15Cl2N3O2/c20-13-5-6-14(15(21)9-13)18(10-24-8-7-22-12-24)25-11-19-23-16-3-1-2-4-17(16)26-19/h1-9,12,18H,10-11H2 ZGBLFPALCPDVLF-UHFFFAOYSA-N 50559363 CHEMBL4783412 Cholinesterase 17600 ChEMBL 10.1016/j.bmcl.2020.127756 10.7270/Q2CF9TS5 33359445 Zhou, Y; Lu, X; Du, C; Liu, Y; Wang, Y; Hong, KH; Chen, Y; Sun, H Southwest University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50559363 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50559363&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156700972 461829755 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51384545 Clc1ccc(C(Cn2ccnc2)OCc2cc3ccccc3s2)c(Cl)c1 InChI=1S/C20H16Cl2N2OS/c21-15-5-6-17(18(22)10-15)19(11-24-8-7-23-13-24)25-12-16-9-14-3-1-2-4-20(14)26-16/h1-10,13,19H,11-12H2 MNTOSYXBBSVRNB-UHFFFAOYSA-N 50559364 CHEMBL4757927 Cholinesterase 1400 ChEMBL 10.1016/j.bmcl.2020.127756 10.7270/Q2CF9TS5 33359445 Zhou, Y; Lu, X; Du, C; Liu, Y; Wang, Y; Hong, KH; Chen, Y; Sun, H Southwest University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50559364 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50559364&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 13642626 461829756 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51380704 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 54 ChEMBL 10.1016/j.bmc.2016.04.041 10.7270/Q21J9FGH 27157006 Maqbool, M; Manral, A; Jameel, E; Kumar, J; Saini, V; Shandilya, A; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51380705 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 3140 ChEMBL 10.1016/j.bmc.2016.04.041 10.7270/Q21J9FGH 27157006 Maqbool, M; Manral, A; Jameel, E; Kumar, J; Saini, V; Shandilya, A; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51380706 COc1ccc(Nc2nc(Nc3cccc(c3)C(F)(F)F)nc(n2)N2CCN(CC2)c2ncccc2C#N)cc1 InChI=1S/C27H24F3N9O/c1-40-22-9-7-20(8-10-22)33-24-35-25(34-21-6-2-5-19(16-21)27(28,29)30)37-26(36-24)39-14-12-38(13-15-39)23-18(17-31)4-3-11-32-23/h2-11,16H,12-15H2,1H3,(H2,33,34,35,36,37) XMTZXGINSRQIFY-UHFFFAOYSA-N 50558113 CHEMBL4788262 Cholinesterase 2015 ChEMBL 10.1016/j.bmc.2016.04.041 10.7270/Q21J9FGH 27157006 Maqbool, M; Manral, A; Jameel, E; Kumar, J; Saini, V; Shandilya, A; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50558113 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50558113&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 132523862 461828505 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51380707 Cc1ccc(Nc2nc(Nc3ccc(F)c(Cl)c3)nc(n2)N2CCN(CC2)c2ncccc2C#N)cc1 InChI=1S/C26H23ClFN9/c1-17-4-6-19(7-5-17)31-24-33-25(32-20-8-9-22(28)21(27)15-20)35-26(34-24)37-13-11-36(12-14-37)23-18(16-29)3-2-10-30-23/h2-10,15H,11-14H2,1H3,(H2,31,32,33,34,35) QHDZVNVQCYTSJP-UHFFFAOYSA-N 50558114 CHEMBL4750916 Cholinesterase 5365 ChEMBL 10.1016/j.bmc.2016.04.041 10.7270/Q21J9FGH 27157006 Maqbool, M; Manral, A; Jameel, E; Kumar, J; Saini, V; Shandilya, A; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50558114 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50558114&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162651808 461828506 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51380708 COc1ccc(Nc2nc(Nc3ccccc3F)nc(n2)N2CCN(CC2)c2ncccc2C#N)cc1 InChI=1S/C26H24FN9O/c1-37-20-10-8-19(9-11-20)30-24-32-25(31-22-7-3-2-6-21(22)27)34-26(33-24)36-15-13-35(14-16-36)23-18(17-28)5-4-12-29-23/h2-12H,13-16H2,1H3,(H2,30,31,32,33,34) LJJJAKCQSLUTJC-UHFFFAOYSA-N 50558115 CHEMBL4748340 Cholinesterase 4132 ChEMBL 10.1016/j.bmc.2016.04.041 10.7270/Q21J9FGH 27157006 Maqbool, M; Manral, A; Jameel, E; Kumar, J; Saini, V; Shandilya, A; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50558115 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50558115&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162649770 461828507 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51380709 Fc1ccc(Nc2nc(Nc3cccc(c3)C(F)(F)F)nc(n2)N2CCN(CC2)c2ncccc2C#N)cc1 InChI=1S/C26H21F4N9/c27-19-6-8-20(9-7-19)33-23-35-24(34-21-5-1-4-18(15-21)26(28,29)30)37-25(36-23)39-13-11-38(12-14-39)22-17(16-31)3-2-10-32-22/h1-10,15H,11-14H2,(H2,33,34,35,36,37) AXLNTCKCVCFQGU-UHFFFAOYSA-N 50558116 CHEMBL4742932 Cholinesterase 4894 ChEMBL 10.1016/j.bmc.2016.04.041 10.7270/Q21J9FGH 27157006 Maqbool, M; Manral, A; Jameel, E; Kumar, J; Saini, V; Shandilya, A; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50558116 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50558116&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162645809 461828508 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51380710 Fc1ccc(Nc2nc(Nc3cccc(c3)C(F)(F)F)nc(n2)N2CCN(CC2)c2ncccc2C#N)cc1Cl InChI=1S/C26H20ClF4N9/c27-20-14-19(6-7-21(20)28)35-24-36-23(34-18-5-1-4-17(13-18)26(29,30)31)37-25(38-24)40-11-9-39(10-12-40)22-16(15-32)3-2-8-33-22/h1-8,13-14H,9-12H2,(H2,34,35,36,37,38) ZEFOPDDDFZWYRD-UHFFFAOYSA-N 50558117 CHEMBL4756899 Cholinesterase 3603 ChEMBL 10.1016/j.bmc.2016.04.041 10.7270/Q21J9FGH 27157006 Maqbool, M; Manral, A; Jameel, E; Kumar, J; Saini, V; Shandilya, A; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50558117 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50558117&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 132523861 461828509 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51380711 Fc1ccc(Nc2nc(Nc3cccc(c3)C(F)(F)F)nc(n2)N2CCN(CC2)c2ncccc2C#N)c(F)c1 InChI=1S/C26H20F5N9/c27-18-6-7-21(20(28)14-18)35-24-36-23(34-19-5-1-4-17(13-19)26(29,30)31)37-25(38-24)40-11-9-39(10-12-40)22-16(15-32)3-2-8-33-22/h1-8,13-14H,9-12H2,(H2,34,35,36,37,38) QYNQZGJHBXPSHC-UHFFFAOYSA-N 50558118 CHEMBL4745700 Cholinesterase 2849 ChEMBL 10.1016/j.bmc.2016.04.041 10.7270/Q21J9FGH 27157006 Maqbool, M; Manral, A; Jameel, E; Kumar, J; Saini, V; Shandilya, A; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50558118 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50558118&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162648729 461828510 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51380712 Cc1ccc(Nc2nc(Nc3cccc(c3)C(F)(F)F)nc(n2)N2CCN(CC2)c2ncccc2C#N)cc1 InChI=1S/C27H24F3N9/c1-18-7-9-21(10-8-18)33-24-35-25(34-22-6-2-5-20(16-22)27(28,29)30)37-26(36-24)39-14-12-38(13-15-39)23-19(17-31)4-3-11-32-23/h2-11,16H,12-15H2,1H3,(H2,33,34,35,36,37) NCWPINBSURTTQN-UHFFFAOYSA-N 50558119 CHEMBL4748575 Cholinesterase 2214 ChEMBL 10.1016/j.bmc.2016.04.041 10.7270/Q21J9FGH 27157006 Maqbool, M; Manral, A; Jameel, E; Kumar, J; Saini, V; Shandilya, A; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50558119 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50558119&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162650537 461828511 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51380713 FC(F)(F)c1cccc(Nc2nc(NC3CC3)nc(n2)N2CCN(CC2)c2ncccc2C#N)c1 InChI=1S/C23H22F3N9/c24-23(25,26)16-4-1-5-18(13-16)30-21-31-20(29-17-6-7-17)32-22(33-21)35-11-9-34(10-12-35)19-15(14-27)3-2-8-28-19/h1-5,8,13,17H,6-7,9-12H2,(H2,29,30,31,32,33) MNYJBUBLCSETOV-UHFFFAOYSA-N 50558120 CHEMBL4793687 Cholinesterase 5245 ChEMBL 10.1016/j.bmc.2016.04.041 10.7270/Q21J9FGH 27157006 Maqbool, M; Manral, A; Jameel, E; Kumar, J; Saini, V; Shandilya, A; Tiwari, M; Hoda, N; Jayaram, B Jamia Millia Islamia (Central University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50558120 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50558120&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162673270 461828512 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51392799 CN(CCCOc1cc(O)c2c(c1)oc1ccccc1c2=O)Cc1cccc(O)c1 InChI=1S/C24H23NO5/c1-25(15-16-6-4-7-17(26)12-16)10-5-11-29-18-13-20(27)23-22(14-18)30-21-9-3-2-8-19(21)24(23)28/h2-4,6-9,12-14,26-27H,5,10-11,15H2,1H3 YEKSRTQYIOCWIA-UHFFFAOYSA-N 50562834 CHEMBL4754255 Cholinesterase 2960 ChEMBL 10.1016/j.ejmech.2021.113154 10.7270/Q2NG4VDK 33476932 Zhang, Z; Guo, J; Cheng, M; Zhou, W; Wan, Y; Wang, R; Fang, Y; Jin, Y; Liu, J; Xie, SS Jiangxi University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50562834 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50562834&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162654084 461683172 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51392800 CN(CCCCOc1cc(O)c2c(c1)oc1ccccc1c2=O)Cc1cccc(O)c1 InChI=1S/C25H25NO5/c1-26(16-17-7-6-8-18(27)13-17)11-4-5-12-30-19-14-21(28)24-23(15-19)31-22-10-3-2-9-20(22)25(24)29/h2-3,6-10,13-15,27-28H,4-5,11-12,16H2,1H3 DDGVPUHITRVBDM-UHFFFAOYSA-N 50562835 CHEMBL4748630 Cholinesterase 8940 ChEMBL 10.1016/j.ejmech.2021.113154 10.7270/Q2NG4VDK 33476932 Zhang, Z; Guo, J; Cheng, M; Zhou, W; Wan, Y; Wang, R; Fang, Y; Jin, Y; Liu, J; Xie, SS Jiangxi University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50562835 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50562835&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162649673 461683173 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51392801 CN(CCCCCOc1cc(O)c2c(c1)oc1ccccc1c2=O)Cc1cccc(O)c1 InChI=1S/C26H27NO5/c1-27(17-18-8-7-9-19(28)14-18)12-5-2-6-13-31-20-15-22(29)25-24(16-20)32-23-11-4-3-10-21(23)26(25)30/h3-4,7-11,14-16,28-29H,2,5-6,12-13,17H2,1H3 UTOBFMQKFPBJBY-UHFFFAOYSA-N 50562836 CHEMBL4758250 Cholinesterase 24240 ChEMBL 10.1016/j.ejmech.2021.113154 10.7270/Q2NG4VDK 33476932 Zhang, Z; Guo, J; Cheng, M; Zhou, W; Wan, Y; Wang, R; Fang, Y; Jin, Y; Liu, J; Xie, SS Jiangxi University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50562836 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50562836&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162656694 461683174 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51392802 CN(CCCCCCOc1cc(O)c2c(c1)oc1ccccc1c2=O)Cc1cccc(O)c1 InChI=1S/C27H29NO5/c1-28(18-19-9-8-10-20(29)15-19)13-6-2-3-7-14-32-21-16-23(30)26-25(17-21)33-24-12-5-4-11-22(24)27(26)31/h4-5,8-12,15-17,29-30H,2-3,6-7,13-14,18H2,1H3 LOUJSJQEPRZURP-UHFFFAOYSA-N 50562837 CHEMBL4778435 Cholinesterase 22330 ChEMBL 10.1016/j.ejmech.2021.113154 10.7270/Q2NG4VDK 33476932 Zhang, Z; Guo, J; Cheng, M; Zhou, W; Wan, Y; Wang, R; Fang, Y; Jin, Y; Liu, J; Xie, SS Jiangxi University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50562837 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50562837&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162644144 461683175 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51392803 CN(CCCCCCCOc1cc(O)c2c(c1)oc1ccccc1c2=O)Cc1cccc(O)c1 InChI=1S/C28H31NO5/c1-29(19-20-10-9-11-21(30)16-20)14-7-3-2-4-8-15-33-22-17-24(31)27-26(18-22)34-25-13-6-5-12-23(25)28(27)32/h5-6,9-13,16-18,30-31H,2-4,7-8,14-15,19H2,1H3 RXIYUFLOMOXXRD-UHFFFAOYSA-N 50562838 CHEMBL4755459 Cholinesterase 500 ChEMBL 10.1016/j.ejmech.2021.113154 10.7270/Q2NG4VDK 33476932 Zhang, Z; Guo, J; Cheng, M; Zhou, W; Wan, Y; Wang, R; Fang, Y; Jin, Y; Liu, J; Xie, SS Jiangxi University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50562838 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50562838&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162655229 461683176 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51392804 CN(CCCCCCCCOc1cc(O)c2c(c1)oc1ccccc1c2=O)Cc1cccc(O)c1 InChI=1S/C29H33NO5/c1-30(20-21-11-10-12-22(31)17-21)15-8-4-2-3-5-9-16-34-23-18-25(32)28-27(19-23)35-26-14-7-6-13-24(26)29(28)33/h6-7,10-14,17-19,31-32H,2-5,8-9,15-16,20H2,1H3 FGAWWFVPBWVUCD-UHFFFAOYSA-N 50562851 CHEMBL4753269 Cholinesterase 6140 ChEMBL 10.1016/j.ejmech.2021.113154 10.7270/Q2NG4VDK 33476932 Zhang, Z; Guo, J; Cheng, M; Zhou, W; Wan, Y; Wang, R; Fang, Y; Jin, Y; Liu, J; Xie, SS Jiangxi University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50562851 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50562851&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162653523 461683189 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51392805 CN(CCCOc1cc(O)c2c(c1)oc1ccccc1c2=O)Cc1ccc(O)cc1 InChI=1S/C24H23NO5/c1-25(15-16-7-9-17(26)10-8-16)11-4-12-29-18-13-20(27)23-22(14-18)30-21-6-3-2-5-19(21)24(23)28/h2-3,5-10,13-14,26-27H,4,11-12,15H2,1H3 NWBDPWVAGGIVLE-UHFFFAOYSA-N 50562852 CHEMBL4744250 Cholinesterase 32260 ChEMBL 10.1016/j.ejmech.2021.113154 10.7270/Q2NG4VDK 33476932 Zhang, Z; Guo, J; Cheng, M; Zhou, W; Wan, Y; Wang, R; Fang, Y; Jin, Y; Liu, J; Xie, SS Jiangxi University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50562852 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50562852&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162645442 461683190 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51392806 CN(CCCCOc1cc(O)c2c(c1)oc1ccccc1c2=O)Cc1ccc(O)cc1 InChI=1S/C25H25NO5/c1-26(16-17-8-10-18(27)11-9-17)12-4-5-13-30-19-14-21(28)24-23(15-19)31-22-7-3-2-6-20(22)25(24)29/h2-3,6-11,14-15,27-28H,4-5,12-13,16H2,1H3 OIUCJQGBNNPNAK-UHFFFAOYSA-N 50562839 CHEMBL4781032 Cholinesterase 790 ChEMBL 10.1016/j.ejmech.2021.113154 10.7270/Q2NG4VDK 33476932 Zhang, Z; Guo, J; Cheng, M; Zhou, W; Wan, Y; Wang, R; Fang, Y; Jin, Y; Liu, J; Xie, SS Jiangxi University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50562839 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50562839&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162663640 461683177 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51392807 CN(CCCCCOc1cc(O)c2c(c1)oc1ccccc1c2=O)Cc1ccc(O)cc1 InChI=1S/C26H27NO5/c1-27(17-18-9-11-19(28)12-10-18)13-5-2-6-14-31-20-15-22(29)25-24(16-20)32-23-8-4-3-7-21(23)26(25)30/h3-4,7-12,15-16,28-29H,2,5-6,13-14,17H2,1H3 DLYKFMRGKTUAFX-UHFFFAOYSA-N 50562840 CHEMBL4758768 Cholinesterase 3870 ChEMBL 10.1016/j.ejmech.2021.113154 10.7270/Q2NG4VDK 33476932 Zhang, Z; Guo, J; Cheng, M; Zhou, W; Wan, Y; Wang, R; Fang, Y; Jin, Y; Liu, J; Xie, SS Jiangxi University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50562840 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50562840&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162658374 461683178 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51392808 CN(CCCCCCOc1cc(O)c2c(c1)oc1ccccc1c2=O)Cc1ccc(O)cc1 InChI=1S/C27H29NO5/c1-28(18-19-10-12-20(29)13-11-19)14-6-2-3-7-15-32-21-16-23(30)26-25(17-21)33-24-9-5-4-8-22(24)27(26)31/h4-5,8-13,16-17,29-30H,2-3,6-7,14-15,18H2,1H3 GNJJURBAYZCGRE-UHFFFAOYSA-N 50562841 CHEMBL4752063 Cholinesterase 590 ChEMBL 10.1016/j.ejmech.2021.113154 10.7270/Q2NG4VDK 33476932 Zhang, Z; Guo, J; Cheng, M; Zhou, W; Wan, Y; Wang, R; Fang, Y; Jin, Y; Liu, J; Xie, SS Jiangxi University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50562841 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50562841&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162652742 461683179 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51392809 CN(CCCCCCCOc1cc(O)c2c(c1)oc1ccccc1c2=O)Cc1ccc(O)cc1 InChI=1S/C28H31NO5/c1-29(19-20-11-13-21(30)14-12-20)15-7-3-2-4-8-16-33-22-17-24(31)27-26(18-22)34-25-10-6-5-9-23(25)28(27)32/h5-6,9-14,17-18,30-31H,2-4,7-8,15-16,19H2,1H3 MNJRGKREKUXGIL-UHFFFAOYSA-N 50562842 CHEMBL4741451 Cholinesterase 1820 ChEMBL 10.1016/j.ejmech.2021.113154 10.7270/Q2NG4VDK 33476932 Zhang, Z; Guo, J; Cheng, M; Zhou, W; Wan, Y; Wang, R; Fang, Y; Jin, Y; Liu, J; Xie, SS Jiangxi University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50562842 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50562842&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162646674 461683180 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51392810 CN(CCCCCCCCOc1cc(O)c2c(c1)oc1ccccc1c2=O)Cc1ccc(O)cc1 InChI=1S/C29H33NO5/c1-30(20-21-12-14-22(31)15-13-21)16-8-4-2-3-5-9-17-34-23-18-25(32)28-27(19-23)35-26-11-7-6-10-24(26)29(28)33/h6-7,10-15,18-19,31-32H,2-5,8-9,16-17,20H2,1H3 XHCPAGFZZDPSMR-UHFFFAOYSA-N 50562853 CHEMBL4744313 Cholinesterase 9530 ChEMBL 10.1016/j.ejmech.2021.113154 10.7270/Q2NG4VDK 33476932 Zhang, Z; Guo, J; Cheng, M; Zhou, W; Wan, Y; Wang, R; Fang, Y; Jin, Y; Liu, J; Xie, SS Jiangxi University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50562853 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50562853&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162648134 461683191 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51392811 COc1ccc(CN(C)CCCCCCOc2cc(O)c3c(c2)oc2ccccc2c3=O)cc1 InChI=1S/C28H31NO5/c1-29(19-20-11-13-21(32-2)14-12-20)15-7-3-4-8-16-33-22-17-24(30)27-26(18-22)34-25-10-6-5-9-23(25)28(27)31/h5-6,9-14,17-18,30H,3-4,7-8,15-16,19H2,1-2H3 DKYGDXKIIQHHLB-UHFFFAOYSA-N 50562843 CHEMBL4755028 Cholinesterase 9370 ChEMBL 10.1016/j.ejmech.2021.113154 10.7270/Q2NG4VDK 33476932 Zhang, Z; Guo, J; Cheng, M; Zhou, W; Wan, Y; Wang, R; Fang, Y; Jin, Y; Liu, J; Xie, SS Jiangxi University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50562843 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50562843&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162654906 461683181 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51392812 CCN(CCCCCCOc1cc(O)c2c(c1)oc1ccccc1c2=O)Cc1ccc(O)cc1 InChI=1S/C28H31NO5/c1-2-29(19-20-11-13-21(30)14-12-20)15-7-3-4-8-16-33-22-17-24(31)27-26(18-22)34-25-10-6-5-9-23(25)28(27)32/h5-6,9-14,17-18,30-31H,2-4,7-8,15-16,19H2,1H3 MCLKDRXUGQWORC-UHFFFAOYSA-N 50562844 CHEMBL4794657 Cholinesterase 1700 ChEMBL 10.1016/j.ejmech.2021.113154 10.7270/Q2NG4VDK 33476932 Zhang, Z; Guo, J; Cheng, M; Zhou, W; Wan, Y; Wang, R; Fang, Y; Jin, Y; Liu, J; Xie, SS Jiangxi University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50562844 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50562844&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162673046 461683182 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51392813 CN(CCCCCCOc1cc(O)c2c(c1)oc1ccccc1c2=O)Cc1ccc(OC(=O)NCCCl)cc1 InChI=1S/C30H33ClN2O6/c1-33(20-21-10-12-22(13-11-21)38-30(36)32-15-14-31)16-6-2-3-7-17-37-23-18-25(34)28-27(19-23)39-26-9-5-4-8-24(26)29(28)35/h4-5,8-13,18-19,34H,2-3,6-7,14-17,20H2,1H3,(H,32,36) VWYHZCHSDUDVFL-UHFFFAOYSA-N 50562846 CHEMBL4798955 Cholinesterase 1740 ChEMBL 10.1016/j.ejmech.2021.113154 10.7270/Q2NG4VDK 33476932 Zhang, Z; Guo, J; Cheng, M; Zhou, W; Wan, Y; Wang, R; Fang, Y; Jin, Y; Liu, J; Xie, SS Jiangxi University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50562846 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50562846&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162676174 461683184 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51392814 CCNC(=O)Oc1ccc(CN(CC)CCCCCCOc2cc(O)c3c(c2)oc2ccccc2c3=O)cc1 InChI=1S/C31H36N2O6/c1-3-32-31(36)38-23-15-13-22(14-16-23)21-33(4-2)17-9-5-6-10-18-37-24-19-26(34)29-28(20-24)39-27-12-8-7-11-25(27)30(29)35/h7-8,11-16,19-20,34H,3-6,9-10,17-18,21H2,1-2H3,(H,32,36) SYAITRUNDPAKAH-UHFFFAOYSA-N 50562848 CHEMBL4744078 Cholinesterase 1150 ChEMBL 10.1016/j.ejmech.2021.113154 10.7270/Q2NG4VDK 33476932 Zhang, Z; Guo, J; Cheng, M; Zhou, W; Wan, Y; Wang, R; Fang, Y; Jin, Y; Liu, J; Xie, SS Jiangxi University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50562848 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50562848&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162645724 461683186 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51392815 CCN(CCCCCCOc1cc(O)c2c(c1)oc1ccccc1c2=O)Cc1ccc(OC(=O)NCCCl)cc1 InChI=1S/C31H35ClN2O6/c1-2-34(21-22-11-13-23(14-12-22)39-31(37)33-16-15-32)17-7-3-4-8-18-38-24-19-26(35)29-28(20-24)40-27-10-6-5-9-25(27)30(29)36/h5-6,9-14,19-20,35H,2-4,7-8,15-18,21H2,1H3,(H,33,37) XYXZIRLTUWVAHS-UHFFFAOYSA-N 50562849 CHEMBL4752929 Cholinesterase 1030 ChEMBL 10.1016/j.ejmech.2021.113154 10.7270/Q2NG4VDK 33476932 Zhang, Z; Guo, J; Cheng, M; Zhou, W; Wan, Y; Wang, R; Fang, Y; Jin, Y; Liu, J; Xie, SS Jiangxi University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50562849 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50562849&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162653242 461683187 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51392816 CCN(CCCCCCOc1cc(O)c2c(c1)oc1ccccc1c2=O)Cc1ccc(OC(=O)NC2CCCCC2)cc1 InChI=1S/C35H42N2O6/c1-2-37(24-25-16-18-27(19-17-25)42-35(40)36-26-12-6-5-7-13-26)20-10-3-4-11-21-41-28-22-30(38)33-32(23-28)43-31-15-9-8-14-29(31)34(33)39/h8-9,14-19,22-23,26,38H,2-7,10-13,20-21,24H2,1H3,(H,36,40) YVQPMMNOMPNOOG-UHFFFAOYSA-N 50562850 CHEMBL4747302 Cholinesterase 1150 ChEMBL 10.1016/j.ejmech.2021.113154 10.7270/Q2NG4VDK 33476932 Zhang, Z; Guo, J; Cheng, M; Zhou, W; Wan, Y; Wang, R; Fang, Y; Jin, Y; Liu, J; Xie, SS Jiangxi University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50562850 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50562850&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162649335 461683188 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51392818 CN(CCCCCCOc1cc(O)c2c(c1)oc1ccccc1c2=O)Cc1ccc(O)cc1 InChI=1S/C27H29NO5/c1-28(18-19-10-12-20(29)13-11-19)14-6-2-3-7-15-32-21-16-23(30)26-25(17-21)33-24-9-5-4-8-22(24)27(26)31/h4-5,8-13,16-17,29-30H,2-3,6-7,14-15,18H2,1H3 GNJJURBAYZCGRE-UHFFFAOYSA-N 50562841 CHEMBL4752063 Cholinesterase 980 ChEMBL 10.1016/j.ejmech.2021.113154 10.7270/Q2NG4VDK 33476932 Zhang, Z; Guo, J; Cheng, M; Zhou, W; Wan, Y; Wang, R; Fang, Y; Jin, Y; Liu, J; Xie, SS Jiangxi University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50562841 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50562841&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162652742 461683179 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51368036 O=C(NC1CCN(Cc2ccccc2)CC1)c1coc2ccccc2c1=O InChI=1S/C22H22N2O3/c25-21-18-8-4-5-9-20(18)27-15-19(21)22(26)23-17-10-12-24(13-11-17)14-16-6-2-1-3-7-16/h1-9,15,17H,10-14H2,(H,23,26) YYQSIEUYVCJQSZ-UHFFFAOYSA-N 50553075 CHEMBL4790953 Cholinesterase 18670 ChEMBL 10.1039/c9md00441f 10.7270/Q270852S 33479629 Wang, XB; Yin, FC; Huang, M; Jiang, N; Lan, JS; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50553075 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50553075&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162670663 461691843 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51368037 COc1ccc2occ(C(=O)NC3CCN(Cc4ccccc4)CC3)c(=O)c2c1 InChI=1S/C23H24N2O4/c1-28-18-7-8-21-19(13-18)22(26)20(15-29-21)23(27)24-17-9-11-25(12-10-17)14-16-5-3-2-4-6-16/h2-8,13,15,17H,9-12,14H2,1H3,(H,24,27) SWFZHTZTBBYBRD-UHFFFAOYSA-N 50553076 CHEMBL4741196 Cholinesterase 24360 ChEMBL 10.1039/c9md00441f 10.7270/Q270852S 33479629 Wang, XB; Yin, FC; Huang, M; Jiang, N; Lan, JS; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50553076 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50553076&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162645600 461691844 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51368038 O=C(NC1CCN(Cc2ccccc2)CC1)c1coc2ccc(OCc3ccccc3)cc2c1=O InChI=1S/C29H28N2O4/c32-28-25-17-24(34-19-22-9-5-2-6-10-22)11-12-27(25)35-20-26(28)29(33)30-23-13-15-31(16-14-23)18-21-7-3-1-4-8-21/h1-12,17,20,23H,13-16,18-19H2,(H,30,33) PTBGLAAUSXAMMJ-UHFFFAOYSA-N 50553077 CHEMBL4760340 Cholinesterase 12430 ChEMBL 10.1039/c9md00441f 10.7270/Q270852S 33479629 Wang, XB; Yin, FC; Huang, M; Jiang, N; Lan, JS; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50553077 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50553077&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162658550 461691845 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51368039 Cc1ccc2occ(C(=O)NC3CCN(Cc4ccccc4)CC3)c(=O)c2c1 InChI=1S/C23H24N2O3/c1-16-7-8-21-19(13-16)22(26)20(15-28-21)23(27)24-18-9-11-25(12-10-18)14-17-5-3-2-4-6-17/h2-8,13,15,18H,9-12,14H2,1H3,(H,24,27) NOZXTWSXCFNMEK-UHFFFAOYSA-N 50553078 CHEMBL4793623 Cholinesterase 15270 ChEMBL 10.1039/c9md00441f 10.7270/Q270852S 33479629 Wang, XB; Yin, FC; Huang, M; Jiang, N; Lan, JS; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50553078 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50553078&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162672332 461691846 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51368040 Brc1ccc2occ(C(=O)NC3CCN(Cc4ccccc4)CC3)c(=O)c2c1 InChI=1S/C22H21BrN2O3/c23-16-6-7-20-18(12-16)21(26)19(14-28-20)22(27)24-17-8-10-25(11-9-17)13-15-4-2-1-3-5-15/h1-7,12,14,17H,8-11,13H2,(H,24,27) WWMJGNGNARFWEL-UHFFFAOYSA-N 50553079 CHEMBL4749888 Cholinesterase 9450 ChEMBL 10.1039/c9md00441f 10.7270/Q270852S 33479629 Wang, XB; Yin, FC; Huang, M; Jiang, N; Lan, JS; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50553079 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50553079&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162652057 461691847 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51368041 COc1ccc2c(c1)occ(C(=O)NC1CCN(Cc3ccccc3)CC1)c2=O InChI=1S/C23H24N2O4/c1-28-18-7-8-19-21(13-18)29-15-20(22(19)26)23(27)24-17-9-11-25(12-10-17)14-16-5-3-2-4-6-16/h2-8,13,15,17H,9-12,14H2,1H3,(H,24,27) AHYOEMAPXJVTGJ-UHFFFAOYSA-N 50553080 CHEMBL4782785 Cholinesterase 9780 ChEMBL 10.1039/c9md00441f 10.7270/Q270852S 33479629 Wang, XB; Yin, FC; Huang, M; Jiang, N; Lan, JS; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50553080 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50553080&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162664676 461691848 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51368042 Brc1ccc2c(c1)occ(C(=O)NC1CCN(Cc3ccccc3)CC1)c2=O InChI=1S/C22H21BrN2O3/c23-16-6-7-18-20(12-16)28-14-19(21(18)26)22(27)24-17-8-10-25(11-9-17)13-15-4-2-1-3-5-15/h1-7,12,14,17H,8-11,13H2,(H,24,27) SWALMABHEZMNIK-UHFFFAOYSA-N 50553081 CHEMBL4757560 Cholinesterase 18240 ChEMBL 10.1039/c9md00441f 10.7270/Q270852S 33479629 Wang, XB; Yin, FC; Huang, M; Jiang, N; Lan, JS; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50553081 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50553081&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162656181 461691849 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51368043 O=C(NC1CCN(Cc2ccccc2)CC1)c1cc(=O)c2ccccc2o1 InChI=1S/C22H22N2O3/c25-19-14-21(27-20-9-5-4-8-18(19)20)22(26)23-17-10-12-24(13-11-17)15-16-6-2-1-3-7-16/h1-9,14,17H,10-13,15H2,(H,23,26) KYHRJRLKNXKQIL-UHFFFAOYSA-N 50553082 CHEMBL4757818 Cholinesterase 27860 ChEMBL 10.1039/c9md00441f 10.7270/Q270852S 33479629 Wang, XB; Yin, FC; Huang, M; Jiang, N; Lan, JS; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50553082 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50553082&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 26691366 461691850 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51368044 O=C(NCCC1CCN(Cc2ccccc2)CC1)c1coc2ccccc2c1=O InChI=1S/C24H26N2O3/c27-23-20-8-4-5-9-22(20)29-17-21(23)24(28)25-13-10-18-11-14-26(15-12-18)16-19-6-2-1-3-7-19/h1-9,17-18H,10-16H2,(H,25,28) RFBQNFSEIPHGIR-UHFFFAOYSA-N 50553083 CHEMBL4755016 Cholinesterase 600 ChEMBL 10.1039/c9md00441f 10.7270/Q270852S 33479629 Wang, XB; Yin, FC; Huang, M; Jiang, N; Lan, JS; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50553083 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50553083&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162654822 461691851 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51368045 COc1ccc2occ(C(=O)NCCC3CCN(Cc4ccccc4)CC3)c(=O)c2c1 InChI=1S/C25H28N2O4/c1-30-20-7-8-23-21(15-20)24(28)22(17-31-23)25(29)26-12-9-18-10-13-27(14-11-18)16-19-5-3-2-4-6-19/h2-8,15,17-18H,9-14,16H2,1H3,(H,26,29) USQSMKRDPJTQEC-UHFFFAOYSA-N 50553084 CHEMBL4798359 Cholinesterase 450 ChEMBL 10.1039/c9md00441f 10.7270/Q270852S 33479629 Wang, XB; Yin, FC; Huang, M; Jiang, N; Lan, JS; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50553084 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50553084&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162675988 461691852 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51368046 O=C(NCCC1CCN(Cc2ccccc2)CC1)c1coc2ccc(OCc3ccccc3)cc2c1=O InChI=1S/C31H32N2O4/c34-30-27-19-26(36-21-25-9-5-2-6-10-25)11-12-29(27)37-22-28(30)31(35)32-16-13-23-14-17-33(18-15-23)20-24-7-3-1-4-8-24/h1-12,19,22-23H,13-18,20-21H2,(H,32,35) TUTKEHICBPHHMG-UHFFFAOYSA-N 50553085 CHEMBL4762982 Cholinesterase 5240 ChEMBL 10.1039/c9md00441f 10.7270/Q270852S 33479629 Wang, XB; Yin, FC; Huang, M; Jiang, N; Lan, JS; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50553085 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50553085&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162660163 461691853 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51368047 Cc1ccc2occ(C(=O)NCCC3CCN(Cc4ccccc4)CC3)c(=O)c2c1 InChI=1S/C25H28N2O3/c1-18-7-8-23-21(15-18)24(28)22(17-30-23)25(29)26-12-9-19-10-13-27(14-11-19)16-20-5-3-2-4-6-20/h2-8,15,17,19H,9-14,16H2,1H3,(H,26,29) SNSYUYWYEUNZER-UHFFFAOYSA-N 50553086 CHEMBL4756552 Cholinesterase 910 ChEMBL 10.1039/c9md00441f 10.7270/Q270852S 33479629 Wang, XB; Yin, FC; Huang, M; Jiang, N; Lan, JS; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50553086 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50553086&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162655555 461691854 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51368048 Brc1ccc2occ(C(=O)NCCC3CCN(Cc4ccccc4)CC3)c(=O)c2c1 InChI=1S/C24H25BrN2O3/c25-19-6-7-22-20(14-19)23(28)21(16-30-22)24(29)26-11-8-17-9-12-27(13-10-17)15-18-4-2-1-3-5-18/h1-7,14,16-17H,8-13,15H2,(H,26,29) YQIZRHGSFXSOAV-UHFFFAOYSA-N 50553087 CHEMBL4762012 Cholinesterase 1170 ChEMBL 10.1039/c9md00441f 10.7270/Q270852S 33479629 Wang, XB; Yin, FC; Huang, M; Jiang, N; Lan, JS; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50553087 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50553087&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162659546 461691855 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51368049 COc1ccc2c(c1)occ(C(=O)NCCC1CCN(Cc3ccccc3)CC1)c2=O InChI=1S/C25H28N2O4/c1-30-20-7-8-21-23(15-20)31-17-22(24(21)28)25(29)26-12-9-18-10-13-27(14-11-18)16-19-5-3-2-4-6-19/h2-8,15,17-18H,9-14,16H2,1H3,(H,26,29) HXGMNMOZSBRAIU-UHFFFAOYSA-N 50553088 CHEMBL4794092 Cholinesterase 520 ChEMBL 10.1039/c9md00441f 10.7270/Q270852S 33479629 Wang, XB; Yin, FC; Huang, M; Jiang, N; Lan, JS; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50553088 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50553088&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162673396 461691856 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51368050 Brc1ccc2c(c1)occ(C(=O)NCCC1CCN(Cc3ccccc3)CC1)c2=O InChI=1S/C24H25BrN2O3/c25-19-6-7-20-22(14-19)30-16-21(23(20)28)24(29)26-11-8-17-9-12-27(13-10-17)15-18-4-2-1-3-5-18/h1-7,14,16-17H,8-13,15H2,(H,26,29) JXKJBFMGHWWKLD-UHFFFAOYSA-N 50553089 CHEMBL4798406 Cholinesterase 1240 ChEMBL 10.1039/c9md00441f 10.7270/Q270852S 33479629 Wang, XB; Yin, FC; Huang, M; Jiang, N; Lan, JS; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50553089 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50553089&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162674764 461691857 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51368051 O=C(NCCC1CCN(Cc2ccccc2)CC1)c1cc(=O)c2ccccc2o1 InChI=1S/C24H26N2O3/c27-21-16-23(29-22-9-5-4-8-20(21)22)24(28)25-13-10-18-11-14-26(15-12-18)17-19-6-2-1-3-7-19/h1-9,16,18H,10-15,17H2,(H,25,28) ADKJHJNFROJLTD-UHFFFAOYSA-N 50468702 CHEMBL4286799 Cholinesterase 1540 ChEMBL 10.1039/c9md00441f 10.7270/Q270852S 33479629 Wang, XB; Yin, FC; Huang, M; Jiang, N; Lan, JS; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50468702 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50468702&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145993120 433935967 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51368052 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 2470 ChEMBL 10.1039/c9md00441f 10.7270/Q270852S 33479629 Wang, XB; Yin, FC; Huang, M; Jiang, N; Lan, JS; Kong, LY China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51377754 Cn1c2ccc(NC(=O)CCN3CCN(Cc4ccc(F)cc4)CC3)cc2sc1=O InChI=1S/C22H25FN4O2S/c1-25-19-7-6-18(14-20(19)30-22(25)29)24-21(28)8-9-26-10-12-27(13-11-26)15-16-2-4-17(23)5-3-16/h2-7,14H,8-13,15H2,1H3,(H,24,28) GBRMCMIAKFMCQQ-UHFFFAOYSA-N 50557142 CHEMBL4798755 Cholinesterase 37600 ChEMBL 10.1016/j.ejmech.2020.113124 10.7270/Q2SJ1Q8X 33395623 Erdogan, M; Kilic, B; Sagkan, RI; Aksakal, F; Ercetin, T; Gulcan, HO; Dogruer, DS Gazi University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50557142 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50557142&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162676421 461695910 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51377755 Cn1c2ccc(NC(=O)CCN3CCC(CC3)c3ccccc3)cc2sc1=O InChI=1S/C22H25N3O2S/c1-24-19-8-7-18(15-20(19)28-22(24)27)23-21(26)11-14-25-12-9-17(10-13-25)16-5-3-2-4-6-16/h2-8,15,17H,9-14H2,1H3,(H,23,26) YUAYWEFHGSCEGY-UHFFFAOYSA-N 50557143 CHEMBL4742967 Cholinesterase 11140 ChEMBL 10.1016/j.ejmech.2020.113124 10.7270/Q2SJ1Q8X 33395623 Erdogan, M; Kilic, B; Sagkan, RI; Aksakal, F; Ercetin, T; Gulcan, HO; Dogruer, DS Gazi University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50557143 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50557143&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162646273 461695911 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51377756 Cn1c2ccc(NC(=O)CCN3CCC(Cc4ccccc4)CC3)cc2sc1=O InChI=1S/C23H27N3O2S/c1-25-20-8-7-19(16-21(20)29-23(25)28)24-22(27)11-14-26-12-9-18(10-13-26)15-17-5-3-2-4-6-17/h2-8,16,18H,9-15H2,1H3,(H,24,27) CNUHEAXHZCDVLC-UHFFFAOYSA-N 50557144 CHEMBL4758816 Cholinesterase 75380 ChEMBL 10.1016/j.ejmech.2020.113124 10.7270/Q2SJ1Q8X 33395623 Erdogan, M; Kilic, B; Sagkan, RI; Aksakal, F; Ercetin, T; Gulcan, HO; Dogruer, DS Gazi University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50557144 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50557144&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162657442 461695912 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51377757 CN(CCC(=O)Nc1ccc2n(C)c(=O)sc2c1)Cc1ccccc1 InChI=1S/C19H21N3O2S/c1-21(13-14-6-4-3-5-7-14)11-10-18(23)20-15-8-9-16-17(12-15)25-19(24)22(16)2/h3-9,12H,10-11,13H2,1-2H3,(H,20,23) RQIPACZSSLDZKC-UHFFFAOYSA-N 50557145 CHEMBL4763568 Cholinesterase 41960 ChEMBL 10.1016/j.ejmech.2020.113124 10.7270/Q2SJ1Q8X 33395623 Erdogan, M; Kilic, B; Sagkan, RI; Aksakal, F; Ercetin, T; Gulcan, HO; Dogruer, DS Gazi University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50557145 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50557145&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162660894 461695913 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51377758 Cn1c2ccc(NC(=O)CCCN3CCC(CC3)c3ccccc3)cc2sc1=O InChI=1S/C23H27N3O2S/c1-25-20-10-9-19(16-21(20)29-23(25)28)24-22(27)8-5-13-26-14-11-18(12-15-26)17-6-3-2-4-7-17/h2-4,6-7,9-10,16,18H,5,8,11-15H2,1H3,(H,24,27) QLXWHINWXLLZDU-UHFFFAOYSA-N 50557153 CHEMBL4757588 Cholinesterase 9650 ChEMBL 10.1016/j.ejmech.2020.113124 10.7270/Q2SJ1Q8X 33395623 Erdogan, M; Kilic, B; Sagkan, RI; Aksakal, F; Ercetin, T; Gulcan, HO; Dogruer, DS Gazi University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50557153 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50557153&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162656365 461695921 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51377759 Cn1c2ccc(NC(=O)CCCCN3CCC(CC3)c3ccccc3)cc2sc1=O InChI=1S/C24H29N3O2S/c1-26-21-11-10-20(17-22(21)30-24(26)29)25-23(28)9-5-6-14-27-15-12-19(13-16-27)18-7-3-2-4-8-18/h2-4,7-8,10-11,17,19H,5-6,9,12-16H2,1H3,(H,25,28) FYJFGLBOOSWANX-UHFFFAOYSA-N 50557154 CHEMBL4760122 Cholinesterase 2980 ChEMBL 10.1016/j.ejmech.2020.113124 10.7270/Q2SJ1Q8X 33395623 Erdogan, M; Kilic, B; Sagkan, RI; Aksakal, F; Ercetin, T; Gulcan, HO; Dogruer, DS Gazi University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50557154 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50557154&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162658298 461695922 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51377760 Cn1c2ccc(cc2sc1=O)C(=O)CCN1CCC(CC1)c1ccccc1 InChI=1S/C22H24N2O2S/c1-23-19-8-7-18(15-21(19)27-22(23)26)20(25)11-14-24-12-9-17(10-13-24)16-5-3-2-4-6-16/h2-8,15,17H,9-14H2,1H3 PELFIHBSIDDGNZ-UHFFFAOYSA-N 50557152 CHEMBL4745840 Cholinesterase 13970 ChEMBL 10.1016/j.ejmech.2020.113124 10.7270/Q2SJ1Q8X 33395623 Erdogan, M; Kilic, B; Sagkan, RI; Aksakal, F; Ercetin, T; Gulcan, HO; Dogruer, DS Gazi University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50557152 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50557152&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162648186 461695920 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51377761 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 3550 ChEMBL 10.1016/j.ejmech.2020.113124 10.7270/Q2SJ1Q8X 33395623 Erdogan, M; Kilic, B; Sagkan, RI; Aksakal, F; Ercetin, T; Gulcan, HO; Dogruer, DS Gazi University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51351333 COc1cc(CNCCCCN2C(=O)c3cccc4cccc(C2=O)c34)ccc1O InChI=1S/C24H24N2O4/c1-30-21-14-16(10-11-20(21)27)15-25-12-2-3-13-26-23(28)18-8-4-6-17-7-5-9-19(22(17)18)24(26)29/h4-11,14,25,27H,2-3,12-13,15H2,1H3 CLRJYSFMIAITSV-UHFFFAOYSA-N 50546613 CHEMBL4742047 Cholinesterase 900 ChEMBL 10.1016/j.bmcl.2020.127505 10.7270/Q24171NS 32822761 Blaikie, L; Blaikie, L; Kay, G; Kay, G; Kong Thoo Lin, P; Kong Thoo Lin, P Robert Gordon University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50546613 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50546613&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162646528 461690376 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51351334 COc1cc(CNCCCCCCCN2C(=O)c3cccc4cccc(C2=O)c34)ccc1O InChI=1S/C27H30N2O4/c1-33-24-17-19(13-14-23(24)30)18-28-15-5-3-2-4-6-16-29-26(31)21-11-7-9-20-10-8-12-22(25(20)21)27(29)32/h7-14,17,28,30H,2-6,15-16,18H2,1H3 RGXUVVCWMGIKNT-UHFFFAOYSA-N 50546614 CHEMBL4778539 Cholinesterase 1500 ChEMBL 10.1016/j.bmcl.2020.127505 10.7270/Q24171NS 32822761 Blaikie, L; Blaikie, L; Kay, G; Kay, G; Kong Thoo Lin, P; Kong Thoo Lin, P Robert Gordon University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50546614 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50546614&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162661969 461690377 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51351335 COc1cc(CN(CCCN2C(=O)c3cccc4cccc(C2=O)c34)Cc2ccc(O)c(OC)c2)ccc1O InChI=1S/C31H30N2O6/c1-38-27-16-20(10-12-25(27)34)18-32(19-21-11-13-26(35)28(17-21)39-2)14-5-15-33-30(36)23-8-3-6-22-7-4-9-24(29(22)23)31(33)37/h3-4,6-13,16-17,34-35H,5,14-15,18-19H2,1-2H3 VBJXVRAUDLCCKR-UHFFFAOYSA-N 50546615 CHEMBL4750099 Cholinesterase 270 ChEMBL 10.1016/j.bmcl.2020.127505 10.7270/Q24171NS 32822761 Blaikie, L; Blaikie, L; Kay, G; Kay, G; Kong Thoo Lin, P; Kong Thoo Lin, P Robert Gordon University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50546615 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50546615&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162652068 461690378 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51351336 COc1cc(CNCCCCCCN2C(=O)c3ccccc3C2=O)ccc1O InChI=1S/C22H26N2O4/c1-28-20-14-16(10-11-19(20)25)15-23-12-6-2-3-7-13-24-21(26)17-8-4-5-9-18(17)22(24)27/h4-5,8-11,14,23,25H,2-3,6-7,12-13,15H2,1H3 NJJXTCJVKOCPOK-UHFFFAOYSA-N 50546616 CHEMBL4800008 Cholinesterase 370 ChEMBL 10.1016/j.bmcl.2020.127505 10.7270/Q24171NS 32822761 Blaikie, L; Blaikie, L; Kay, G; Kay, G; Kong Thoo Lin, P; Kong Thoo Lin, P Robert Gordon University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50546616 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50546616&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162676864 461690379 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51351337 CN(C)C(=O)Oc1cccc(c1)[N+](C)(C)C InChI=1S/C12H19N2O2/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5/h6-9H,1-5H3/q+1 ALWKGYPQUAPLQC-UHFFFAOYSA-N 50022775 (m-Hydroxyphenyl)trimethylammonium dimethylcarbamate::3-Trimethylammoniumphenyl N,N-dimethylcarbamate::3-[(dimethylcarbamoyl)oxy]-N,N,N-trimethylanilinium::CHEMBL211471::CHEMBL278020::Eustigmin::Eustigmine::NEOSTIGMINE::Neostigmine (2)::Prostigmine::Vagostigmine::m-Trimethylammoniumphenyldimethylcarbamate Cholinesterase 2930 ChEMBL 10.1016/j.bmcl.2020.127505 10.7270/Q24171NS 32822761 Blaikie, L; Blaikie, L; Kay, G; Kay, G; Kong Thoo Lin, P; Kong Thoo Lin, P Robert Gordon University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50022775 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50022775&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 4456 103933337 7514 CHEMBL278020CHEMBL211471 DB01400 C08200 ZINC00001792 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51387497 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 8416 ChEMBL 10.1016/j.bmcl.2020.127477 10.7270/Q2W099MW 32781220 Singh, A; Sharma, S; Arora, S; Attri, S; Kaur, P; Kaur Gulati, H; Bhagat, K; Kumar, N; Singh, H; Vir Singh, J; Mohinder Singh Bedi, P Guru Nanak Dev University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51366974 COc1cc(ccc1O)C(=O)N\N=C\c1ccccc1OC(=O)N(C)C InChI=1S/C18H19N3O5/c1-21(2)18(24)26-15-7-5-4-6-13(15)11-19-20-17(23)12-8-9-14(22)16(10-12)25-3/h4-11,22H,1-3H3,(H,20,23)/b19-11+ FTDJFOKFNKIETA-YBFXNURJSA-N 50552595 CHEMBL4761984 Cholinesterase 97000 ChEMBL 10.1016/j.bmc.2020.115991 10.7270/Q29W0K3R 33440318 Yamazaki, DAS; Rozada, AMF; Baréa, P; Reis, EC; Basso, EA; Sarragiotto, MH; Seixas, FAV; Gauze, GF State University of Maring£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50552595 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50552595&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162660783 461682935 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373839 Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F InChI=1S/C12H11FN2O3S/c1-8-9-6-7-19(16,17)18-12(9)15(14-8)11-5-3-2-4-10(11)13/h2-5H,6-7H2,1H3 SMSFRYXCFRZWAE-UHFFFAOYSA-N 50528684 CHEMBL4560302 Cholinesterase 1190 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528684 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528684&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155558388 440737266 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373840 Clc1ccccc1-n1nc(C2CC2)c2CCS(=O)(=O)Oc12 InChI=1S/C14H13ClN2O3S/c15-11-3-1-2-4-12(11)17-14-10(7-8-21(18,19)20-14)13(16-17)9-5-6-9/h1-4,9H,5-8H2 JZQFFOXOJONFBB-UHFFFAOYSA-N 50555623 CHEMBL4764930 Cholinesterase 180 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555623 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555623&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162662119 461694391 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373841 Clc1cccc(c1)-n1nc(C2CC2)c2CCS(=O)(=O)Oc12 InChI=1S/C14H13ClN2O3S/c15-10-2-1-3-11(8-10)17-14-12(6-7-21(18,19)20-14)13(16-17)9-4-5-9/h1-3,8-9H,4-7H2 STLYXQDWVKOWNJ-UHFFFAOYSA-N 50555624 CHEMBL4762725 Cholinesterase 700 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555624 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555624&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162660361 461694392 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373842 Fc1ccccc1-n1nc(C2CC2)c2CCS(=O)(=O)Oc12 InChI=1S/C14H13FN2O3S/c15-11-3-1-2-4-12(11)17-14-10(7-8-21(18,19)20-14)13(16-17)9-5-6-9/h1-4,9H,5-8H2 CTMADYVHIUYPPF-UHFFFAOYSA-N 50528685 CHEMBL4457213 Cholinesterase 140 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50528685 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50528685&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 154722373 440737267 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373843 Fc1cccc(c1)-n1nc(C2CC2)c2CCS(=O)(=O)Oc12 InChI=1S/C14H13FN2O3S/c15-10-2-1-3-11(8-10)17-14-12(6-7-21(18,19)20-14)13(16-17)9-4-5-9/h1-3,8-9H,4-7H2 GQDBAXHVJMCUAQ-UHFFFAOYSA-N 50555625 CHEMBL4795377 Cholinesterase 370 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555625 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555625&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162674216 461694393 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373844 Fc1ccccc1-n1nc(c2CCS(=O)(=O)Oc12)-c1ccccc1 InChI=1S/C17H13FN2O3S/c18-14-8-4-5-9-15(14)20-17-13(10-11-24(21,22)23-17)16(19-20)12-6-2-1-3-7-12/h1-9H,10-11H2 WQUZYYQVUDVMGT-UHFFFAOYSA-N 50555626 CHEMBL4782632 Cholinesterase 180 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555626 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555626&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162664672 461694394 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373845 Fc1ccccc1-n1nc(c2CCS(=O)(=O)Oc12)-c1ccc(Cl)cc1 InChI=1S/C17H12ClFN2O3S/c18-12-7-5-11(6-8-12)16-13-9-10-25(22,23)24-17(13)21(20-16)15-4-2-1-3-14(15)19/h1-8H,9-10H2 MAAADEAUTPQGEF-UHFFFAOYSA-N 50555627 CHEMBL4754030 Cholinesterase 200 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555627 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555627&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162654921 461694395 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373846 Fc1ccccc1-n1nc(c2CCS(=O)(=O)Oc12)-c1ccc(Br)cc1 InChI=1S/C17H12BrFN2O3S/c18-12-7-5-11(6-8-12)16-13-9-10-25(22,23)24-17(13)21(20-16)15-4-2-1-3-14(15)19/h1-8H,9-10H2 CFVJQOQTZIWVJU-UHFFFAOYSA-N 50555628 CHEMBL4741324 Cholinesterase 470 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555628 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555628&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162647252 461694396 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373847 Fc1ccc(cc1)-c1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F InChI=1S/C17H12F2N2O3S/c18-12-7-5-11(6-8-12)16-13-9-10-25(22,23)24-17(13)21(20-16)15-4-2-1-3-14(15)19/h1-8H,9-10H2 MVEKEXSRIFDKNN-UHFFFAOYSA-N 50555629 CHEMBL4781184 Cholinesterase 160 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555629 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555629&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162663513 461694397 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373848 Clc1ccccc1-n1nc(c2CCS(=O)(=O)Oc12)-c1ccccc1 InChI=1S/C17H13ClN2O3S/c18-14-8-4-5-9-15(14)20-17-13(10-11-24(21,22)23-17)16(19-20)12-6-2-1-3-7-12/h1-9H,10-11H2 MNGDYFQEYGSSRJ-UHFFFAOYSA-N 50555630 CHEMBL4798109 Cholinesterase 170 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555630 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555630&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162675551 461694398 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373849 Clc1ccc(cc1)-c1nn(c2OS(=O)(=O)CCc12)-c1ccccc1Cl InChI=1S/C17H12Cl2N2O3S/c18-12-7-5-11(6-8-12)16-13-9-10-25(22,23)24-17(13)21(20-16)15-4-2-1-3-14(15)19/h1-8H,9-10H2 HSTQNKLEDZNSKG-UHFFFAOYSA-N 50555631 CHEMBL4800048 Cholinesterase 1580 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555631 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555631&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162677113 461694399 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373850 Clc1ccccc1-n1nc(c2CCS(=O)(=O)Oc12)-c1ccc(Br)cc1 InChI=1S/C17H12BrClN2O3S/c18-12-7-5-11(6-8-12)16-13-9-10-25(22,23)24-17(13)21(20-16)15-4-2-1-3-14(15)19/h1-8H,9-10H2 ZVHZMRQFNLLMBL-UHFFFAOYSA-N 50555632 CHEMBL4800191 Cholinesterase 3690 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555632 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555632&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162676708 461694400 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373851 Fc1ccc(cc1)-c1nn(c2OS(=O)(=O)CCc12)-c1ccccc1Cl InChI=1S/C17H12ClFN2O3S/c18-14-3-1-2-4-15(14)21-17-13(9-10-25(22,23)24-17)16(20-21)11-5-7-12(19)8-6-11/h1-8H,9-10H2 PNSPOGPXYRQPOQ-UHFFFAOYSA-N 50555633 CHEMBL4788705 Cholinesterase 130 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555633 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555633&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162670021 461694401 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373852 COc1ccc(cc1)-c1nn(c2OS(=O)(=O)CCc12)-c1ccc(Cl)cc1 InChI=1S/C18H15ClN2O4S/c1-24-15-8-2-12(3-9-15)17-16-10-11-26(22,23)25-18(16)21(20-17)14-6-4-13(19)5-7-14/h2-9H,10-11H2,1H3 DMOATKAKQABMEU-UHFFFAOYSA-N 50555634 CHEMBL4752077 Cholinesterase 8780 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555634 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555634&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162652850 461694402 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373853 ClCc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1Cl InChI=1S/C12H10Cl2N2O3S/c13-7-10-8-5-6-20(17,18)19-12(8)16(15-10)11-4-2-1-3-9(11)14/h1-4H,5-7H2 ZXXPHLTUKKCBPA-UHFFFAOYSA-N 50555635 CHEMBL4746233 Cholinesterase 200 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555635 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555635&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162647875 461694403 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373854 CN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1Cl)Cc1ccccc1 InChI=1S/C20H20ClN3O3S/c1-23(13-15-7-3-2-4-8-15)14-18-16-11-12-28(25,26)27-20(16)24(22-18)19-10-6-5-9-17(19)21/h2-10H,11-14H2,1H3 UZQLIPUTSWSTGN-UHFFFAOYSA-N 50555636 CHEMBL4779234 Cholinesterase 70 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555636 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555636&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162663659 461694404 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373855 CCN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1Cl)Cc1ccccc1 InChI=1S/C21H22ClN3O3S/c1-2-24(14-16-8-4-3-5-9-16)15-19-17-12-13-29(26,27)28-21(17)25(23-19)20-11-7-6-10-18(20)22/h3-11H,2,12-15H2,1H3 TYTYSVZBBUJYQY-UHFFFAOYSA-N 50555637 CHEMBL4759540 Cholinesterase 50 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555637 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555637&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162658511 461694405 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373856 OCCN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1Cl)Cc1ccccc1 InChI=1S/C21H22ClN3O4S/c22-18-8-4-5-9-20(18)25-21-17(10-13-30(27,28)29-21)19(23-25)15-24(11-12-26)14-16-6-2-1-3-7-16/h1-9,26H,10-15H2 ZNSMTINFLNFPNK-UHFFFAOYSA-N 50555638 CHEMBL4757326 Cholinesterase 40 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555638 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555638&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162657192 461694406 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373857 Clc1ccccc1-n1nc(CN2CCOCC2)c2CCS(=O)(=O)Oc12 InChI=1S/C16H18ClN3O4S/c17-13-3-1-2-4-15(13)20-16-12(5-10-25(21,22)24-16)14(18-20)11-19-6-8-23-9-7-19/h1-4H,5-11H2 XNGXTPIXENFXAO-UHFFFAOYSA-N 50555639 CHEMBL4795386 Cholinesterase 410 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555639 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555639&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162674221 461694407 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373858 CN1CCN(Cc2nn(c3OS(=O)(=O)CCc23)-c2ccccc2Cl)CC1 InChI=1S/C17H21ClN4O3S/c1-20-7-9-21(10-8-20)12-15-13-6-11-26(23,24)25-17(13)22(19-15)16-5-3-2-4-14(16)18/h2-5H,6-12H2,1H3 CIZDFWVDSDUZHJ-UHFFFAOYSA-N 50555640 CHEMBL4796746 Cholinesterase 2220 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555640 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555640&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162676210 461694408 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373859 Clc1ccccc1-n1nc(CN2CCN(Cc3ccccc3)CC2)c2CCS(=O)(=O)Oc12 InChI=1S/C23H25ClN4O3S/c24-20-8-4-5-9-22(20)28-23-19(10-15-32(29,30)31-23)21(25-28)17-27-13-11-26(12-14-27)16-18-6-2-1-3-7-18/h1-9H,10-17H2 IUYSAOFVJWFWTA-UHFFFAOYSA-N 50555641 CHEMBL4740057 Cholinesterase 460 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555641 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555641&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162645187 461694409 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373860 Fc1ccccc1-n1nc(CCl)c2CCS(=O)(=O)Oc12 InChI=1S/C12H10ClFN2O3S/c13-7-10-8-5-6-20(17,18)19-12(8)16(15-10)11-4-2-1-3-9(11)14/h1-4H,5-7H2 YZOKOTIEWNUZJQ-UHFFFAOYSA-N 50555642 CHEMBL4741477 Cholinesterase 190 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555642 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555642&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162646787 461694410 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373861 CN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F)Cc1ccccc1 InChI=1S/C20H20FN3O3S/c1-23(13-15-7-3-2-4-8-15)14-18-16-11-12-28(25,26)27-20(16)24(22-18)19-10-6-5-9-17(19)21/h2-10H,11-14H2,1H3 JRBZYDRPQKZSJJ-UHFFFAOYSA-N 50555643 CHEMBL4742743 Cholinesterase 80 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555643 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555643&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162645795 461694411 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373862 CCN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F)Cc1ccccc1 InChI=1S/C21H22FN3O3S/c1-2-24(14-16-8-4-3-5-9-16)15-19-17-12-13-29(26,27)28-21(17)25(23-19)20-11-7-6-10-18(20)22/h3-11H,2,12-15H2,1H3 QMXNIIFLVVVJKU-UHFFFAOYSA-N 50555644 CHEMBL4776663 Cholinesterase 80 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555644 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555644&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162643002 461694412 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373863 OCCN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F)Cc1ccccc1 InChI=1S/C21H22FN3O4S/c22-18-8-4-5-9-20(18)25-21-17(10-13-30(27,28)29-21)19(23-25)15-24(11-12-26)14-16-6-2-1-3-7-16/h1-9,26H,10-15H2 BTOGWYRFXWZTSR-UHFFFAOYSA-N 50555645 CHEMBL4756580 Cholinesterase 40 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555645 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555645&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162655646 461694413 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373864 Fc1ccccc1-n1nc(CN2CCOCC2)c2CCS(=O)(=O)Oc12 InChI=1S/C16H18FN3O4S/c17-13-3-1-2-4-15(13)20-16-12(5-10-25(21,22)24-16)14(18-20)11-19-6-8-23-9-7-19/h1-4H,5-11H2 AIKVHTUDDVQXRO-UHFFFAOYSA-N 50555646 CHEMBL4747807 Cholinesterase 150 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555646 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555646&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162649965 461694414 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373865 CN1CCN(Cc2nn(c3OS(=O)(=O)CCc23)-c2ccccc2F)CC1 InChI=1S/C17H21FN4O3S/c1-20-7-9-21(10-8-20)12-15-13-6-11-26(23,24)25-17(13)22(19-15)16-5-3-2-4-14(16)18/h2-5H,6-12H2,1H3 OINAYCMMOLLZEK-UHFFFAOYSA-N 50555647 CHEMBL4755357 Cholinesterase 2170 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555647 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555647&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162655436 461694415 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373866 Fc1ccccc1-n1nc(CN2CCN(Cc3ccccc3)CC2)c2CCS(=O)(=O)Oc12 InChI=1S/C23H25FN4O3S/c24-20-8-4-5-9-22(20)28-23-19(10-15-32(29,30)31-23)21(25-28)17-27-13-11-26(12-14-27)16-18-6-2-1-3-7-18/h1-9H,10-17H2 SPJCOHGYSGMTCB-UHFFFAOYSA-N 50555648 CHEMBL4750029 Cholinesterase 680 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555648 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555648&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162651206 461694416 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373867 OCCN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F)Cc1cccc(F)c1 InChI=1S/C21H21F2N3O4S/c22-16-5-3-4-15(12-16)13-25(9-10-27)14-19-17-8-11-31(28,29)30-21(17)26(24-19)20-7-2-1-6-18(20)23/h1-7,12,27H,8-11,13-14H2 ZFTTXLGGLCKQRP-UHFFFAOYSA-N 50555649 CHEMBL4746503 Cholinesterase 90 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555649 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555649&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162648576 461694417 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373868 OCCN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F)Cc1cccc(Cl)c1 InChI=1S/C21H21ClFN3O4S/c22-16-5-3-4-15(12-16)13-25(9-10-27)14-19-17-8-11-31(28,29)30-21(17)26(24-19)20-7-2-1-6-18(20)23/h1-7,12,27H,8-11,13-14H2 CYXHGAPIGNTYPM-UHFFFAOYSA-N 50555650 CHEMBL4780962 Cholinesterase 190 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555650 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555650&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162663217 461694418 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373869 OCCN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F)Cc1cccc(Br)c1 InChI=1S/C21H21BrFN3O4S/c22-16-5-3-4-15(12-16)13-25(9-10-27)14-19-17-8-11-31(28,29)30-21(17)26(24-19)20-7-2-1-6-18(20)23/h1-7,12,27H,8-11,13-14H2 OXAPJBUIGHOMLS-UHFFFAOYSA-N 50555651 CHEMBL4783120 Cholinesterase 330 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555651 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555651&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162664895 461694419 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373870 OCCN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F)Cc1ccc(F)cc1 InChI=1S/C21H21F2N3O4S/c22-16-7-5-15(6-8-16)13-25(10-11-27)14-19-17-9-12-31(28,29)30-21(17)26(24-19)20-4-2-1-3-18(20)23/h1-8,27H,9-14H2 NXNQFAFCHYMMPB-UHFFFAOYSA-N 50555652 CHEMBL4781328 Cholinesterase 8.3 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555652 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555652&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162664213 461694420 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373871 OCCN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F)Cc1ccc(Cl)cc1 InChI=1S/C21H21ClFN3O4S/c22-16-7-5-15(6-8-16)13-25(10-11-27)14-19-17-9-12-31(28,29)30-21(17)26(24-19)20-4-2-1-3-18(20)23/h1-8,27H,9-14H2 WQDXBPRPNLMJHX-UHFFFAOYSA-N 50555653 CHEMBL4784647 Cholinesterase 90 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555653 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555653&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162665707 461694421 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373872 OCCN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F)Cc1ccc(Br)cc1 InChI=1S/C21H21BrFN3O4S/c22-16-7-5-15(6-8-16)13-25(10-11-27)14-19-17-9-12-31(28,29)30-21(17)26(24-19)20-4-2-1-3-18(20)23/h1-8,27H,9-14H2 LDIVPSYYUOVSCS-UHFFFAOYSA-N 50555654 CHEMBL4797435 Cholinesterase 7.7 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555654 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555654&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162674713 461694422 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373873 OCCN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F)Cc1ccc(Cl)cc1Cl InChI=1S/C21H20Cl2FN3O4S/c22-15-6-5-14(17(23)11-15)12-26(8-9-28)13-19-16-7-10-32(29,30)31-21(16)27(25-19)20-4-2-1-3-18(20)24/h1-6,11,28H,7-10,12-13H2 LUXFCYIXVWEFGP-UHFFFAOYSA-N 50555655 CHEMBL4761517 Cholinesterase 90 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555655 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555655&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162659042 461694423 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373874 Cc1ccc(CN(CCO)Cc2nn(c3OS(=O)(=O)CCc23)-c2ccccc2F)cc1 InChI=1S/C22H24FN3O4S/c1-16-6-8-17(9-7-16)14-25(11-12-27)15-20-18-10-13-31(28,29)30-22(18)26(24-20)21-5-3-2-4-19(21)23/h2-9,27H,10-15H2,1H3 KJYHYIOLTGJNSN-UHFFFAOYSA-N 50555656 CHEMBL4791928 Cholinesterase 170 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555656 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555656&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162671808 461694424 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373875 COc1ccc(CN(CCO)Cc2nn(c3OS(=O)(=O)CCc23)-c2ccccc2F)cc1 InChI=1S/C22H24FN3O5S/c1-30-17-8-6-16(7-9-17)14-25(11-12-27)15-20-18-10-13-32(28,29)31-22(18)26(24-20)21-5-3-2-4-19(21)23/h2-9,27H,10-15H2,1H3 WUOBNYGVOXGOTE-UHFFFAOYSA-N 50555657 CHEMBL4787079 Cholinesterase 260 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555657 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555657&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162667520 461694425 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373876 COc1ccc(CN(CCO)Cc2nn(c3OS(=O)(=O)CCc23)-c2ccccc2F)cc1OC InChI=1S/C23H26FN3O6S/c1-31-21-8-7-16(13-22(21)32-2)14-26(10-11-28)15-19-17-9-12-34(29,30)33-23(17)27(25-19)20-6-4-3-5-18(20)24/h3-8,13,28H,9-12,14-15H2,1-2H3 YQCVJMLIVRXMNP-UHFFFAOYSA-N 50555658 CHEMBL4760032 Cholinesterase 560 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555658 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555658&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162657392 461694426 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373877 COCCN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F)Cc1ccccc1 InChI=1S/C22H24FN3O4S/c1-29-13-12-25(15-17-7-3-2-4-8-17)16-20-18-11-14-31(27,28)30-22(18)26(24-20)21-10-6-5-9-19(21)23/h2-10H,11-16H2,1H3 PXTVUKIHDJAWDX-UHFFFAOYSA-N 50555659 CHEMBL4749622 Cholinesterase 240 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555659 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555659&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162650869 461694427 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373878 COCCN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F)Cc1ccc(F)cc1 InChI=1S/C22H23F2N3O4S/c1-30-12-11-26(14-16-6-8-17(23)9-7-16)15-20-18-10-13-32(28,29)31-22(18)27(25-20)21-5-3-2-4-19(21)24/h2-9H,10-15H2,1H3 JWKBVGYXJYCAQN-UHFFFAOYSA-N 50555660 CHEMBL4764576 Cholinesterase 110 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555660 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555660&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162660815 461694428 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373879 COCCN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F)Cc1ccc(Cl)cc1 InChI=1S/C22H23ClFN3O4S/c1-30-12-11-26(14-16-6-8-17(23)9-7-16)15-20-18-10-13-32(28,29)31-22(18)27(25-20)21-5-3-2-4-19(21)24/h2-9H,10-15H2,1H3 ORDCYTDJLWGOLJ-UHFFFAOYSA-N 50555661 CHEMBL4786037 Cholinesterase 90 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555661 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555661&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162667008 461694429 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373880 COCCN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F)Cc1ccc(Br)cc1 InChI=1S/C22H23BrFN3O4S/c1-30-12-11-26(14-16-6-8-17(23)9-7-16)15-20-18-10-13-32(28,29)31-22(18)27(25-20)21-5-3-2-4-19(21)24/h2-9H,10-15H2,1H3 XBQLVWBPACEYFY-UHFFFAOYSA-N 50555662 CHEMBL4748616 Cholinesterase 150 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555662 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555662&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162649572 461694430 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373881 CCN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F)Cc1ccc(F)cc1 InChI=1S/C21H21F2N3O3S/c1-2-25(13-15-7-9-16(22)10-8-15)14-19-17-11-12-30(27,28)29-21(17)26(24-19)20-6-4-3-5-18(20)23/h3-10H,2,11-14H2,1H3 QUOBNSOOJGVMTA-UHFFFAOYSA-N 50555663 CHEMBL4741858 Cholinesterase 70 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555663 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555663&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162646243 461694431 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373882 CCN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F)Cc1ccc(Cl)cc1 InChI=1S/C21H21ClFN3O3S/c1-2-25(13-15-7-9-16(22)10-8-15)14-19-17-11-12-30(27,28)29-21(17)26(24-19)20-6-4-3-5-18(20)23/h3-10H,2,11-14H2,1H3 AFRQOBLZFLKYFD-UHFFFAOYSA-N 50555664 CHEMBL4761581 Cholinesterase 40 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555664 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555664&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162659619 461694432 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373883 CCN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F)Cc1ccc(Br)cc1 InChI=1S/C21H21BrFN3O3S/c1-2-25(13-15-7-9-16(22)10-8-15)14-19-17-11-12-30(27,28)29-21(17)26(24-19)20-6-4-3-5-18(20)23/h3-10H,2,11-14H2,1H3 ISTWNTPERXHWQY-UHFFFAOYSA-N 50555665 CHEMBL4778650 Cholinesterase 70 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555665 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555665&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162662137 461694433 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373884 CN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F)Cc1ccc(F)cc1 InChI=1S/C20H19F2N3O3S/c1-24(12-14-6-8-15(21)9-7-14)13-18-16-10-11-29(26,27)28-20(16)25(23-18)19-5-3-2-4-17(19)22/h2-9H,10-13H2,1H3 PIHVTRWHCPBZTE-UHFFFAOYSA-N 50555666 CHEMBL4742141 Cholinesterase 40 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555666 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555666&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162647430 461694434 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373885 CN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F)Cc1ccc(Cl)cc1 InChI=1S/C20H19ClFN3O3S/c1-24(12-14-6-8-15(21)9-7-14)13-18-16-10-11-29(26,27)28-20(16)25(23-18)19-5-3-2-4-17(19)22/h2-9H,10-13H2,1H3 MBGREMWHRQNNRZ-UHFFFAOYSA-N 50555667 CHEMBL4759071 Cholinesterase 20 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555667 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555667&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162658836 461694435 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373886 CN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F)Cc1ccc(Br)cc1 InChI=1S/C20H19BrFN3O3S/c1-24(12-14-6-8-15(21)9-7-14)13-18-16-10-11-29(26,27)28-20(16)25(23-18)19-5-3-2-4-17(19)22/h2-9H,10-13H2,1H3 CFZSBPCCAYDQKB-UHFFFAOYSA-N 50555668 CHEMBL4776289 Cholinesterase 70 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555668 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555668&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162643060 461694436 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373887 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 10380 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373888 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 11682 2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::Rivastigmine.tartrate::US9586925, Rivastigmine Cholinesterase 560 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=11682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=11682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46512204 DB00989 C11766 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51373889 OCCN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F)Cc1ccc(Br)cc1 InChI=1S/C21H21BrFN3O4S/c22-16-7-5-15(6-8-16)13-25(10-11-27)14-19-17-9-12-31(28,29)30-21(17)26(24-19)20-4-2-1-3-18(20)23/h1-8,27H,9-14H2 LDIVPSYYUOVSCS-UHFFFAOYSA-N 50555654 CHEMBL4797435 Cholinesterase 24 ChEMBL 10.1016/j.ejmech.2020.112273 10.7270/Q2T157BP 32569925 Zhang, Z; Min, J; Chen, M; Jiang, X; Xu, Y; Qin, H; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50555654 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50555654&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162674713 461694422 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51370991 COc1ccc(cc1)-c1cc(C(=O)N2CCN(Cc3ccccc3)CC2)c2ccccc2n1 InChI=1S/C28H27N3O2/c1-33-23-13-11-22(12-14-23)27-19-25(24-9-5-6-10-26(24)29-27)28(32)31-17-15-30(16-18-31)20-21-7-3-2-4-8-21/h2-14,19H,15-18,20H2,1H3 GAGZEGAZKAPJPQ-UHFFFAOYSA-N 50554314 CHEMBL4764997 Cholinesterase 3300 ChEMBL 10.1016/j.bmcl.2020.127609 10.7270/Q23R0XH1 33039562 Miles, JA; Kapure, JS; Deora, GS; Courageux, C; Igert, A; Dias, J; McGeary, RP; Brazzolotto, X; Ross, BP The University of Queensland http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50554314 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50554314&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1292876 461693082 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51370992 COc1ccccc1C1CCN(Cc2c(C)[nH]c3ccccc23)CC1 InChI=1S/C22H26N2O/c1-16-20(19-8-3-5-9-21(19)23-16)15-24-13-11-17(12-14-24)18-7-4-6-10-22(18)25-2/h3-10,17,23H,11-15H2,1-2H3 LIHDAALNSWSNQF-UHFFFAOYSA-N 50554315 CHEMBL1728093 Cholinesterase 12300 ChEMBL 10.1016/j.bmcl.2020.127609 10.7270/Q23R0XH1 33039562 Miles, JA; Kapure, JS; Deora, GS; Courageux, C; Igert, A; Dias, J; McGeary, RP; Brazzolotto, X; Ross, BP The University of Queensland http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50554315 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50554315&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 2813102 461693083 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51370993 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 30 ChEMBL 10.1016/j.bmcl.2020.127609 10.7270/Q23R0XH1 33039562 Miles, JA; Kapure, JS; Deora, GS; Courageux, C; Igert, A; Dias, J; McGeary, RP; Brazzolotto, X; Ross, BP The University of Queensland http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51370998 COc1ccc(cc1)-c1cc(C(=O)N2CCN(Cc3ccccc3)CC2)c2ccccc2n1 InChI=1S/C28H27N3O2/c1-33-23-13-11-22(12-14-23)27-19-25(24-9-5-6-10-26(24)29-27)28(32)31-17-15-30(16-18-31)20-21-7-3-2-4-8-21/h2-14,19H,15-18,20H2,1H3 GAGZEGAZKAPJPQ-UHFFFAOYSA-N 50554314 CHEMBL4764997 Cholinesterase 5200 ChEMBL 10.1016/j.bmcl.2020.127609 10.7270/Q23R0XH1 33039562 Miles, JA; Kapure, JS; Deora, GS; Courageux, C; Igert, A; Dias, J; McGeary, RP; Brazzolotto, X; Ross, BP The University of Queensland http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50554314 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50554314&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1292876 461693082 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375391 C(COc1ccc2N=C3CCCN3Cc2c1)CN1CCCCC1 InChI=1S/C19H27N3O/c1-2-9-21(10-3-1)11-5-13-23-17-7-8-18-16(14-17)15-22-12-4-6-19(22)20-18/h7-8,14H,1-6,9-13,15H2 UVYNECUSQBZMSD-UHFFFAOYSA-N 50053435 CHEMBL3323035 Cholinesterase 8200 ChEMBL 10.1016/j.ejmech.2020.112743 10.7270/Q2P272S9 32882609 Łażewska, D; Bajda, M; Kaleta, M; Zaręba, P; Doroz-Płonka, A; Siwek, A; Alachkar, A; Mogilski, S; Saad, A; Kuder, K; Olejarz-Maciej, A; Godyń, J; Stary, D; Sudoł, S; Więcek, M; Latacz, G; Walczak, M; Handzlik, J; Sadek, B; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053435 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053435&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710487 103950116 CHEMBL3323035 ZINC03815717 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375440 O=c1c2ccccc2oc2ccc(OCCCCCN3CCCCC3)cc12 InChI=1S/C23H27NO3/c25-23-19-9-3-4-10-21(19)27-22-12-11-18(17-20(22)23)26-16-8-2-7-15-24-13-5-1-6-14-24/h3-4,9-12,17H,1-2,5-8,13-16H2 HIDZMCKONDQZSV-UHFFFAOYSA-N 50556113 CHEMBL4750579 Cholinesterase 2540 ChEMBL 10.1016/j.ejmech.2020.112743 10.7270/Q2P272S9 32882609 Łażewska, D; Bajda, M; Kaleta, M; Zaręba, P; Doroz-Płonka, A; Siwek, A; Alachkar, A; Mogilski, S; Saad, A; Kuder, K; Olejarz-Maciej, A; Godyń, J; Stary, D; Sudoł, S; Więcek, M; Latacz, G; Walczak, M; Handzlik, J; Sadek, B; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556113 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556113&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155816352 461694881 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375441 Clc1ccc2oc3ccc(OCCCCCN4CCCCC4)cc3c(=O)c2c1 InChI=1S/C23H26ClNO3/c24-17-7-9-21-19(15-17)23(26)20-16-18(8-10-22(20)28-21)27-14-6-2-5-13-25-11-3-1-4-12-25/h7-10,15-16H,1-6,11-14H2 AQIRLJIMBMOXCB-UHFFFAOYSA-N 50556114 CHEMBL4798732 Cholinesterase 983 ChEMBL 10.1016/j.ejmech.2020.112743 10.7270/Q2P272S9 32882609 Łażewska, D; Bajda, M; Kaleta, M; Zaręba, P; Doroz-Płonka, A; Siwek, A; Alachkar, A; Mogilski, S; Saad, A; Kuder, K; Olejarz-Maciej, A; Godyń, J; Stary, D; Sudoł, S; Więcek, M; Latacz, G; Walczak, M; Handzlik, J; Sadek, B; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556114 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556114&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155817149 461694882 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375442 O=c1c2ccccc2oc2ccc(OCCCCCCN3CCCCC3)cc12 InChI=1S/C24H29NO3/c26-24-20-10-4-5-11-22(20)28-23-13-12-19(18-21(23)24)27-17-9-2-1-6-14-25-15-7-3-8-16-25/h4-5,10-13,18H,1-3,6-9,14-17H2 WUPGEKBATJPINO-UHFFFAOYSA-N 50556115 CHEMBL4794003 Cholinesterase 2000 ChEMBL 10.1016/j.ejmech.2020.112743 10.7270/Q2P272S9 32882609 Łażewska, D; Bajda, M; Kaleta, M; Zaręba, P; Doroz-Płonka, A; Siwek, A; Alachkar, A; Mogilski, S; Saad, A; Kuder, K; Olejarz-Maciej, A; Godyń, J; Stary, D; Sudoł, S; Więcek, M; Latacz, G; Walczak, M; Handzlik, J; Sadek, B; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556115 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556115&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162672614 461694883 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375443 Clc1ccc2c(c1)oc1ccc(OCCCCCCN3CCCCC3)cc1c2=O InChI=1S/C24H28ClNO3/c25-18-8-10-20-23(16-18)29-22-11-9-19(17-21(22)24(20)27)28-15-7-2-1-4-12-26-13-5-3-6-14-26/h8-11,16-17H,1-7,12-15H2 QONNOXSQVWRKPP-UHFFFAOYSA-N 50556116 CHEMBL4797867 Cholinesterase 1983 ChEMBL 10.1016/j.ejmech.2020.112743 10.7270/Q2P272S9 32882609 Łażewska, D; Bajda, M; Kaleta, M; Zaręba, P; Doroz-Płonka, A; Siwek, A; Alachkar, A; Mogilski, S; Saad, A; Kuder, K; Olejarz-Maciej, A; Godyń, J; Stary, D; Sudoł, S; Więcek, M; Latacz, G; Walczak, M; Handzlik, J; Sadek, B; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556116 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556116&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162675540 461694884 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375444 Clc1ccc2oc3ccc(OCCCCCCN4CCCCC4)cc3c(=O)c2c1 InChI=1S/C24H28ClNO3/c25-18-8-10-22-20(16-18)24(27)21-17-19(9-11-23(21)29-22)28-15-7-2-1-4-12-26-13-5-3-6-14-26/h8-11,16-17H,1-7,12-15H2 OEDJVPWEONMVEJ-UHFFFAOYSA-N 50556117 CHEMBL4785098 Cholinesterase 954 ChEMBL 10.1016/j.ejmech.2020.112743 10.7270/Q2P272S9 32882609 Łażewska, D; Bajda, M; Kaleta, M; Zaręba, P; Doroz-Płonka, A; Siwek, A; Alachkar, A; Mogilski, S; Saad, A; Kuder, K; Olejarz-Maciej, A; Godyń, J; Stary, D; Sudoł, S; Więcek, M; Latacz, G; Walczak, M; Handzlik, J; Sadek, B; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556117 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556117&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155806244 461694885 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375445 CC1CCCN(CCCCCOc2ccc3oc4ccccc4c(=O)c3c2)C1 InChI=1S/C24H29NO3/c1-18-8-7-14-25(17-18)13-5-2-6-15-27-19-11-12-23-21(16-19)24(26)20-9-3-4-10-22(20)28-23/h3-4,9-12,16,18H,2,5-8,13-15,17H2,1H3 ULETXKLQEAYDAN-UHFFFAOYSA-N 50556118 CHEMBL4759463 Cholinesterase 978 ChEMBL 10.1016/j.ejmech.2020.112743 10.7270/Q2P272S9 32882609 Łażewska, D; Bajda, M; Kaleta, M; Zaręba, P; Doroz-Płonka, A; Siwek, A; Alachkar, A; Mogilski, S; Saad, A; Kuder, K; Olejarz-Maciej, A; Godyń, J; Stary, D; Sudoł, S; Więcek, M; Latacz, G; Walczak, M; Handzlik, J; Sadek, B; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556118 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556118&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155810596 461694886 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375446 CC1CCCN(CCCCCOc2ccc3oc4cc(Cl)ccc4c(=O)c3c2)C1 InChI=1S/C24H28ClNO3/c1-17-6-5-12-26(16-17)11-3-2-4-13-28-19-8-10-22-21(15-19)24(27)20-9-7-18(25)14-23(20)29-22/h7-10,14-15,17H,2-6,11-13,16H2,1H3 SSEQRAVSHBBQRH-UHFFFAOYSA-N 50556119 CHEMBL4757387 Cholinesterase 2829 ChEMBL 10.1016/j.ejmech.2020.112743 10.7270/Q2P272S9 32882609 Łażewska, D; Bajda, M; Kaleta, M; Zaręba, P; Doroz-Płonka, A; Siwek, A; Alachkar, A; Mogilski, S; Saad, A; Kuder, K; Olejarz-Maciej, A; Godyń, J; Stary, D; Sudoł, S; Więcek, M; Latacz, G; Walczak, M; Handzlik, J; Sadek, B; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556119 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556119&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162657215 461694887 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375447 CC1CCCN(CCCCCOc2ccc3oc4ccc(Cl)cc4c(=O)c3c2)C1 InChI=1S/C24H28ClNO3/c1-17-6-5-12-26(16-17)11-3-2-4-13-28-19-8-10-23-21(15-19)24(27)20-14-18(25)7-9-22(20)29-23/h7-10,14-15,17H,2-6,11-13,16H2,1H3 HGCSDFHPKCOZNX-UHFFFAOYSA-N 50556120 CHEMBL4784081 Cholinesterase 685 ChEMBL 10.1016/j.ejmech.2020.112743 10.7270/Q2P272S9 32882609 Łażewska, D; Bajda, M; Kaleta, M; Zaręba, P; Doroz-Płonka, A; Siwek, A; Alachkar, A; Mogilski, S; Saad, A; Kuder, K; Olejarz-Maciej, A; Godyń, J; Stary, D; Sudoł, S; Więcek, M; Latacz, G; Walczak, M; Handzlik, J; Sadek, B; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556120 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556120&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155813315 461694888 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375448 CC1CCCN(CCCCCCOc2ccc3oc4ccccc4c(=O)c3c2)C1 InChI=1S/C25H31NO3/c1-19-9-8-15-26(18-19)14-6-2-3-7-16-28-20-12-13-24-22(17-20)25(27)21-10-4-5-11-23(21)29-24/h4-5,10-13,17,19H,2-3,6-9,14-16,18H2,1H3 ORWWEFNRIIMKFU-UHFFFAOYSA-N 50556121 CHEMBL4796334 Cholinesterase 1150 ChEMBL 10.1016/j.ejmech.2020.112743 10.7270/Q2P272S9 32882609 Łażewska, D; Bajda, M; Kaleta, M; Zaręba, P; Doroz-Płonka, A; Siwek, A; Alachkar, A; Mogilski, S; Saad, A; Kuder, K; Olejarz-Maciej, A; Godyń, J; Stary, D; Sudoł, S; Więcek, M; Latacz, G; Walczak, M; Handzlik, J; Sadek, B; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556121 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556121&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162675909 461694889 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375449 CC1CCCN(CCCCCCOc2ccc3oc4cc(Cl)ccc4c(=O)c3c2)C1 InChI=1S/C25H30ClNO3/c1-18-7-6-13-27(17-18)12-4-2-3-5-14-29-20-9-11-23-22(16-20)25(28)21-10-8-19(26)15-24(21)30-23/h8-11,15-16,18H,2-7,12-14,17H2,1H3 PKMVAJLTTZJPKV-UHFFFAOYSA-N 50556122 CHEMBL4793206 Cholinesterase 2040 ChEMBL 10.1016/j.ejmech.2020.112743 10.7270/Q2P272S9 32882609 Łażewska, D; Bajda, M; Kaleta, M; Zaręba, P; Doroz-Płonka, A; Siwek, A; Alachkar, A; Mogilski, S; Saad, A; Kuder, K; Olejarz-Maciej, A; Godyń, J; Stary, D; Sudoł, S; Więcek, M; Latacz, G; Walczak, M; Handzlik, J; Sadek, B; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556122 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556122&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162672072 461694890 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375450 CC1CCCN(CCCCCCOc2ccc3oc4ccc(Cl)cc4c(=O)c3c2)C1 InChI=1S/C25H30ClNO3/c1-18-7-6-13-27(17-18)12-4-2-3-5-14-29-20-9-11-24-22(16-20)25(28)21-15-19(26)8-10-23(21)30-24/h8-11,15-16,18H,2-7,12-14,17H2,1H3 HAIDCJHWMODKNB-UHFFFAOYSA-N 50556123 CHEMBL4790939 Cholinesterase 1470 ChEMBL 10.1016/j.ejmech.2020.112743 10.7270/Q2P272S9 32882609 Łażewska, D; Bajda, M; Kaleta, M; Zaręba, P; Doroz-Płonka, A; Siwek, A; Alachkar, A; Mogilski, S; Saad, A; Kuder, K; Olejarz-Maciej, A; Godyń, J; Stary, D; Sudoł, S; Więcek, M; Latacz, G; Walczak, M; Handzlik, J; Sadek, B; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556123 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556123&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162670535 461694891 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375451 CC1CCN(CCCCCOc2ccc3oc4ccccc4c(=O)c3c2)CC1 InChI=1S/C24H29NO3/c1-18-11-14-25(15-12-18)13-5-2-6-16-27-19-9-10-23-21(17-19)24(26)20-7-3-4-8-22(20)28-23/h3-4,7-10,17-18H,2,5-6,11-16H2,1H3 HZLFIOGMLMGNKL-UHFFFAOYSA-N 50556124 CHEMBL4797681 Cholinesterase 1090 ChEMBL 10.1016/j.ejmech.2020.112743 10.7270/Q2P272S9 32882609 Łażewska, D; Bajda, M; Kaleta, M; Zaręba, P; Doroz-Płonka, A; Siwek, A; Alachkar, A; Mogilski, S; Saad, A; Kuder, K; Olejarz-Maciej, A; Godyń, J; Stary, D; Sudoł, S; Więcek, M; Latacz, G; Walczak, M; Handzlik, J; Sadek, B; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556124 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556124&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155816378 461694892 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375452 CC1CCN(CCCCCOc2ccc3oc4cc(Cl)ccc4c(=O)c3c2)CC1 InChI=1S/C24H28ClNO3/c1-17-9-12-26(13-10-17)11-3-2-4-14-28-19-6-8-22-21(16-19)24(27)20-7-5-18(25)15-23(20)29-22/h5-8,15-17H,2-4,9-14H2,1H3 KIAUCSPOPNRBJQ-UHFFFAOYSA-N 50556125 CHEMBL4784025 Cholinesterase 1610 ChEMBL 10.1016/j.ejmech.2020.112743 10.7270/Q2P272S9 32882609 Łażewska, D; Bajda, M; Kaleta, M; Zaręba, P; Doroz-Płonka, A; Siwek, A; Alachkar, A; Mogilski, S; Saad, A; Kuder, K; Olejarz-Maciej, A; Godyń, J; Stary, D; Sudoł, S; Więcek, M; Latacz, G; Walczak, M; Handzlik, J; Sadek, B; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556125 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556125&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155813470 461694893 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375453 CC1CCN(CCCCCOc2ccc3oc4ccc(Cl)cc4c(=O)c3c2)CC1 InChI=1S/C24H28ClNO3/c1-17-9-12-26(13-10-17)11-3-2-4-14-28-19-6-8-23-21(16-19)24(27)20-15-18(25)5-7-22(20)29-23/h5-8,15-17H,2-4,9-14H2,1H3 OQBDNCOEWGLQTE-UHFFFAOYSA-N 50556126 CHEMBL4786252 Cholinesterase 1100 ChEMBL 10.1016/j.ejmech.2020.112743 10.7270/Q2P272S9 32882609 Łażewska, D; Bajda, M; Kaleta, M; Zaręba, P; Doroz-Płonka, A; Siwek, A; Alachkar, A; Mogilski, S; Saad, A; Kuder, K; Olejarz-Maciej, A; Godyń, J; Stary, D; Sudoł, S; Więcek, M; Latacz, G; Walczak, M; Handzlik, J; Sadek, B; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556126 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556126&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155810966 461694894 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375454 CC1CCN(CCCCCCOc2ccc3oc4ccccc4c(=O)c3c2)CC1 InChI=1S/C25H31NO3/c1-19-12-15-26(16-13-19)14-6-2-3-7-17-28-20-10-11-24-22(18-20)25(27)21-8-4-5-9-23(21)29-24/h4-5,8-11,18-19H,2-3,6-7,12-17H2,1H3 IMIDSGXDTGNBGW-UHFFFAOYSA-N 50556127 CHEMBL4777210 Cholinesterase 965 ChEMBL 10.1016/j.ejmech.2020.112743 10.7270/Q2P272S9 32882609 Łażewska, D; Bajda, M; Kaleta, M; Zaręba, P; Doroz-Płonka, A; Siwek, A; Alachkar, A; Mogilski, S; Saad, A; Kuder, K; Olejarz-Maciej, A; Godyń, J; Stary, D; Sudoł, S; Więcek, M; Latacz, G; Walczak, M; Handzlik, J; Sadek, B; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556127 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556127&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162642956 461694895 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375455 CC1CCN(CCCCCCOc2ccc3oc4cc(Cl)ccc4c(=O)c3c2)CC1 InChI=1S/C25H30ClNO3/c1-18-10-13-27(14-11-18)12-4-2-3-5-15-29-20-7-9-23-22(17-20)25(28)21-8-6-19(26)16-24(21)30-23/h6-9,16-18H,2-5,10-15H2,1H3 DONNAKRKYALRDB-UHFFFAOYSA-N 50556128 CHEMBL4741039 Cholinesterase 1510 ChEMBL 10.1016/j.ejmech.2020.112743 10.7270/Q2P272S9 32882609 Łażewska, D; Bajda, M; Kaleta, M; Zaręba, P; Doroz-Płonka, A; Siwek, A; Alachkar, A; Mogilski, S; Saad, A; Kuder, K; Olejarz-Maciej, A; Godyń, J; Stary, D; Sudoł, S; Więcek, M; Latacz, G; Walczak, M; Handzlik, J; Sadek, B; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556128 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556128&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162645593 461694896 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375456 CC1CCN(CCCCCCOc2ccc3oc4ccc(Cl)cc4c(=O)c3c2)CC1 InChI=1S/C25H30ClNO3/c1-18-10-13-27(14-11-18)12-4-2-3-5-15-29-20-7-9-24-22(17-20)25(28)21-16-19(26)6-8-23(21)30-24/h6-9,16-18H,2-5,10-15H2,1H3 HRIXXYOKKMTERZ-UHFFFAOYSA-N 50556129 CHEMBL4784501 Cholinesterase 899 ChEMBL 10.1016/j.ejmech.2020.112743 10.7270/Q2P272S9 32882609 Łażewska, D; Bajda, M; Kaleta, M; Zaręba, P; Doroz-Płonka, A; Siwek, A; Alachkar, A; Mogilski, S; Saad, A; Kuder, K; Olejarz-Maciej, A; Godyń, J; Stary, D; Sudoł, S; Więcek, M; Latacz, G; Walczak, M; Handzlik, J; Sadek, B; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556129 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556129&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162665460 461694897 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375457 O=c1c2ccccc2oc2ccc(OCCCCCN3CCCCCC3)cc12 InChI=1S/C24H29NO3/c26-24-20-10-4-5-11-22(20)28-23-13-12-19(18-21(23)24)27-17-9-3-8-16-25-14-6-1-2-7-15-25/h4-5,10-13,18H,1-3,6-9,14-17H2 KNIPHGXUVWAHCN-UHFFFAOYSA-N 50556130 CHEMBL4797355 Cholinesterase 880 ChEMBL 10.1016/j.ejmech.2020.112743 10.7270/Q2P272S9 32882609 Łażewska, D; Bajda, M; Kaleta, M; Zaręba, P; Doroz-Płonka, A; Siwek, A; Alachkar, A; Mogilski, S; Saad, A; Kuder, K; Olejarz-Maciej, A; Godyń, J; Stary, D; Sudoł, S; Więcek, M; Latacz, G; Walczak, M; Handzlik, J; Sadek, B; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556130 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556130&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155811750 461694898 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375458 Clc1ccc2c(c1)oc1ccc(OCCCCCN3CCCCCC3)cc1c2=O InChI=1S/C24H28ClNO3/c25-18-8-10-20-23(16-18)29-22-11-9-19(17-21(22)24(20)27)28-15-7-3-6-14-26-12-4-1-2-5-13-26/h8-11,16-17H,1-7,12-15H2 LKXYCZQRBHVDER-UHFFFAOYSA-N 50556131 CHEMBL4789324 Cholinesterase 1280 ChEMBL 10.1016/j.ejmech.2020.112743 10.7270/Q2P272S9 32882609 Łażewska, D; Bajda, M; Kaleta, M; Zaręba, P; Doroz-Płonka, A; Siwek, A; Alachkar, A; Mogilski, S; Saad, A; Kuder, K; Olejarz-Maciej, A; Godyń, J; Stary, D; Sudoł, S; Więcek, M; Latacz, G; Walczak, M; Handzlik, J; Sadek, B; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556131 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556131&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162669554 461694899 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375459 Clc1ccc2oc3ccc(OCCCCCN4CCCCCC4)cc3c(=O)c2c1 InChI=1S/C24H28ClNO3/c25-18-8-10-22-20(16-18)24(27)21-17-19(9-11-23(21)29-22)28-15-7-3-6-14-26-12-4-1-2-5-13-26/h8-11,16-17H,1-7,12-15H2 JREXJAZIYYZNSO-UHFFFAOYSA-N 50556132 CHEMBL4783624 Cholinesterase 394 ChEMBL 10.1016/j.ejmech.2020.112743 10.7270/Q2P272S9 32882609 Łażewska, D; Bajda, M; Kaleta, M; Zaręba, P; Doroz-Płonka, A; Siwek, A; Alachkar, A; Mogilski, S; Saad, A; Kuder, K; Olejarz-Maciej, A; Godyń, J; Stary, D; Sudoł, S; Więcek, M; Latacz, G; Walczak, M; Handzlik, J; Sadek, B; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556132 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556132&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155815608 461694900 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375460 O=c1c2ccccc2oc2ccc(OCCCCCCN3CCCCCC3)cc12 InChI=1S/C25H31NO3/c27-25-21-11-5-6-12-23(21)29-24-14-13-20(19-22(24)25)28-18-10-4-3-9-17-26-15-7-1-2-8-16-26/h5-6,11-14,19H,1-4,7-10,15-18H2 DTEPKYSLLWLWRZ-UHFFFAOYSA-N 50556133 CHEMBL4744451 Cholinesterase 605 ChEMBL 10.1016/j.ejmech.2020.112743 10.7270/Q2P272S9 32882609 Łażewska, D; Bajda, M; Kaleta, M; Zaręba, P; Doroz-Płonka, A; Siwek, A; Alachkar, A; Mogilski, S; Saad, A; Kuder, K; Olejarz-Maciej, A; Godyń, J; Stary, D; Sudoł, S; Więcek, M; Latacz, G; Walczak, M; Handzlik, J; Sadek, B; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556133 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556133&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155815003 461694901 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375461 Clc1ccc2c(c1)oc1ccc(OCCCCCCN3CCCCCC3)cc1c2=O InChI=1S/C25H30ClNO3/c26-19-9-11-21-24(17-19)30-23-12-10-20(18-22(23)25(21)28)29-16-8-4-3-7-15-27-13-5-1-2-6-14-27/h9-12,17-18H,1-8,13-16H2 ZWCILIRMPOCMLE-UHFFFAOYSA-N 50556134 CHEMBL4746282 Cholinesterase 1240 ChEMBL 10.1016/j.ejmech.2020.112743 10.7270/Q2P272S9 32882609 Łażewska, D; Bajda, M; Kaleta, M; Zaręba, P; Doroz-Płonka, A; Siwek, A; Alachkar, A; Mogilski, S; Saad, A; Kuder, K; Olejarz-Maciej, A; Godyń, J; Stary, D; Sudoł, S; Więcek, M; Latacz, G; Walczak, M; Handzlik, J; Sadek, B; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556134 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556134&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162654675 461694902 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375462 Clc1ccc2oc3ccc(OCCCCCCN4CCCCCC4)cc3c(=O)c2c1 InChI=1S/C25H30ClNO3/c26-19-9-11-23-21(17-19)25(28)22-18-20(10-12-24(22)30-23)29-16-8-4-3-7-15-27-13-5-1-2-6-14-27/h9-12,17-18H,1-8,13-16H2 IGORWQONHHRXPZ-UHFFFAOYSA-N 50556135 CHEMBL4747044 Cholinesterase 545 ChEMBL 10.1016/j.ejmech.2020.112743 10.7270/Q2P272S9 32882609 Łażewska, D; Bajda, M; Kaleta, M; Zaręba, P; Doroz-Płonka, A; Siwek, A; Alachkar, A; Mogilski, S; Saad, A; Kuder, K; Olejarz-Maciej, A; Godyń, J; Stary, D; Sudoł, S; Więcek, M; Latacz, G; Walczak, M; Handzlik, J; Sadek, B; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556135 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556135&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162650349 461694903 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375463 Clc1ccc(CCCOCCCN2CCCCC2)cc1 InChI=1S/C17H26ClNO/c18-17-9-7-16(8-10-17)6-4-14-20-15-5-13-19-11-2-1-3-12-19/h7-10H,1-6,11-15H2 NNACHAUCXXVJSP-UHFFFAOYSA-N 50247053 1-(3-(3-(4-chlorophenyl)propoxy)propyl)piperidine::CHEMBL462605::Tiprolisant Cholinesterase 8400 ChEMBL 10.1016/j.ejmech.2020.112743 10.7270/Q2P272S9 32882609 Łażewska, D; Bajda, M; Kaleta, M; Zaręba, P; Doroz-Płonka, A; Siwek, A; Alachkar, A; Mogilski, S; Saad, A; Kuder, K; Olejarz-Maciej, A; Godyń, J; Stary, D; Sudoł, S; Więcek, M; Latacz, G; Walczak, M; Handzlik, J; Sadek, B; Malawska, B; Kieć-Kononowicz, K Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50247053 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50247053&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 9948102 104102226 CHEMBL462605 ZINC34045468 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51370680 Cc1c(OCc2ccccc2)cccc1N1CCN(CCNC2CCN(Cc3ccccc3)C2)CC1 InChI=1S/C31H40N4O/c1-26-30(13-8-14-31(26)36-25-28-11-6-3-7-12-28)35-21-19-33(20-22-35)18-16-32-29-15-17-34(24-29)23-27-9-4-2-5-10-27/h2-14,29,32H,15-25H2,1H3 XUOPIQHQMIVGOI-UHFFFAOYSA-N 50554160 CHEMBL4742650 Cholinesterase 7782 ChEMBL 10.1016/j.bmc.2020.115721 10.7270/Q2J106T5 33007563 Choubey, PK; Tripathi, A; Sharma, P; Shrivastava, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50554160 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50554160&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162646922 461692928 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375819 [Br-].CCOc1ccc(cc1)C(=O)Nc1cc[n+](Cc2ccccc2)cc1 InChI=1S/C21H20N2O2.BrH/c1-2-25-20-10-8-18(9-11-20)21(24)22-19-12-14-23(15-13-19)16-17-6-4-3-5-7-17;/h3-15H,2,16H2,1H3;1H FCSWWXDRJDLYTP-UHFFFAOYSA-N 50556282 CHEMBL4747531 Cholinesterase 12650 ChEMBL 10.1016/j.ejmech.2020.112761 10.7270/Q2M61PX1 32942070 Abdullaha, M; Nuthakki, VK; Bharate, SB CSIR-India; Academy of Scientific & Innovative Research http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556282 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556282&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162650707 461695050 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375820 [Br-].COc1ccc2cc(ccc2c1)C(=O)Nc1cc[n+](Cc2ccccc2)cc1 InChI=1S/C24H20N2O2.BrH/c1-28-23-10-9-19-15-21(8-7-20(19)16-23)24(27)25-22-11-13-26(14-12-22)17-18-5-3-2-4-6-18;/h2-16H,17H2,1H3;1H RUVVGSCVBQMZTD-UHFFFAOYSA-N 50556283 CHEMBL4746835 Cholinesterase 1591 ChEMBL 10.1016/j.ejmech.2020.112761 10.7270/Q2M61PX1 32942070 Abdullaha, M; Nuthakki, VK; Bharate, SB CSIR-India; Academy of Scientific & Innovative Research http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556283 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556283&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162649707 461695051 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375821 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 5520 ChEMBL 10.1016/j.ejmech.2020.112761 10.7270/Q2M61PX1 32942070 Abdullaha, M; Nuthakki, VK; Bharate, SB CSIR-India; Academy of Scientific & Innovative Research http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375822 [Cl-].COc1ccc2cc(ccc2c1)C(=O)Nc1cc[n+](Cc2ccccc2Cl)cc1 InChI=1S/C24H19ClN2O2.ClH/c1-29-22-9-8-17-14-19(7-6-18(17)15-22)24(28)26-21-10-12-27(13-11-21)16-20-4-2-3-5-23(20)25;/h2-15H,16H2,1H3;1H WKZQMDTZAXHJRZ-UHFFFAOYSA-N 50556284 CHEMBL4761420 Cholinesterase >1000 ChEMBL 10.1016/j.ejmech.2020.112761 10.7270/Q2M61PX1 32942070 Abdullaha, M; Nuthakki, VK; Bharate, SB CSIR-India; Academy of Scientific & Innovative Research http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556284 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556284&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162659412 461695052 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375823 [Cl-].COc1ccc2cc(ccc2c1)C(=O)Nc1cc[n+](Cc2ccc(Cl)cc2)cc1 InChI=1S/C24H19ClN2O2.ClH/c1-29-23-9-6-18-14-20(5-4-19(18)15-23)24(28)26-22-10-12-27(13-11-22)16-17-2-7-21(25)8-3-17;/h2-15H,16H2,1H3;1H GAIBVOYCWRENOC-UHFFFAOYSA-N 50556285 CHEMBL4762753 Cholinesterase >1000 ChEMBL 10.1016/j.ejmech.2020.112761 10.7270/Q2M61PX1 32942070 Abdullaha, M; Nuthakki, VK; Bharate, SB CSIR-India; Academy of Scientific & Innovative Research http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556285 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556285&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162660566 461695053 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375824 [Br-].COc1ccc2cc(ccc2c1)C(=O)Nc1cc[n+](Cc2ccccc2F)cc1 InChI=1S/C24H19FN2O2.BrH/c1-29-22-9-8-17-14-19(7-6-18(17)15-22)24(28)26-21-10-12-27(13-11-21)16-20-4-2-3-5-23(20)25;/h2-15H,16H2,1H3;1H YQLUGEZLABBDEV-UHFFFAOYSA-N 50556286 CHEMBL4747308 Cholinesterase >1000 ChEMBL 10.1016/j.ejmech.2020.112761 10.7270/Q2M61PX1 32942070 Abdullaha, M; Nuthakki, VK; Bharate, SB CSIR-India; Academy of Scientific & Innovative Research http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556286 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556286&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162649414 461695054 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375825 [Cl-].COc1ccc2cc(ccc2c1)C(=O)Nc1cc[n+](Cc2ccc(F)cc2)cc1 InChI=1S/C24H19FN2O2.ClH/c1-29-23-9-6-18-14-20(5-4-19(18)15-23)24(28)26-22-10-12-27(13-11-22)16-17-2-7-21(25)8-3-17;/h2-15H,16H2,1H3;1H CUFONMMJIRLBOZ-UHFFFAOYSA-N 50556287 CHEMBL4792532 Cholinesterase >1000 ChEMBL 10.1016/j.ejmech.2020.112761 10.7270/Q2M61PX1 32942070 Abdullaha, M; Nuthakki, VK; Bharate, SB CSIR-India; Academy of Scientific & Innovative Research http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556287 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556287&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162671228 461695055 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375826 [Br-].COc1ccc2cc(ccc2c1)C(=O)Nc1cc[n+](Cc2ccccc2[N+]([O-])=O)cc1 InChI=1S/C24H19N3O4.BrH/c1-31-22-9-8-17-14-19(7-6-18(17)15-22)24(28)25-21-10-12-26(13-11-21)16-20-4-2-3-5-23(20)27(29)30;/h2-15H,16H2,1H3;1H IRJYCCWNTAGHQB-UHFFFAOYSA-N 50556288 CHEMBL4758613 Cholinesterase >1000 ChEMBL 10.1016/j.ejmech.2020.112761 10.7270/Q2M61PX1 32942070 Abdullaha, M; Nuthakki, VK; Bharate, SB CSIR-India; Academy of Scientific & Innovative Research http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556288 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556288&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162657361 461695056 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375827 [Br-].COc1ccc2cc(ccc2c1)C(=O)NCCc1cc[n+](Cc2ccccc2)cc1 InChI=1S/C26H24N2O2.BrH/c1-30-25-10-9-22-17-24(8-7-23(22)18-25)26(29)27-14-11-20-12-15-28(16-13-20)19-21-5-3-2-4-6-21;/h2-10,12-13,15-18H,11,14,19H2,1H3;1H NANMERKYFFRJHF-UHFFFAOYSA-N 50556289 CHEMBL4748627 Cholinesterase 680 ChEMBL 10.1016/j.ejmech.2020.112761 10.7270/Q2M61PX1 32942070 Abdullaha, M; Nuthakki, VK; Bharate, SB CSIR-India; Academy of Scientific & Innovative Research http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556289 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556289&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162649669 461695057 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375828 [Br-].COc1ccc2cc(ccc2c1)C(=O)NCCc1cc[n+](Cc2ccccc2C)cc1 InChI=1S/C27H26N2O2.BrH/c1-20-5-3-4-6-25(20)19-29-15-12-21(13-16-29)11-14-28-27(30)24-8-7-23-18-26(31-2)10-9-22(23)17-24;/h3-10,12-13,15-18H,11,14,19H2,1-2H3;1H DVNUJOCOPSJJFR-UHFFFAOYSA-N 50556290 CHEMBL4789118 Cholinesterase >1000 ChEMBL 10.1016/j.ejmech.2020.112761 10.7270/Q2M61PX1 32942070 Abdullaha, M; Nuthakki, VK; Bharate, SB CSIR-India; Academy of Scientific & Innovative Research http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556290 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556290&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162669037 461695058 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375829 [Cl-].COc1ccc2cc(ccc2c1)C(=O)NCCc1cc[n+](Cc2ccccc2Cl)cc1 InChI=1S/C26H23ClN2O2.ClH/c1-31-24-9-8-20-16-22(7-6-21(20)17-24)26(30)28-13-10-19-11-14-29(15-12-19)18-23-4-2-3-5-25(23)27;/h2-9,11-12,14-17H,10,13,18H2,1H3;1H JXOWVLWEBWUEGY-UHFFFAOYSA-N 50556291 CHEMBL4777638 Cholinesterase 830 ChEMBL 10.1016/j.ejmech.2020.112761 10.7270/Q2M61PX1 32942070 Abdullaha, M; Nuthakki, VK; Bharate, SB CSIR-India; Academy of Scientific & Innovative Research http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556291 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556291&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162644016 461695059 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375830 [Cl-].COc1ccc2cc(ccc2c1)C(=O)NCCc1cc[n+](Cc2cccc(Cl)c2)cc1 InChI=1S/C26H23ClN2O2.ClH/c1-31-25-8-7-21-16-23(6-5-22(21)17-25)26(30)28-12-9-19-10-13-29(14-11-19)18-20-3-2-4-24(27)15-20;/h2-8,10-11,13-17H,9,12,18H2,1H3;1H YIZRRFAQGJZDLZ-UHFFFAOYSA-N 50556292 CHEMBL4753568 Cholinesterase >1000 ChEMBL 10.1016/j.ejmech.2020.112761 10.7270/Q2M61PX1 32942070 Abdullaha, M; Nuthakki, VK; Bharate, SB CSIR-India; Academy of Scientific & Innovative Research http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556292 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556292&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162653545 461695060 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375831 [Br-].COc1ccc2cc(ccc2c1)C(=O)NCCc1cc[n+](Cc2ccccc2F)cc1 InChI=1S/C26H23FN2O2.BrH/c1-31-24-9-8-20-16-22(7-6-21(20)17-24)26(30)28-13-10-19-11-14-29(15-12-19)18-23-4-2-3-5-25(23)27;/h2-9,11-12,14-17H,10,13,18H2,1H3;1H YJQXXZXCPKHYDY-UHFFFAOYSA-N 50556293 CHEMBL4743596 Cholinesterase >1000 ChEMBL 10.1016/j.ejmech.2020.112761 10.7270/Q2M61PX1 32942070 Abdullaha, M; Nuthakki, VK; Bharate, SB CSIR-India; Academy of Scientific & Innovative Research http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556293 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556293&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162645266 461695061 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375832 [Cl-].COc1ccc2cc(ccc2c1)C(=O)NCCc1cc[n+](Cc2ccc(F)cc2)cc1 InChI=1S/C26H23FN2O2.ClH/c1-31-25-9-6-21-16-23(5-4-22(21)17-25)26(30)28-13-10-19-11-14-29(15-12-19)18-20-2-7-24(27)8-3-20;/h2-9,11-12,14-17H,10,13,18H2,1H3;1H WNPZAUAKSXUJJI-UHFFFAOYSA-N 50556294 CHEMBL4739991 Cholinesterase >1000 ChEMBL 10.1016/j.ejmech.2020.112761 10.7270/Q2M61PX1 32942070 Abdullaha, M; Nuthakki, VK; Bharate, SB CSIR-India; Academy of Scientific & Innovative Research http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556294 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556294&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162645032 461695062 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375833 [Br-].COc1ccc2cc(ccc2c1)C(=O)NCCc1cc[n+](Cc2ccccc2[N+]([O-])=O)cc1 InChI=1S/C26H23N3O4.BrH/c1-33-24-9-8-20-16-22(7-6-21(20)17-24)26(30)27-13-10-19-11-14-28(15-12-19)18-23-4-2-3-5-25(23)29(31)32;/h2-9,11-12,14-17H,10,13,18H2,1H3;1H YYOFSNGMUVTWCL-UHFFFAOYSA-N 50556295 CHEMBL4794984 Cholinesterase >1000 ChEMBL 10.1016/j.ejmech.2020.112761 10.7270/Q2M61PX1 32942070 Abdullaha, M; Nuthakki, VK; Bharate, SB CSIR-India; Academy of Scientific & Innovative Research http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556295 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556295&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162672649 461695063 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375834 [Br-].COc1ccc2cc(ccc2c1)C(=O)NCCc1cc[n+](Cc2ccc(cc2)[N+]([O-])=O)cc1 InChI=1S/C26H23N3O4.BrH/c1-33-25-9-6-21-16-23(5-4-22(21)17-25)26(30)27-13-10-19-11-14-28(15-12-19)18-20-2-7-24(8-3-20)29(31)32;/h2-9,11-12,14-17H,10,13,18H2,1H3;1H JZSLPIPDHHQWTH-UHFFFAOYSA-N 50556296 CHEMBL4761783 Cholinesterase >1000 ChEMBL 10.1016/j.ejmech.2020.112761 10.7270/Q2M61PX1 32942070 Abdullaha, M; Nuthakki, VK; Bharate, SB CSIR-India; Academy of Scientific & Innovative Research http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556296 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556296&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162660116 461695064 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375835 COc1ccc2cc(ccc2c1)C(=O)NCCC1CCN(Cc2ccccc2)CC1 InChI=1S/C26H30N2O2/c1-30-25-10-9-22-17-24(8-7-23(22)18-25)26(29)27-14-11-20-12-15-28(16-13-20)19-21-5-3-2-4-6-21/h2-10,17-18,20H,11-16,19H2,1H3,(H,27,29) AIIWJMPOAUNFLG-UHFFFAOYSA-N 50556281 CHEMBL4790545 Cholinesterase 470 ChEMBL 10.1016/j.ejmech.2020.112761 10.7270/Q2M61PX1 32942070 Abdullaha, M; Nuthakki, VK; Bharate, SB CSIR-India; Academy of Scientific & Innovative Research http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556281 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556281&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162671509 461695049 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375836 [Br-].O=C(Nc1cc[n+](Cc2ccccc2)cc1)c1ccc(OCc2ccccc2)cc1 InChI=1S/C26H22N2O2.BrH/c29-26(23-11-13-25(14-12-23)30-20-22-9-5-2-6-10-22)27-24-15-17-28(18-16-24)19-21-7-3-1-4-8-21;/h1-18H,19-20H2;1H LLNGTEJPFLHTRC-UHFFFAOYSA-N 50556297 CHEMBL4752463 Cholinesterase >1000 ChEMBL 10.1016/j.ejmech.2020.112761 10.7270/Q2M61PX1 32942070 Abdullaha, M; Nuthakki, VK; Bharate, SB CSIR-India; Academy of Scientific & Innovative Research http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556297 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556297&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162652554 461695065 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375837 [Br-].O=C(Nc1cc[n+](Cc2ccccc2)cc1)c1ccc(cc1)-c1ccccc1 InChI=1S/C25H20N2O.BrH/c28-25(23-13-11-22(12-14-23)21-9-5-2-6-10-21)26-24-15-17-27(18-16-24)19-20-7-3-1-4-8-20;/h1-18H,19H2;1H GOGBWBYISCJIPL-UHFFFAOYSA-N 50556298 CHEMBL4751925 Cholinesterase >1000 ChEMBL 10.1016/j.ejmech.2020.112761 10.7270/Q2M61PX1 32942070 Abdullaha, M; Nuthakki, VK; Bharate, SB CSIR-India; Academy of Scientific & Innovative Research http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556298 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556298&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162652520 461695066 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375838 [Br-].COc1ccc2cc(ccc2c1)C(=O)Nc1cc[n+](Cc2ccccc2C)cc1 InChI=1S/C25H22N2O2.BrH/c1-18-5-3-4-6-22(18)17-27-13-11-23(12-14-27)26-25(28)21-8-7-20-16-24(29-2)10-9-19(20)15-21;/h3-16H,17H2,1-2H3;1H CETFFQOSAZVLDC-UHFFFAOYSA-N 50556299 CHEMBL4777643 Cholinesterase >1000 ChEMBL 10.1016/j.ejmech.2020.112761 10.7270/Q2M61PX1 32942070 Abdullaha, M; Nuthakki, VK; Bharate, SB CSIR-India; Academy of Scientific & Innovative Research http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556299 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556299&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162644022 461695067 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51375865 COc1ccc2cc(ccc2c1)C(=O)NCCC1CCN(Cc2ccccc2)CC1 InChI=1S/C26H30N2O2/c1-30-25-10-9-22-17-24(8-7-23(22)18-25)26(29)27-14-11-20-12-15-28(16-13-20)19-21-5-3-2-4-6-21/h2-10,17-18,20H,11-16,19H2,1H3,(H,27,29) AIIWJMPOAUNFLG-UHFFFAOYSA-N 50556281 CHEMBL4790545 Cholinesterase 150 ChEMBL 10.1016/j.ejmech.2020.112761 10.7270/Q2M61PX1 32942070 Abdullaha, M; Nuthakki, VK; Bharate, SB CSIR-India; Academy of Scientific & Innovative Research http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50556281 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50556281&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162671509 461695049 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51368498 Nc1nc(cc(n1)-c1ccc(OCC#C)cc1)-c1ccc(OCCN2CCOCC2)cc1 InChI=1S/C25H26N4O3/c1-2-14-31-21-7-3-19(4-8-21)23-18-24(28-25(26)27-23)20-5-9-22(10-6-20)32-17-13-29-11-15-30-16-12-29/h1,3-10,18H,11-17H2,(H2,26,27,28) SZNDVDHYJXHIKM-UHFFFAOYSA-N 50553263 CHEMBL4790416 Cholinesterase 666 ChEMBL 10.1016/j.bmc.2019.02.031 10.7270/Q2CJ8J40 30795991 Tripathi, PN; Srivastava, P; Sharma, P; Seth, A; Shrivastava, SK Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50553263 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50553263&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162669604 461692031 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51366975 CN(C)C(=O)Oc1ccccc1\C=N\NC(=O)c1cccc(O)c1 InChI=1S/C17H17N3O4/c1-20(2)17(23)24-15-9-4-3-6-13(15)11-18-19-16(22)12-7-5-8-14(21)10-12/h3-11,21H,1-2H3,(H,19,22)/b18-11+ WDDSQQFHSXNVQV-WOJGMQOQSA-N 50552596 CHEMBL4776280 Cholinesterase 560 ChEMBL 10.1016/j.bmc.2020.115991 10.7270/Q29W0K3R 33440318 Yamazaki, DAS; Rozada, AMF; Baréa, P; Reis, EC; Basso, EA; Sarragiotto, MH; Seixas, FAV; Gauze, GF State University of Maring£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50552596 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50552596&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162642987 461682936 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51366976 CN(C)C(=O)Oc1ccccc1\C=N\NC(=O)c1ccc(O)cc1 InChI=1S/C17H17N3O4/c1-20(2)17(23)24-15-6-4-3-5-13(15)11-18-19-16(22)12-7-9-14(21)10-8-12/h3-11,21H,1-2H3,(H,19,22)/b18-11+ WODIYJZQYSKRBS-WOJGMQOQSA-N 50552597 CHEMBL4744701 Cholinesterase 180 ChEMBL 10.1016/j.bmc.2020.115991 10.7270/Q29W0K3R 33440318 Yamazaki, DAS; Rozada, AMF; Baréa, P; Reis, EC; Basso, EA; Sarragiotto, MH; Seixas, FAV; Gauze, GF State University of Maring£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50552597 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50552597&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162648347 461682937 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51366977 COc1cc(ccc1O)C(=O)N\N=C\c1ccccc1OC(=O)N(C)C InChI=1S/C18H19N3O5/c1-21(2)18(24)26-15-7-5-4-6-13(15)11-19-20-17(23)12-8-9-14(22)16(10-12)25-3/h4-11,22H,1-3H3,(H,20,23)/b19-11+ FTDJFOKFNKIETA-YBFXNURJSA-N 50552595 CHEMBL4761984 Cholinesterase 70 ChEMBL 10.1016/j.bmc.2020.115991 10.7270/Q29W0K3R 33440318 Yamazaki, DAS; Rozada, AMF; Baréa, P; Reis, EC; Basso, EA; Sarragiotto, MH; Seixas, FAV; Gauze, GF State University of Maring£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50552595 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50552595&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162660783 461682935 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51366978 COc1ccc(cc1OC)C(=O)N\N=C\c1ccccc1OC(=O)N(C)C InChI=1S/C19H21N3O5/c1-22(2)19(24)27-15-8-6-5-7-14(15)12-20-21-18(23)13-9-10-16(25-3)17(11-13)26-4/h5-12H,1-4H3,(H,21,23)/b20-12+ BMFFIVWDQCPCRL-UDWIEESQSA-N 50552598 CHEMBL4798149 Cholinesterase 310 ChEMBL 10.1016/j.bmc.2020.115991 10.7270/Q29W0K3R 33440318 Yamazaki, DAS; Rozada, AMF; Baréa, P; Reis, EC; Basso, EA; Sarragiotto, MH; Seixas, FAV; Gauze, GF State University of Maring£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50552598 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50552598&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162676131 461682938 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51366979 CN(C)C(=O)Oc1ccc(\C=N\NC(=O)c2cccc(O)c2)cc1 InChI=1S/C17H17N3O4/c1-20(2)17(23)24-15-8-6-12(7-9-15)11-18-19-16(22)13-4-3-5-14(21)10-13/h3-11,21H,1-2H3,(H,19,22)/b18-11+ DCWKCRHFZMYUQE-WOJGMQOQSA-N 50552599 CHEMBL4781961 Cholinesterase 29250 ChEMBL 10.1016/j.bmc.2020.115991 10.7270/Q29W0K3R 33440318 Yamazaki, DAS; Rozada, AMF; Baréa, P; Reis, EC; Basso, EA; Sarragiotto, MH; Seixas, FAV; Gauze, GF State University of Maring£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50552599 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50552599&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162665234 461682939 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51366980 CN(C)C(=O)Oc1ccc(\C=N\NC(=O)c2ccc(O)cc2)cc1 InChI=1S/C17H17N3O4/c1-20(2)17(23)24-15-9-3-12(4-10-15)11-18-19-16(22)13-5-7-14(21)8-6-13/h3-11,21H,1-2H3,(H,19,22)/b18-11+ FEZVURNTCULYFS-WOJGMQOQSA-N 50552600 CHEMBL4756512 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2020.115991 10.7270/Q29W0K3R 33440318 Yamazaki, DAS; Rozada, AMF; Baréa, P; Reis, EC; Basso, EA; Sarragiotto, MH; Seixas, FAV; Gauze, GF State University of Maring£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50552600 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50552600&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162655283 461682940 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51366981 COc1cc(ccc1O)C(=O)N\N=C\c1ccc(OC(=O)N(C)C)cc1 InChI=1S/C18H19N3O5/c1-21(2)18(24)26-14-7-4-12(5-8-14)11-19-20-17(23)13-6-9-15(22)16(10-13)25-3/h4-11,22H,1-3H3,(H,20,23)/b19-11+ PALIUEBDNXQUME-YBFXNURJSA-N 50552601 CHEMBL4755990 Cholinesterase 21860 ChEMBL 10.1016/j.bmc.2020.115991 10.7270/Q29W0K3R 33440318 Yamazaki, DAS; Rozada, AMF; Baréa, P; Reis, EC; Basso, EA; Sarragiotto, MH; Seixas, FAV; Gauze, GF State University of Maring£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50552601 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50552601&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162655092 461682941 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51366982 COc1ccc(cc1OC)C(=O)N\N=C\c1ccc(OC(=O)N(C)C)cc1 InChI=1S/C19H21N3O5/c1-22(2)19(24)27-15-8-5-13(6-9-15)12-20-21-18(23)14-7-10-16(25-3)17(11-14)26-4/h5-12H,1-4H3,(H,21,23)/b20-12+ CEDXTZGOEDJOPT-UDWIEESQSA-N 50552602 CHEMBL4746542 Cholinesterase >100000 ChEMBL 10.1016/j.bmc.2020.115991 10.7270/Q29W0K3R 33440318 Yamazaki, DAS; Rozada, AMF; Baréa, P; Reis, EC; Basso, EA; Sarragiotto, MH; Seixas, FAV; Gauze, GF State University of Maring£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50552602 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50552602&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162648762 461682942 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51366983 COc1cc(\C=N\NC(=O)c2cccc(O)c2)ccc1OC(=O)N(C)C InChI=1S/C18H19N3O5/c1-21(2)18(24)26-15-8-7-12(9-16(15)25-3)11-19-20-17(23)13-5-4-6-14(22)10-13/h4-11,22H,1-3H3,(H,20,23)/b19-11+ XFTAGZXJGIAQFI-YBFXNURJSA-N 50552603 CHEMBL4746890 Cholinesterase 7650 ChEMBL 10.1016/j.bmc.2020.115991 10.7270/Q29W0K3R 33440318 Yamazaki, DAS; Rozada, AMF; Baréa, P; Reis, EC; Basso, EA; Sarragiotto, MH; Seixas, FAV; Gauze, GF State University of Maring£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50552603 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50552603&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162650569 461682943 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51366984 COc1cc(\C=N\NC(=O)c2ccc(O)cc2)ccc1OC(=O)N(C)C InChI=1S/C18H19N3O5/c1-21(2)18(24)26-15-9-4-12(10-16(15)25-3)11-19-20-17(23)13-5-7-14(22)8-6-13/h4-11,22H,1-3H3,(H,20,23)/b19-11+ FMXYAIYVEVLHLD-YBFXNURJSA-N 50552604 CHEMBL4742015 Cholinesterase 940 ChEMBL 10.1016/j.bmc.2020.115991 10.7270/Q29W0K3R 33440318 Yamazaki, DAS; Rozada, AMF; Baréa, P; Reis, EC; Basso, EA; Sarragiotto, MH; Seixas, FAV; Gauze, GF State University of Maring£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50552604 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50552604&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162646116 461682944 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51366985 COc1cc(ccc1O)C(=O)N\N=C\c1ccc(OC(=O)N(C)C)c(OC)c1 InChI=1S/C19H21N3O6/c1-22(2)19(25)28-15-8-5-12(9-17(15)27-4)11-20-21-18(24)13-6-7-14(23)16(10-13)26-3/h5-11,23H,1-4H3,(H,21,24)/b20-11+ BKFTUBTVLWAKPN-RGVLZGJSSA-N 50552605 CHEMBL4740762 Cholinesterase 9980 ChEMBL 10.1016/j.bmc.2020.115991 10.7270/Q29W0K3R 33440318 Yamazaki, DAS; Rozada, AMF; Baréa, P; Reis, EC; Basso, EA; Sarragiotto, MH; Seixas, FAV; Gauze, GF State University of Maring£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50552605 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50552605&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162645178 461682945 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51366986 COc1ccc(cc1OC)C(=O)N\N=C\c1ccc(OC(=O)N(C)C)c(OC)c1 InChI=1S/C20H23N3O6/c1-23(2)20(25)29-16-8-6-13(10-17(16)27-4)12-21-22-19(24)14-7-9-15(26-3)18(11-14)28-5/h6-12H,1-5H3,(H,22,24)/b21-12+ FSPHIAKYOZNUQW-CIAFOILYSA-N 50552606 CHEMBL4744935 Cholinesterase 2070 ChEMBL 10.1016/j.bmc.2020.115991 10.7270/Q29W0K3R 33440318 Yamazaki, DAS; Rozada, AMF; Baréa, P; Reis, EC; Basso, EA; Sarragiotto, MH; Seixas, FAV; Gauze, GF State University of Maring£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50552606 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50552606&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162647937 461682946 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51366987 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 3540 ChEMBL 10.1016/j.bmc.2020.115991 10.7270/Q29W0K3R 33440318 Yamazaki, DAS; Rozada, AMF; Baréa, P; Reis, EC; Basso, EA; Sarragiotto, MH; Seixas, FAV; Gauze, GF State University of Maring£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51361349 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 5.1 ChEMBL 10.1021/acs.jmedchem.6b01178 10.7270/Q2WH2TMM 27736061 Benchekroun, M; Romero, A; Egea, J; León, R; Michalska, P; Buendía, I; Jimeno, ML; Jun, D; Janockova, J; Sepsova, V; Soukup, O; Bautista-Aguilera, OM; Refouvelet, B; Ouari, O; Marco-Contelles, J; Ismaili, L Universit£ Bourgogne Franche-Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51361350 COc1ccc2[nH]cc(CCNC(=O)CN(CCCCCCCCNc3c4CCCCc4nc4ccc(OC)cc34)C(=O)CCCC[C@@H]3CCSS3)c2c1 50550229 CHEMBL4755679 Cholinesterase 8.2 ChEMBL 10.1021/acs.jmedchem.6b01178 10.7270/Q2WH2TMM 27736061 Benchekroun, M; Romero, A; Egea, J; León, R; Michalska, P; Buendía, I; Jimeno, ML; Jun, D; Janockova, J; Sepsova, V; Soukup, O; Bautista-Aguilera, OM; Refouvelet, B; Ouari, O; Marco-Contelles, J; Ismaili, L Universit£ Bourgogne Franche-Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50550229 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50550229&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162655191 461680569 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51361351 COc1ccc2[nH]cc(CCNC(=O)CN(CCCCCCCNc3c4CCCCc4nc4ccc(OC)cc34)C(=O)CCCC[C@@H]3CCSS3)c2c1 50550230 CHEMBL4761802 Cholinesterase 5.4 ChEMBL 10.1021/acs.jmedchem.6b01178 10.7270/Q2WH2TMM 27736061 Benchekroun, M; Romero, A; Egea, J; León, R; Michalska, P; Buendía, I; Jimeno, ML; Jun, D; Janockova, J; Sepsova, V; Soukup, O; Bautista-Aguilera, OM; Refouvelet, B; Ouari, O; Marco-Contelles, J; Ismaili, L Universit£ Bourgogne Franche-Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50550230 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50550230&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162660508 461680570 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51361352 COc1ccc2[nH]cc(CCNC(=O)CN(CCCCCCNc3c4CCCCc4nc4ccc(OC)cc34)C(=O)CCCC[C@@H]3CCSS3)c2c1 50550231 CHEMBL4752488 Cholinesterase 3.9 ChEMBL 10.1021/acs.jmedchem.6b01178 10.7270/Q2WH2TMM 27736061 Benchekroun, M; Romero, A; Egea, J; León, R; Michalska, P; Buendía, I; Jimeno, ML; Jun, D; Janockova, J; Sepsova, V; Soukup, O; Bautista-Aguilera, OM; Refouvelet, B; Ouari, O; Marco-Contelles, J; Ismaili, L Universit£ Bourgogne Franche-Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50550231 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50550231&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162652771 461680571 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51361353 COc1ccc2[nH]cc(CCNC(=O)CN(CCCCCCCCNc3c4CCCCc4nc4ccccc34)C(=O)CCCC[C@@H]3CCSS3)c2c1 50550232 CHEMBL4762083 Cholinesterase 1.3 ChEMBL 10.1021/acs.jmedchem.6b01178 10.7270/Q2WH2TMM 27736061 Benchekroun, M; Romero, A; Egea, J; León, R; Michalska, P; Buendía, I; Jimeno, ML; Jun, D; Janockova, J; Sepsova, V; Soukup, O; Bautista-Aguilera, OM; Refouvelet, B; Ouari, O; Marco-Contelles, J; Ismaili, L Universit£ Bourgogne Franche-Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50550232 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50550232&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162659994 461680572 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51361354 COc1ccc2[nH]cc(CCNC(=O)CN(CCCCCCCCNc3c4CCCCc4nc4ccc(OC)cc34)C(=O)\C=C\c3ccc(O)c(OC)c3)c2c1 InChI=1S/C45H55N5O6/c1-54-33-16-18-38-36(27-33)32(29-48-38)22-24-46-43(52)30-50(44(53)21-15-31-14-20-41(51)42(26-31)56-3)25-11-7-5-4-6-10-23-47-45-35-12-8-9-13-39(35)49-40-19-17-34(55-2)28-37(40)45/h14-21,26-29,48,51H,4-13,22-25,30H2,1-3H3,(H,46,52)(H,47,49)/b21-15+ HPDZXQZAOYMUDC-RCCKNPSSSA-N 50550233 CHEMBL4762095 Cholinesterase 12 ChEMBL 10.1021/acs.jmedchem.6b01178 10.7270/Q2WH2TMM 27736061 Benchekroun, M; Romero, A; Egea, J; León, R; Michalska, P; Buendía, I; Jimeno, ML; Jun, D; Janockova, J; Sepsova, V; Soukup, O; Bautista-Aguilera, OM; Refouvelet, B; Ouari, O; Marco-Contelles, J; Ismaili, L Universit£ Bourgogne Franche-Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50550233 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50550233&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162660127 461680573 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51361355 COc1ccc2[nH]cc(CCNC(=O)CN(CCCCCCCNc3c4CCCCc4nc4ccc(OC)cc34)C(=O)\C=C\c3ccc(O)c(OC)c3)c2c1 InChI=1S/C44H53N5O6/c1-53-32-15-17-37-35(26-32)31(28-47-37)21-23-45-42(51)29-49(43(52)20-14-30-13-19-40(50)41(25-30)55-3)24-10-6-4-5-9-22-46-44-34-11-7-8-12-38(34)48-39-18-16-33(54-2)27-36(39)44/h13-20,25-28,47,50H,4-12,21-24,29H2,1-3H3,(H,45,51)(H,46,48)/b20-14+ BCHYGDBEGKZQHD-XSFVSMFZSA-N 50550234 CHEMBL4784757 Cholinesterase 2.9 ChEMBL 10.1021/acs.jmedchem.6b01178 10.7270/Q2WH2TMM 27736061 Benchekroun, M; Romero, A; Egea, J; León, R; Michalska, P; Buendía, I; Jimeno, ML; Jun, D; Janockova, J; Sepsova, V; Soukup, O; Bautista-Aguilera, OM; Refouvelet, B; Ouari, O; Marco-Contelles, J; Ismaili, L Universit£ Bourgogne Franche-Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50550234 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50550234&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162665572 461680574 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51361356 COc1ccc2[nH]cc(CCNC(=O)CN(CCCCCCNc3c4CCCCc4nc4ccc(OC)cc34)C(=O)\C=C\c3ccc(O)c(OC)c3)c2c1 InChI=1S/C43H51N5O6/c1-52-31-14-16-36-34(25-31)30(27-46-36)20-22-44-41(50)28-48(42(51)19-13-29-12-18-39(49)40(24-29)54-3)23-9-5-4-8-21-45-43-33-10-6-7-11-37(33)47-38-17-15-32(53-2)26-35(38)43/h12-19,24-27,46,49H,4-11,20-23,28H2,1-3H3,(H,44,50)(H,45,47)/b19-13+ MFLCKOCRDJGDBD-CPNJWEJPSA-N 50550235 CHEMBL4790426 Cholinesterase 3.0 ChEMBL 10.1021/acs.jmedchem.6b01178 10.7270/Q2WH2TMM 27736061 Benchekroun, M; Romero, A; Egea, J; León, R; Michalska, P; Buendía, I; Jimeno, ML; Jun, D; Janockova, J; Sepsova, V; Soukup, O; Bautista-Aguilera, OM; Refouvelet, B; Ouari, O; Marco-Contelles, J; Ismaili, L Universit£ Bourgogne Franche-Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50550235 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50550235&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162669612 461680575 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51361357 COc1ccc2[nH]cc(CCNC(=O)CN(CCCCCCCCNc3c4CCCCc4nc4ccccc34)C(=O)\C=C\c3ccc(O)c(OC)c3)c2c1 InChI=1S/C44H53N5O5/c1-53-33-19-20-37-36(28-33)32(29-47-37)23-25-45-42(51)30-49(43(52)22-18-31-17-21-40(50)41(27-31)54-2)26-12-6-4-3-5-11-24-46-44-34-13-7-9-15-38(34)48-39-16-10-8-14-35(39)44/h7,9,13,15,17-22,27-29,47,50H,3-6,8,10-12,14,16,23-26,30H2,1-2H3,(H,45,51)(H,46,48)/b22-18+ OCOGBPYFWRDLHI-RELWKKBWSA-N 50550236 CHEMBL4759893 Cholinesterase 2.3 ChEMBL 10.1021/acs.jmedchem.6b01178 10.7270/Q2WH2TMM 27736061 Benchekroun, M; Romero, A; Egea, J; León, R; Michalska, P; Buendía, I; Jimeno, ML; Jun, D; Janockova, J; Sepsova, V; Soukup, O; Bautista-Aguilera, OM; Refouvelet, B; Ouari, O; Marco-Contelles, J; Ismaili, L Universit£ Bourgogne Franche-Comt£ http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50550236 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50550236&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162657382 461680576 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51365406 COc1cc(\C=C\C(=O)N2CCc3ccccc3C2)ccc1OC(=O)N(C)C InChI=1S/C22H24N2O4/c1-23(2)22(26)28-19-10-8-16(14-20(19)27-3)9-11-21(25)24-13-12-17-6-4-5-7-18(17)15-24/h4-11,14H,12-13,15H2,1-3H3/b11-9+ SCZIJKUJAHPGAK-PKNBQFBNSA-N 50551924 CHEMBL4759959 Cholinesterase 3700 ChEMBL 10.1016/j.ejmech.2020.112265 10.7270/Q2W099J0 32240904 Sang, Z; Wang, K; Bai, P; Wu, A; Shi, J; Liu, W; Zhu, G; Wang, Y; Lan, Y; Chen, Z; Zhao, Y; Qiao, Z; Wang, C; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50551924 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50551924&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162658406 461682264 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51365407 CCN(C)C(=O)Oc1ccc(\C=C\C(=O)N2CCc3ccccc3C2)cc1OC InChI=1S/C23H26N2O4/c1-4-24(2)23(27)29-20-11-9-17(15-21(20)28-3)10-12-22(26)25-14-13-18-7-5-6-8-19(18)16-25/h5-12,15H,4,13-14,16H2,1-3H3/b12-10+ LFDKTRKHMGXBPS-ZRDIBKRKSA-N 50551925 CHEMBL4793075 Cholinesterase 920 ChEMBL 10.1016/j.ejmech.2020.112265 10.7270/Q2W099J0 32240904 Sang, Z; Wang, K; Bai, P; Wu, A; Shi, J; Liu, W; Zhu, G; Wang, Y; Lan, Y; Chen, Z; Zhao, Y; Qiao, Z; Wang, C; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50551925 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50551925&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162670885 461682265 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51365408 CCN(CC)C(=O)Oc1ccc(\C=C\C(=O)N2CCc3ccccc3C2)cc1OC InChI=1S/C24H28N2O4/c1-4-25(5-2)24(28)30-21-12-10-18(16-22(21)29-3)11-13-23(27)26-15-14-19-8-6-7-9-20(19)17-26/h6-13,16H,4-5,14-15,17H2,1-3H3/b13-11+ XINGJGMSNDJSNH-ACCUITESSA-N 50551926 CHEMBL4779514 Cholinesterase 2000 ChEMBL 10.1016/j.ejmech.2020.112265 10.7270/Q2W099J0 32240904 Sang, Z; Wang, K; Bai, P; Wu, A; Shi, J; Liu, W; Zhu, G; Wang, Y; Lan, Y; Chen, Z; Zhao, Y; Qiao, Z; Wang, C; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50551926 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50551926&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162663361 461682266 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51365409 COc1cc(\C=C\C(=O)N2CCC(Cc3ccccc3)CC2)ccc1OC(=O)N(c1ccccc1)c1ccccc1 InChI=1S/C35H34N2O4/c1-40-33-26-28(18-20-34(38)36-23-21-29(22-24-36)25-27-11-5-2-6-12-27)17-19-32(33)41-35(39)37(30-13-7-3-8-14-30)31-15-9-4-10-16-31/h2-20,26,29H,21-25H2,1H3/b20-18+ GKLOQGGYHKLMHI-CZIZESTLSA-N 50551927 CHEMBL4759355 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2020.112265 10.7270/Q2W099J0 32240904 Sang, Z; Wang, K; Bai, P; Wu, A; Shi, J; Liu, W; Zhu, G; Wang, Y; Lan, Y; Chen, Z; Zhao, Y; Qiao, Z; Wang, C; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50551927 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50551927&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162658496 461682267 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51365410 COc1cc(\C=C\C(=O)N2CCC(Cc3ccccc3)CC2)ccc1OC(=O)N(C)C InChI=1S/C25H30N2O4/c1-26(2)25(29)31-22-11-9-20(18-23(22)30-3)10-12-24(28)27-15-13-21(14-16-27)17-19-7-5-4-6-8-19/h4-12,18,21H,13-17H2,1-3H3/b12-10+ DGIUFKOTVNGVKP-ZRDIBKRKSA-N 50551928 CHEMBL4792013 Cholinesterase 1300 ChEMBL 10.1016/j.ejmech.2020.112265 10.7270/Q2W099J0 32240904 Sang, Z; Wang, K; Bai, P; Wu, A; Shi, J; Liu, W; Zhu, G; Wang, Y; Lan, Y; Chen, Z; Zhao, Y; Qiao, Z; Wang, C; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50551928 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50551928&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162670842 461682268 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51365411 CCN(C)C(=O)Oc1ccc(\C=C\C(=O)N2CCC(Cc3ccccc3)CC2)cc1OC InChI=1S/C26H32N2O4/c1-4-27(2)26(30)32-23-12-10-21(19-24(23)31-3)11-13-25(29)28-16-14-22(15-17-28)18-20-8-6-5-7-9-20/h5-13,19,22H,4,14-18H2,1-3H3/b13-11+ IWQVOBYFNTVEOD-ACCUITESSA-N 50551929 CHEMBL4787165 Cholinesterase 3900 ChEMBL 10.1016/j.ejmech.2020.112265 10.7270/Q2W099J0 32240904 Sang, Z; Wang, K; Bai, P; Wu, A; Shi, J; Liu, W; Zhu, G; Wang, Y; Lan, Y; Chen, Z; Zhao, Y; Qiao, Z; Wang, C; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50551929 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50551929&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162667053 461682269 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51365412 CCN(CC)C(=O)Oc1ccc(\C=C\C(=O)N2CCC(Cc3ccccc3)CC2)cc1OC InChI=1S/C27H34N2O4/c1-4-28(5-2)27(31)33-24-13-11-22(20-25(24)32-3)12-14-26(30)29-17-15-23(16-18-29)19-21-9-7-6-8-10-21/h6-14,20,23H,4-5,15-19H2,1-3H3/b14-12+ DOKSDSNRXIBXCC-WYMLVPIESA-N 50551930 CHEMBL4761179 Cholinesterase 2800 ChEMBL 10.1016/j.ejmech.2020.112265 10.7270/Q2W099J0 32240904 Sang, Z; Wang, K; Bai, P; Wu, A; Shi, J; Liu, W; Zhu, G; Wang, Y; Lan, Y; Chen, Z; Zhao, Y; Qiao, Z; Wang, C; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50551930 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50551930&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162659021 461682270 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51365413 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 11682 2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::Rivastigmine.tartrate::US9586925, Rivastigmine Cholinesterase 1100 ChEMBL 10.1016/j.ejmech.2020.112265 10.7270/Q2W099J0 32240904 Sang, Z; Wang, K; Bai, P; Wu, A; Shi, J; Liu, W; Zhu, G; Wang, Y; Lan, Y; Chen, Z; Zhao, Y; Qiao, Z; Wang, C; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=11682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=11682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46512204 DB00989 C11766 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51365414 COc1cc(\C=C\C(O)=O)ccc1O InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+ KSEBMYQBYZTDHS-HWKANZROSA-N 50214744 (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid::(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid (10)::CHEMBL32749::Ferulic acid (M5)::ferulic acid Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2020.112265 10.7270/Q2W099J0 32240904 Sang, Z; Wang, K; Bai, P; Wu, A; Shi, J; Liu, W; Zhu, G; Wang, Y; Lan, Y; Chen, Z; Zhao, Y; Qiao, Z; Wang, C; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50214744 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50214744&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search FER 3NX2,1GKL,4PME,6G21,7ATJ,3PFC,2BNJ,1JT2,6YUX,1GW2,1GWT,6ATJ,7Z2U,1KYZ,7NTD,1UWC,3CBG,2BJH,5CXX,4RGU,4JB0,2WTN,6HOV,6HOQ,6HOP,6MBY,5X14 445858 104089679 17620 CHEMBL32749 DB07767 C01494 ZINC00058258 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51365415 CCN(C)C(=O)Oc1ccc(\C=C\C(=O)N2CCN(Cc3ccccc3)CC2)cc1 InChI=1S/C24H29N3O3/c1-3-25(2)24(29)30-22-12-9-20(10-13-22)11-14-23(28)27-17-15-26(16-18-27)19-21-7-5-4-6-8-21/h4-14H,3,15-19H2,1-2H3/b14-11+ FQGOWPYBNKSIRG-SDNWHVSQSA-N 50551939 CHEMBL4750360 Cholinesterase 20300 ChEMBL 10.1016/j.ejmech.2020.112265 10.7270/Q2W099J0 32240904 Sang, Z; Wang, K; Bai, P; Wu, A; Shi, J; Liu, W; Zhu, G; Wang, Y; Lan, Y; Chen, Z; Zhao, Y; Qiao, Z; Wang, C; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50551939 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50551939&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162650835 461682279 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51365416 CCN(C)C(=O)Oc1ccc(\C=C\C(=O)N2CCc3ccccc3C2)cc1 InChI=1S/C22H24N2O3/c1-3-23(2)22(26)27-20-11-8-17(9-12-20)10-13-21(25)24-15-14-18-6-4-5-7-19(18)16-24/h4-13H,3,14-16H2,1-2H3/b13-10+ MWFZYRJWHFSLOE-JLHYYAGUSA-N 50551938 CHEMBL4777412 Cholinesterase 3800 ChEMBL 10.1016/j.ejmech.2020.112265 10.7270/Q2W099J0 32240904 Sang, Z; Wang, K; Bai, P; Wu, A; Shi, J; Liu, W; Zhu, G; Wang, Y; Lan, Y; Chen, Z; Zhao, Y; Qiao, Z; Wang, C; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50551938 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50551938&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162643036 461682278 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51365417 CCN(C)C(=O)Oc1ccc(\C=C\C(=O)N2CCC(Cc3ccccc3)CC2)cc1 InChI=1S/C25H30N2O3/c1-3-26(2)25(29)30-23-12-9-20(10-13-23)11-14-24(28)27-17-15-22(16-18-27)19-21-7-5-4-6-8-21/h4-14,22H,3,15-19H2,1-2H3/b14-11+ MNNPXTZWADKUJP-SDNWHVSQSA-N 50551937 CHEMBL4776936 Cholinesterase 5300 ChEMBL 10.1016/j.ejmech.2020.112265 10.7270/Q2W099J0 32240904 Sang, Z; Wang, K; Bai, P; Wu, A; Shi, J; Liu, W; Zhu, G; Wang, Y; Lan, Y; Chen, Z; Zhao, Y; Qiao, Z; Wang, C; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50551937 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50551937&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162643531 461682277 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51365418 CCN(CC)C(=O)\C=C\c1ccc(OC(=O)N(C)C)c(OC)c1 InChI=1S/C17H24N2O4/c1-6-19(7-2)16(20)11-9-13-8-10-14(15(12-13)22-5)23-17(21)18(3)4/h8-12H,6-7H2,1-5H3/b11-9+ HSCGFHIZLBSWKK-PKNBQFBNSA-N 50551936 CHEMBL4789995 Cholinesterase 19200 ChEMBL 10.1016/j.ejmech.2020.112265 10.7270/Q2W099J0 32240904 Sang, Z; Wang, K; Bai, P; Wu, A; Shi, J; Liu, W; Zhu, G; Wang, Y; Lan, Y; Chen, Z; Zhao, Y; Qiao, Z; Wang, C; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50551936 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50551936&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162671264 461682276 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51365419 CCN(Cc1ccccc1)C(=O)\C=C\c1ccc(OC(=O)N(c2ccccc2)c2ccccc2)c(OC)c1 InChI=1S/C32H30N2O4/c1-3-33(24-26-13-7-4-8-14-26)31(35)22-20-25-19-21-29(30(23-25)37-2)38-32(36)34(27-15-9-5-10-16-27)28-17-11-6-12-18-28/h4-23H,3,24H2,1-2H3/b22-20+ KOURHYYDCUECQR-LSDHQDQOSA-N 50551935 CHEMBL4762548 Cholinesterase 24600 ChEMBL 10.1016/j.ejmech.2020.112265 10.7270/Q2W099J0 32240904 Sang, Z; Wang, K; Bai, P; Wu, A; Shi, J; Liu, W; Zhu, G; Wang, Y; Lan, Y; Chen, Z; Zhao, Y; Qiao, Z; Wang, C; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50551935 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50551935&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162659640 461682275 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51365420 CCN(C)C(=O)Oc1ccc(\C=C\C(=O)N(CC)Cc2ccccc2)cc1OC InChI=1S/C23H28N2O4/c1-5-24(3)23(27)29-20-14-12-18(16-21(20)28-4)13-15-22(26)25(6-2)17-19-10-8-7-9-11-19/h7-16H,5-6,17H2,1-4H3/b15-13+ OONJTMHYAWPQHW-FYWRMAATSA-N 50551934 CHEMBL4800310 Cholinesterase 1500 ChEMBL 10.1016/j.ejmech.2020.112265 10.7270/Q2W099J0 32240904 Sang, Z; Wang, K; Bai, P; Wu, A; Shi, J; Liu, W; Zhu, G; Wang, Y; Lan, Y; Chen, Z; Zhao, Y; Qiao, Z; Wang, C; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50551934 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50551934&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162677381 461682274 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51365421 COc1cc(\C=C\C(=O)N2CCCCC2)ccc1OC(=O)N(c1ccccc1)c1ccccc1 InChI=1S/C28H28N2O4/c1-33-26-21-22(16-18-27(31)29-19-9-4-10-20-29)15-17-25(26)34-28(32)30(23-11-5-2-6-12-23)24-13-7-3-8-14-24/h2-3,5-8,11-18,21H,4,9-10,19-20H2,1H3/b18-16+ FRTYPMGQTQZTSS-FBMGVBCBSA-N 50551933 CHEMBL4756054 Cholinesterase 98500 ChEMBL 10.1016/j.ejmech.2020.112265 10.7270/Q2W099J0 32240904 Sang, Z; Wang, K; Bai, P; Wu, A; Shi, J; Liu, W; Zhu, G; Wang, Y; Lan, Y; Chen, Z; Zhao, Y; Qiao, Z; Wang, C; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50551933 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50551933&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162655415 461682273 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51365422 COc1cc(\C=C\C(=O)N2CCCCC2)ccc1OC(=O)N(C)C InChI=1S/C18H24N2O4/c1-19(2)18(22)24-15-9-7-14(13-16(15)23-3)8-10-17(21)20-11-5-4-6-12-20/h7-10,13H,4-6,11-12H2,1-3H3/b10-8+ RVHOEUHHAHFBJU-CSKARUKUSA-N 50551932 CHEMBL4748948 Cholinesterase 26300 ChEMBL 10.1016/j.ejmech.2020.112265 10.7270/Q2W099J0 32240904 Sang, Z; Wang, K; Bai, P; Wu, A; Shi, J; Liu, W; Zhu, G; Wang, Y; Lan, Y; Chen, Z; Zhao, Y; Qiao, Z; Wang, C; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50551932 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50551932&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162649275 461682272 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51365423 CCN(C)C(=O)Oc1ccc(\C=C\C(=O)N2CCCCC2)cc1OC InChI=1S/C19H26N2O4/c1-4-20(2)19(23)25-16-10-8-15(14-17(16)24-3)9-11-18(22)21-12-6-5-7-13-21/h8-11,14H,4-7,12-13H2,1-3H3/b11-9+ KIQCSORRMFIOHM-PKNBQFBNSA-N 50551931 CHEMBL4747710 Cholinesterase 19600 ChEMBL 10.1016/j.ejmech.2020.112265 10.7270/Q2W099J0 32240904 Sang, Z; Wang, K; Bai, P; Wu, A; Shi, J; Liu, W; Zhu, G; Wang, Y; Lan, Y; Chen, Z; Zhao, Y; Qiao, Z; Wang, C; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50551931 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50551931&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162650617 461682271 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51365424 COc1cc(\C=C\C(=O)N2CCN(Cc3ccccc3)CC2)ccc1OC(=O)N(c1ccccc1)c1ccccc1 InChI=1S/C34H33N3O4/c1-40-32-25-27(18-20-33(38)36-23-21-35(22-24-36)26-28-11-5-2-6-12-28)17-19-31(32)41-34(39)37(29-13-7-3-8-14-29)30-15-9-4-10-16-30/h2-20,25H,21-24,26H2,1H3/b20-18+ ICKSGIYUZRTUTJ-CZIZESTLSA-N 50551919 CHEMBL4762653 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2020.112265 10.7270/Q2W099J0 32240904 Sang, Z; Wang, K; Bai, P; Wu, A; Shi, J; Liu, W; Zhu, G; Wang, Y; Lan, Y; Chen, Z; Zhao, Y; Qiao, Z; Wang, C; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50551919 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50551919&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162659467 461682259 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51365425 COc1cc(\C=C\C(=O)N2CCN(Cc3ccccc3)CC2)ccc1OC(=O)N(C)C InChI=1S/C24H29N3O4/c1-25(2)24(29)31-21-11-9-19(17-22(21)30-3)10-12-23(28)27-15-13-26(14-16-27)18-20-7-5-4-6-8-20/h4-12,17H,13-16,18H2,1-3H3/b12-10+ YPFUXEHNZQELSW-ZRDIBKRKSA-N 50551920 CHEMBL4756176 Cholinesterase 12100 ChEMBL 10.1016/j.ejmech.2020.112265 10.7270/Q2W099J0 32240904 Sang, Z; Wang, K; Bai, P; Wu, A; Shi, J; Liu, W; Zhu, G; Wang, Y; Lan, Y; Chen, Z; Zhao, Y; Qiao, Z; Wang, C; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50551920 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50551920&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162655617 461682260 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51365426 CCN(CC)C(=O)Oc1ccc(\C=C\C(=O)N2CCN(Cc3ccccc3)CC2)cc1OC InChI=1S/C26H33N3O4/c1-4-28(5-2)26(31)33-23-13-11-21(19-24(23)32-3)12-14-25(30)29-17-15-27(16-18-29)20-22-9-7-6-8-10-22/h6-14,19H,4-5,15-18,20H2,1-3H3/b14-12+ LUVGFBXWMIIQJF-WYMLVPIESA-N 50551921 CHEMBL4740081 Cholinesterase 8700 ChEMBL 10.1016/j.ejmech.2020.112265 10.7270/Q2W099J0 32240904 Sang, Z; Wang, K; Bai, P; Wu, A; Shi, J; Liu, W; Zhu, G; Wang, Y; Lan, Y; Chen, Z; Zhao, Y; Qiao, Z; Wang, C; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50551921 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50551921&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162644642 461682261 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51365427 CON(C)C(=O)Oc1ccc(\C=C\C(=O)N2CCc3ccccc3C2)cc1OC InChI=1S/C22H24N2O5/c1-23(28-3)22(26)29-19-10-8-16(14-20(19)27-2)9-11-21(25)24-13-12-17-6-4-5-7-18(17)15-24/h4-11,14H,12-13,15H2,1-3H3/b11-9+ ZUJNWRAQDSOTQS-PKNBQFBNSA-N 50551922 CHEMBL4741070 Cholinesterase 29200 ChEMBL 10.1016/j.ejmech.2020.112265 10.7270/Q2W099J0 32240904 Sang, Z; Wang, K; Bai, P; Wu, A; Shi, J; Liu, W; Zhu, G; Wang, Y; Lan, Y; Chen, Z; Zhao, Y; Qiao, Z; Wang, C; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50551922 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50551922&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162645908 461682262 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51365428 COc1cc(\C=C\C(=O)N2CCc3ccccc3C2)ccc1OC(=O)N(c1ccccc1)c1ccccc1 InChI=1S/C32H28N2O4/c1-37-30-22-24(17-19-31(35)33-21-20-25-10-8-9-11-26(25)23-33)16-18-29(30)38-32(36)34(27-12-4-2-5-13-27)28-14-6-3-7-15-28/h2-19,22H,20-21,23H2,1H3/b19-17+ AJGKMXXAHDHHEF-HTXNQAPBSA-N 50551923 CHEMBL4745075 Cholinesterase 23900 ChEMBL 10.1016/j.ejmech.2020.112265 10.7270/Q2W099J0 32240904 Sang, Z; Wang, K; Bai, P; Wu, A; Shi, J; Liu, W; Zhu, G; Wang, Y; Lan, Y; Chen, Z; Zhao, Y; Qiao, Z; Wang, C; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50551923 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50551923&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162647681 461682263 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51356902 CN1CCCC[C@H]1c1ccc(nc1)-c1cccnc1 InChI=1S/C16H19N3/c1-19-10-3-2-6-16(19)14-7-8-15(18-12-14)13-5-4-9-17-11-13/h4-5,7-9,11-12,16H,2-3,6,10H2,1H3/t16-/m0/s1 TZRDBHMKTWECOV-INIZCTEOSA-N 50548707 CHEMBL4792387 Cholinesterase 440000 ChEMBL 10.1016/j.bmc.2020.115820 10.7270/Q2WW7N96 33120080 Lin, SX; Curtis, MA; Sperry, J University of Auckland http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50548707 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50548707&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 928346 461679047 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51397324 COc1cccc(NC(=O)CNC(=O)\C=C\c2ccc(O)c(OC)c2)c1 InChI=1S/C19H20N2O5/c1-25-15-5-3-4-14(11-15)21-19(24)12-20-18(23)9-7-13-6-8-16(22)17(10-13)26-2/h3-11,22H,12H2,1-2H3,(H,20,23)(H,21,24)/b9-7+ DBMZBMJYDIJUPI-VQHVLOKHSA-N 50564485 CHEMBL4799854 Cholinesterase 15290 ChEMBL 10.1016/j.ejmech.2020.112257 10.7270/Q2K35ZCB 32375073 Singh, YP; Tej, GNVC; Pandey, A; Priya, K; Pandey, P; Shankar, G; Nayak, PK; Rai, G; Chittiboyina, AG; Doerksen, RJ; Vishwakarma, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564485 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564485&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162676954 461684823 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51397325 COc1ccc(NC(=O)CNC(=O)\C=C\c2ccc(O)c(OC)c2)cc1 InChI=1S/C19H20N2O5/c1-25-15-7-5-14(6-8-15)21-19(24)12-20-18(23)10-4-13-3-9-16(22)17(11-13)26-2/h3-11,22H,12H2,1-2H3,(H,20,23)(H,21,24)/b10-4+ HQHUHBMSMSWDBN-ONNFQVAWSA-N 50564486 CHEMBL4789401 Cholinesterase 19540 ChEMBL 10.1016/j.ejmech.2020.112257 10.7270/Q2K35ZCB 32375073 Singh, YP; Tej, GNVC; Pandey, A; Priya, K; Pandey, P; Shankar, G; Nayak, PK; Rai, G; Chittiboyina, AG; Doerksen, RJ; Vishwakarma, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564486 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564486&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162668560 461684824 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51397326 COc1cc(\C=C\C(=O)NCC(=O)Nc2ccc3[nH]ccc3c2)ccc1O InChI=1S/C20H19N3O4/c1-27-18-10-13(2-6-17(18)24)3-7-19(25)22-12-20(26)23-15-4-5-16-14(11-15)8-9-21-16/h2-11,21,24H,12H2,1H3,(H,22,25)(H,23,26)/b7-3+ XVKHPTDTSZLRHX-XVNBXDOJSA-N 50564501 CHEMBL4799941 Cholinesterase 14050 ChEMBL 10.1016/j.ejmech.2020.112257 10.7270/Q2K35ZCB 32375073 Singh, YP; Tej, GNVC; Pandey, A; Priya, K; Pandey, P; Shankar, G; Nayak, PK; Rai, G; Chittiboyina, AG; Doerksen, RJ; Vishwakarma, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564501 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564501&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162676464 461684839 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51397327 COc1cc(\C=C\C(=O)NCC(=O)Nc2ccc3ncccc3c2)ccc1O InChI=1S/C21H19N3O4/c1-28-19-11-14(4-8-18(19)25)5-9-20(26)23-13-21(27)24-16-6-7-17-15(12-16)3-2-10-22-17/h2-12,25H,13H2,1H3,(H,23,26)(H,24,27)/b9-5+ FDCRLLFTRZKKFG-WEVVVXLNSA-N 50564502 CHEMBL4789794 Cholinesterase 14320 ChEMBL 10.1016/j.ejmech.2020.112257 10.7270/Q2K35ZCB 32375073 Singh, YP; Tej, GNVC; Pandey, A; Priya, K; Pandey, P; Shankar, G; Nayak, PK; Rai, G; Chittiboyina, AG; Doerksen, RJ; Vishwakarma, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564502 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564502&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162669711 461684840 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51397328 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 2890 ChEMBL 10.1016/j.ejmech.2020.112257 10.7270/Q2K35ZCB 32375073 Singh, YP; Tej, GNVC; Pandey, A; Priya, K; Pandey, P; Shankar, G; Nayak, PK; Rai, G; Chittiboyina, AG; Doerksen, RJ; Vishwakarma, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51397597 Cc1c(OCc2ccccc2)c(=O)ccn1CCCCCCNCc1ccccc1 InChI=1S/C26H32N2O2/c1-22-26(30-21-24-14-8-5-9-15-24)25(29)16-19-28(22)18-11-3-2-10-17-27-20-23-12-6-4-7-13-23/h4-9,12-16,19,27H,2-3,10-11,17-18,20-21H2,1H3 UIAHSQRUFROBRQ-UHFFFAOYSA-N 50564584 CHEMBL4791565 Cholinesterase 2364 ChEMBL 10.1016/j.ejmech.2020.112350 10.7270/Q25X2DP5 32380385 Bortolami, M; Pandolfi, F; De Vita, D; Carafa, C; Messore, A; Di Santo, R; Feroci, M; Costi, R; Chiarotto, I; Bagetta, D; Alcaro, S; Colone, M; Stringaro, A; Scipione, L Sapienza University of Rome http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564584 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564584&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162671445 461684922 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51397598 Cc1c(OCc2ccccc2)c(=O)ccn1CCCCNCc1ccccc1 InChI=1S/C24H28N2O2/c1-20-24(28-19-22-12-6-3-7-13-22)23(27)14-17-26(20)16-9-8-15-25-18-21-10-4-2-5-11-21/h2-7,10-14,17,25H,8-9,15-16,18-19H2,1H3 SYPYEZVJGSDHKM-UHFFFAOYSA-N 50564588 CHEMBL4785902 Cholinesterase 450 ChEMBL 10.1016/j.ejmech.2020.112350 10.7270/Q25X2DP5 32380385 Bortolami, M; Pandolfi, F; De Vita, D; Carafa, C; Messore, A; Di Santo, R; Feroci, M; Costi, R; Chiarotto, I; Bagetta, D; Alcaro, S; Colone, M; Stringaro, A; Scipione, L Sapienza University of Rome http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564588 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564588&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162666832 461684926 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51397599 COc1ccccc1CNCCCCCCn1ccc(=O)c(OCc2ccccc2)c1C InChI=1S/C27H34N2O3/c1-22-27(32-21-23-12-6-5-7-13-23)25(30)16-19-29(22)18-11-4-3-10-17-28-20-24-14-8-9-15-26(24)31-2/h5-9,12-16,19,28H,3-4,10-11,17-18,20-21H2,1-2H3 NOYYPSXZLJMCPI-UHFFFAOYSA-N 50564585 CHEMBL4780976 Cholinesterase 910 ChEMBL 10.1016/j.ejmech.2020.112350 10.7270/Q25X2DP5 32380385 Bortolami, M; Pandolfi, F; De Vita, D; Carafa, C; Messore, A; Di Santo, R; Feroci, M; Costi, R; Chiarotto, I; Bagetta, D; Alcaro, S; Colone, M; Stringaro, A; Scipione, L Sapienza University of Rome http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564585 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564585&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162663321 461684923 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51397600 Cc1c(OCc2ccccc2)c(=O)ccn1CCCCCCNc1ccccn1 InChI=1S/C24H29N3O2/c1-20-24(29-19-21-11-5-4-6-12-21)22(28)14-18-27(20)17-10-3-2-8-15-25-23-13-7-9-16-26-23/h4-7,9,11-14,16,18H,2-3,8,10,15,17,19H2,1H3,(H,25,26) QQUBQWRVRFCKMT-UHFFFAOYSA-N 50564589 CHEMBL4783436 Cholinesterase 182 ChEMBL 10.1016/j.ejmech.2020.112350 10.7270/Q25X2DP5 32380385 Bortolami, M; Pandolfi, F; De Vita, D; Carafa, C; Messore, A; Di Santo, R; Feroci, M; Costi, R; Chiarotto, I; Bagetta, D; Alcaro, S; Colone, M; Stringaro, A; Scipione, L Sapienza University of Rome http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564589 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564589&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162665301 461684927 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51397601 Cc1c(OCc2ccccc2)c(=O)ccn1CCCCCCNc1nccc(Cl)n1 InChI=1S/C23H27ClN4O2/c1-18-22(30-17-19-9-5-4-6-10-19)20(29)12-16-28(18)15-8-3-2-7-13-25-23-26-14-11-21(24)27-23/h4-6,9-12,14,16H,2-3,7-8,13,15,17H2,1H3,(H,25,26,27) ZRTMCIKXQLVHSD-UHFFFAOYSA-N 50564590 CHEMBL4778716 Cholinesterase 1080 ChEMBL 10.1016/j.ejmech.2020.112350 10.7270/Q25X2DP5 32380385 Bortolami, M; Pandolfi, F; De Vita, D; Carafa, C; Messore, A; Di Santo, R; Feroci, M; Costi, R; Chiarotto, I; Bagetta, D; Alcaro, S; Colone, M; Stringaro, A; Scipione, L Sapienza University of Rome http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564590 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564590&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162661067 461684928 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51397602 Cc1c(OCc2ccccc2)c(=O)ccn1CCCCCCNc1ccnc(NCc2ccccc2)n1 InChI=1S/C30H35N5O2/c1-24-29(37-23-26-14-8-5-9-15-26)27(36)17-21-35(24)20-11-3-2-10-18-31-28-16-19-32-30(34-28)33-22-25-12-6-4-7-13-25/h4-9,12-17,19,21H,2-3,10-11,18,20,22-23H2,1H3,(H2,31,32,33,34) IYECCCDUGSYHSK-UHFFFAOYSA-N 50564591 CHEMBL4799735 Cholinesterase 258 ChEMBL 10.1016/j.ejmech.2020.112350 10.7270/Q25X2DP5 32380385 Bortolami, M; Pandolfi, F; De Vita, D; Carafa, C; Messore, A; Di Santo, R; Feroci, M; Costi, R; Chiarotto, I; Bagetta, D; Alcaro, S; Colone, M; Stringaro, A; Scipione, L Sapienza University of Rome http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564591 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564591&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162677243 461684929 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51397603 Cc1c(O)c(=O)ccn1CCCCCCNc1ccnc(NCc2ccccc2)n1 InChI=1S/C23H29N5O2/c1-18-22(30)20(29)12-16-28(18)15-8-3-2-7-13-24-21-11-14-25-23(27-21)26-17-19-9-5-4-6-10-19/h4-6,9-12,14,16,30H,2-3,7-8,13,15,17H2,1H3,(H2,24,25,26,27) YYJCCCMASLJFRQ-UHFFFAOYSA-N 50564592 CHEMBL4798261 Cholinesterase 920 ChEMBL 10.1016/j.ejmech.2020.112350 10.7270/Q25X2DP5 32380385 Bortolami, M; Pandolfi, F; De Vita, D; Carafa, C; Messore, A; Di Santo, R; Feroci, M; Costi, R; Chiarotto, I; Bagetta, D; Alcaro, S; Colone, M; Stringaro, A; Scipione, L Sapienza University of Rome http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564592 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564592&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162675295 461684930 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51396741 Oc1cc(OCCCCN2CCC(Cc3ccccc3)CC2)cc2oc(cc(=O)c12)-c1ccc(OCCCCN2CCC(Cc3ccccc3)CC2)cc1 InChI=1S/C47H56N2O5/c50-43-33-42(53-30-10-8-24-49-27-21-39(22-28-49)32-37-13-5-2-6-14-37)34-46-47(43)44(51)35-45(54-46)40-15-17-41(18-16-40)52-29-9-7-23-48-25-19-38(20-26-48)31-36-11-3-1-4-12-36/h1-6,11-18,33-35,38-39,50H,7-10,19-32H2 NTMOJNLZGRDYEX-UHFFFAOYSA-N 50564215 CHEMBL4779180 Cholinesterase 19700 ChEMBL 10.1016/j.ejmech.2020.112180 10.7270/Q2N301PX 32131034 Sang, Z; Wang, K; Shi, J; Liu, W; Cheng, X; Zhu, G; Wang, Y; Zhao, Y; Qiao, Z; Wu, A; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564215 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564215&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162662803 461684553 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51396742 Oc1cc(OCCCCN2CCN(Cc3ccccc3)CC2)cc2oc(cc(=O)c12)-c1ccc(OCCCCN2CCN(Cc3ccccc3)CC2)cc1 InChI=1S/C45H54N4O5/c50-41-31-40(53-30-10-8-20-47-23-27-49(28-24-47)35-37-13-5-2-6-14-37)32-44-45(41)42(51)33-43(54-44)38-15-17-39(18-16-38)52-29-9-7-19-46-21-25-48(26-22-46)34-36-11-3-1-4-12-36/h1-6,11-18,31-33,50H,7-10,19-30,34-35H2 QDGFZDSHMCVZQL-UHFFFAOYSA-N 50564214 CHEMBL4777818 Cholinesterase 37500 ChEMBL 10.1016/j.ejmech.2020.112180 10.7270/Q2N301PX 32131034 Sang, Z; Wang, K; Shi, J; Liu, W; Cheng, X; Zhu, G; Wang, Y; Zhao, Y; Qiao, Z; Wu, A; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564214 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564214&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162643980 461684552 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51396743 Oc1cc(OCCCCN2CCc3ccccc3C2)cc2oc(cc(=O)c12)-c1ccc(OCCCCN2CCc3ccccc3C2)cc1 InChI=1S/C41H44N2O5/c44-37-25-36(47-24-8-6-20-43-22-18-31-10-2-4-12-34(31)29-43)26-40-41(37)38(45)27-39(48-40)32-13-15-35(16-14-32)46-23-7-5-19-42-21-17-30-9-1-3-11-33(30)28-42/h1-4,9-16,25-27,44H,5-8,17-24,28-29H2 YNXCNTICEBIQKR-UHFFFAOYSA-N 50564216 CHEMBL4792240 Cholinesterase 17500 ChEMBL 10.1016/j.ejmech.2020.112180 10.7270/Q2N301PX 32131034 Sang, Z; Wang, K; Shi, J; Liu, W; Cheng, X; Zhu, G; Wang, Y; Zhao, Y; Qiao, Z; Wu, A; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564216 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564216&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162671343 461684554 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51396744 CCN(CCCCOc1ccc(cc1)-c1cc(=O)c2c(O)cc(OCCCCN(CC)Cc3ccccc3)cc2o1)Cc1ccccc1 InChI=1S/C41H48N2O5/c1-3-42(30-32-15-7-5-8-16-32)23-11-13-25-46-35-21-19-34(20-22-35)39-29-38(45)41-37(44)27-36(28-40(41)48-39)47-26-14-12-24-43(4-2)31-33-17-9-6-10-18-33/h5-10,15-22,27-29,44H,3-4,11-14,23-26,30-31H2,1-2H3 ZLKRKOVDOXDQDL-UHFFFAOYSA-N 50564217 CHEMBL4783427 Cholinesterase 9600 ChEMBL 10.1016/j.ejmech.2020.112180 10.7270/Q2N301PX 32131034 Sang, Z; Wang, K; Shi, J; Liu, W; Cheng, X; Zhu, G; Wang, Y; Zhao, Y; Qiao, Z; Wu, A; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564217 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564217&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162666614 461684555 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51396745 Oc1cc(OCCCCN2CCC(Cc3ccccc3)CC2)cc2OC(CC(=O)c12)c1ccc(OCCCCN2CCC(Cc3ccccc3)CC2)cc1 InChI=1S/C47H58N2O5/c50-43-33-42(53-30-10-8-24-49-27-21-39(22-28-49)32-37-13-5-2-6-14-37)34-46-47(43)44(51)35-45(54-46)40-15-17-41(18-16-40)52-29-9-7-23-48-25-19-38(20-26-48)31-36-11-3-1-4-12-36/h1-6,11-18,33-34,38-39,45,50H,7-10,19-32,35H2 SOHPLFZBNPLYPB-UHFFFAOYSA-N 50564218 CHEMBL4798516 Cholinesterase 7500 ChEMBL 10.1016/j.ejmech.2020.112180 10.7270/Q2N301PX 32131034 Sang, Z; Wang, K; Shi, J; Liu, W; Cheng, X; Zhu, G; Wang, Y; Zhao, Y; Qiao, Z; Wu, A; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564218 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564218&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162675998 461684556 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51396746 CCN(CCCCOc1ccc(cc1)C1CC(=O)c2c(O)cc(OCCCCN(CC)Cc3ccccc3OC)cc2O1)Cc1ccccc1OC InChI=1S/C43H54N2O7/c1-5-44(30-33-15-7-9-17-39(33)48-3)23-11-13-25-50-35-21-19-32(20-22-35)41-29-38(47)43-37(46)27-36(28-42(43)52-41)51-26-14-12-24-45(6-2)31-34-16-8-10-18-40(34)49-4/h7-10,15-22,27-28,41,46H,5-6,11-14,23-26,29-31H2,1-4H3 RFJJUATUWWQTAO-UHFFFAOYSA-N 50564221 CHEMBL4795370 Cholinesterase 21900 ChEMBL 10.1016/j.ejmech.2020.112180 10.7270/Q2N301PX 32131034 Sang, Z; Wang, K; Shi, J; Liu, W; Cheng, X; Zhu, G; Wang, Y; Zhao, Y; Qiao, Z; Wu, A; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564221 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564221&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162674114 461684559 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51396747 Oc1cc(OCCCCN2CCC(Cc3ccccc3)CC2)cc2occ(-c3ccc(OCCCCN4CCC(Cc5ccccc5)CC4)cc3)c(=O)c12 InChI=1S/C47H56N2O5/c50-44-33-42(53-30-10-8-24-49-27-21-39(22-28-49)32-37-13-5-2-6-14-37)34-45-46(44)47(51)43(35-54-45)40-15-17-41(18-16-40)52-29-9-7-23-48-25-19-38(20-26-48)31-36-11-3-1-4-12-36/h1-6,11-18,33-35,38-39,50H,7-10,19-32H2 MJYHXFQKEQRPEC-UHFFFAOYSA-N 50564222 CHEMBL4796574 Cholinesterase 31800 ChEMBL 10.1016/j.ejmech.2020.112180 10.7270/Q2N301PX 32131034 Sang, Z; Wang, K; Shi, J; Liu, W; Cheng, X; Zhu, G; Wang, Y; Zhao, Y; Qiao, Z; Wu, A; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564222 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564222&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162676060 461684560 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51396748 Oc1cc(OCCCCN2CCc3ccccc3C2)cc2occ(-c3ccc(OCCCCN4CCc5ccccc5C4)cc3)c(=O)c12 InChI=1S/C41H44N2O5/c44-38-25-36(47-24-8-6-20-43-22-18-31-10-2-4-12-34(31)28-43)26-39-40(38)41(45)37(29-48-39)32-13-15-35(16-14-32)46-23-7-5-19-42-21-17-30-9-1-3-11-33(30)27-42/h1-4,9-16,25-26,29,44H,5-8,17-24,27-28H2 OKOIPODBGJKFGU-UHFFFAOYSA-N 50564224 CHEMBL4791528 Cholinesterase 52600 ChEMBL 10.1016/j.ejmech.2020.112180 10.7270/Q2N301PX 32131034 Sang, Z; Wang, K; Shi, J; Liu, W; Cheng, X; Zhu, G; Wang, Y; Zhao, Y; Qiao, Z; Wu, A; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564224 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564224&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162671083 461684562 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51396749 Oc1cc(OCCCCN2CCCCC2)cc2occ(-c3ccc(OCCCCN4CCCCC4)cc3)c(=O)c12 InChI=1S/C33H44N2O5/c36-30-23-28(39-22-10-8-20-35-17-5-2-6-18-35)24-31-32(30)33(37)29(25-40-31)26-11-13-27(14-12-26)38-21-9-7-19-34-15-3-1-4-16-34/h11-14,23-25,36H,1-10,15-22H2 VIOPWDAUYNQNRM-UHFFFAOYSA-N 50564227 CHEMBL4787690 Cholinesterase 2200 ChEMBL 10.1016/j.ejmech.2020.112180 10.7270/Q2N301PX 32131034 Sang, Z; Wang, K; Shi, J; Liu, W; Cheng, X; Zhu, G; Wang, Y; Zhao, Y; Qiao, Z; Wu, A; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564227 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564227&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162668286 461684565 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51396750 Oc1cc(OCCCCN2CCC(Cc3ccccc3)CC2)cc(O)c1C(=O)\C=C\c1ccc(OCCCCN2CCC(Cc3ccccc3)CC2)cc1 InChI=1S/C47H58N2O5/c50-44(20-17-37-15-18-42(19-16-37)53-31-9-7-25-48-27-21-40(22-28-48)33-38-11-3-1-4-12-38)47-45(51)35-43(36-46(47)52)54-32-10-8-26-49-29-23-41(24-30-49)34-39-13-5-2-6-14-39/h1-6,11-20,35-36,40-41,51-52H,7-10,21-34H2/b20-17+ PJQRMGWDMAUSJK-LVZFUZTISA-N 50564228 CHEMBL4793096 Cholinesterase 46100 ChEMBL 10.1016/j.ejmech.2020.112180 10.7270/Q2N301PX 32131034 Sang, Z; Wang, K; Shi, J; Liu, W; Cheng, X; Zhu, G; Wang, Y; Zhao, Y; Qiao, Z; Wu, A; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564228 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564228&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162671142 461684566 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51396751 CCN(CCCCOc1ccc(\C=C\C(=O)c2c(O)cc(OCCCCN(CC)Cc3ccccc3OC)cc2O)cc1)Cc1ccccc1OC InChI=1S/C43H54N2O7/c1-5-44(31-34-15-7-9-17-41(34)49-3)25-11-13-27-51-36-22-19-33(20-23-36)21-24-38(46)43-39(47)29-37(30-40(43)48)52-28-14-12-26-45(6-2)32-35-16-8-10-18-42(35)50-4/h7-10,15-24,29-30,47-48H,5-6,11-14,25-28,31-32H2,1-4H3/b24-21+ XPYFRMBBCHEZMZ-DARPEHSRSA-N 50564229 CHEMBL4782477 Cholinesterase 15600 ChEMBL 10.1016/j.ejmech.2020.112180 10.7270/Q2N301PX 32131034 Sang, Z; Wang, K; Shi, J; Liu, W; Cheng, X; Zhu, G; Wang, Y; Zhao, Y; Qiao, Z; Wu, A; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564229 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564229&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162663969 461684567 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51396752 Oc1cc(OCCCCN2CCCCC2)cc(O)c1C(=O)\C=C\c1ccc(OCCCCN2CCCCC2)cc1 InChI=1S/C33H46N2O5/c36-30(16-13-27-11-14-28(15-12-27)39-23-9-7-21-34-17-3-1-4-18-34)33-31(37)25-29(26-32(33)38)40-24-10-8-22-35-19-5-2-6-20-35/h11-16,25-26,37-38H,1-10,17-24H2/b16-13+ XBDYTEFXMPXJIS-DTQAZKPQSA-N 50564230 CHEMBL4777899 Cholinesterase 7200 ChEMBL 10.1016/j.ejmech.2020.112180 10.7270/Q2N301PX 32131034 Sang, Z; Wang, K; Shi, J; Liu, W; Cheng, X; Zhu, G; Wang, Y; Zhao, Y; Qiao, Z; Wu, A; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564230 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564230&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162644230 461684568 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51396753 Oc1cc(OCCCCN2CCCC2)cc(O)c1C(=O)\C=C\c1ccc(OCCCCN2CCCC2)cc1 InChI=1S/C31H42N2O5/c34-28(14-11-25-9-12-26(13-10-25)37-21-7-5-19-32-15-1-2-16-32)31-29(35)23-27(24-30(31)36)38-22-8-6-20-33-17-3-4-18-33/h9-14,23-24,35-36H,1-8,15-22H2/b14-11+ QOSSCOVDLSVVJA-SDNWHVSQSA-N 50564231 CHEMBL4798445 Cholinesterase 8190 ChEMBL 10.1016/j.ejmech.2020.112180 10.7270/Q2N301PX 32131034 Sang, Z; Wang, K; Shi, J; Liu, W; Cheng, X; Zhu, G; Wang, Y; Zhao, Y; Qiao, Z; Wu, A; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564231 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564231&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162675319 461684569 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51396754 CCN(CC)CCCCOc1ccc(\C=C\C(=O)c2c(O)cc(OCCCCN(CC)CC)cc2O)cc1 InChI=1S/C31H46N2O5/c1-5-32(6-2)19-9-11-21-37-26-16-13-25(14-17-26)15-18-28(34)31-29(35)23-27(24-30(31)36)38-22-12-10-20-33(7-3)8-4/h13-18,23-24,35-36H,5-12,19-22H2,1-4H3/b18-15+ OGHSLHAXPVLHBD-OBGWFSINSA-N 50564232 CHEMBL4782832 Cholinesterase 30800 ChEMBL 10.1016/j.ejmech.2020.112180 10.7270/Q2N301PX 32131034 Sang, Z; Wang, K; Shi, J; Liu, W; Cheng, X; Zhu, G; Wang, Y; Zhao, Y; Qiao, Z; Wu, A; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564232 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564232&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162665033 461684570 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51396755 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 4760 ChEMBL 10.1016/j.ejmech.2020.112180 10.7270/Q2N301PX 32131034 Sang, Z; Wang, K; Shi, J; Liu, W; Cheng, X; Zhu, G; Wang, Y; Zhao, Y; Qiao, Z; Wu, A; Tan, Z Nanyang Normal University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51404160 COc1cc(\C=C\C(=O)N2CCN(Cc3ccccc3C)CC2)ccc1O InChI=1S/C22H26N2O3/c1-17-5-3-4-6-19(17)16-23-11-13-24(14-12-23)22(26)10-8-18-7-9-20(25)21(15-18)27-2/h3-10,15,25H,11-14,16H2,1-2H3/b10-8+ JIODEVUKWPGMRZ-CSKARUKUSA-N 50567301 CHEMBL4860607 Cholinesterase 15060 ChEMBL 10.1016/j.bmc.2021.116385 10.7270/Q28W3J18 34481338 Singh, YP; Shankar, G; Jahan, S; Singh, G; Kumar, N; Barik, A; Upadhyay, P; Singh, L; Kamble, K; Singh, GK; Tiwari, S; Garg, P; Gupta, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50567301 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50567301&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164614307 471057446 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51404161 COc1cc(\C=C\C(=O)N2CCN(Cc3cccc(C)c3)CC2)ccc1O InChI=1S/C22H26N2O3/c1-17-4-3-5-19(14-17)16-23-10-12-24(13-11-23)22(26)9-7-18-6-8-20(25)21(15-18)27-2/h3-9,14-15,25H,10-13,16H2,1-2H3/b9-7+ ZQWXPCFDLVPCKH-VQHVLOKHSA-N 50567302 CHEMBL4871018 Cholinesterase 14690 ChEMBL 10.1016/j.bmc.2021.116385 10.7270/Q28W3J18 34481338 Singh, YP; Shankar, G; Jahan, S; Singh, G; Kumar, N; Barik, A; Upadhyay, P; Singh, L; Kamble, K; Singh, GK; Tiwari, S; Garg, P; Gupta, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50567302 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50567302&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164624705 471057447 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51404162 COc1cc(\C=C\C(=O)N2CCN(Cc3ccc(C)cc3)CC2)ccc1O InChI=1S/C22H26N2O3/c1-17-3-5-19(6-4-17)16-23-11-13-24(14-12-23)22(26)10-8-18-7-9-20(25)21(15-18)27-2/h3-10,15,25H,11-14,16H2,1-2H3/b10-8+ IQMBEXLYUZMZHT-CSKARUKUSA-N 50567303 CHEMBL4876437 Cholinesterase 14750 ChEMBL 10.1016/j.bmc.2021.116385 10.7270/Q28W3J18 34481338 Singh, YP; Shankar, G; Jahan, S; Singh, G; Kumar, N; Barik, A; Upadhyay, P; Singh, L; Kamble, K; Singh, GK; Tiwari, S; Garg, P; Gupta, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50567303 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50567303&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164627247 471057448 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51404163 COc1cc(\C=C\C(=O)N2CCN(Cc3ccccc3Cl)CC2)ccc1O InChI=1S/C21H23ClN2O3/c1-27-20-14-16(6-8-19(20)25)7-9-21(26)24-12-10-23(11-13-24)15-17-4-2-3-5-18(17)22/h2-9,14,25H,10-13,15H2,1H3/b9-7+ MZMPRWUXMXDAFP-VQHVLOKHSA-N 50567304 CHEMBL4861679 Cholinesterase 15210 ChEMBL 10.1016/j.bmc.2021.116385 10.7270/Q28W3J18 34481338 Singh, YP; Shankar, G; Jahan, S; Singh, G; Kumar, N; Barik, A; Upadhyay, P; Singh, L; Kamble, K; Singh, GK; Tiwari, S; Garg, P; Gupta, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50567304 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50567304&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164615887 471057449 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51404164 COc1cc(\C=C\C(=O)N2CCN(Cc3cccc(Cl)c3)CC2)ccc1O InChI=1S/C21H23ClN2O3/c1-27-20-14-16(5-7-19(20)25)6-8-21(26)24-11-9-23(10-12-24)15-17-3-2-4-18(22)13-17/h2-8,13-14,25H,9-12,15H2,1H3/b8-6+ QGFULWWYVZUOTH-SOFGYWHQSA-N 50567292 CHEMBL4868234 Cholinesterase 14800 ChEMBL 10.1016/j.bmc.2021.116385 10.7270/Q28W3J18 34481338 Singh, YP; Shankar, G; Jahan, S; Singh, G; Kumar, N; Barik, A; Upadhyay, P; Singh, L; Kamble, K; Singh, GK; Tiwari, S; Garg, P; Gupta, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50567292 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50567292&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164625134 471057437 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51404165 COc1cc(\C=C\C(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)ccc1O InChI=1S/C21H23ClN2O3/c1-27-20-14-16(4-8-19(20)25)5-9-21(26)24-12-10-23(11-13-24)15-17-2-6-18(22)7-3-17/h2-9,14,25H,10-13,15H2,1H3/b9-5+ ZNECINCGFRAVIE-WEVVVXLNSA-N 50567305 CHEMBL4864548 Cholinesterase 15860 ChEMBL 10.1016/j.bmc.2021.116385 10.7270/Q28W3J18 34481338 Singh, YP; Shankar, G; Jahan, S; Singh, G; Kumar, N; Barik, A; Upadhyay, P; Singh, L; Kamble, K; Singh, GK; Tiwari, S; Garg, P; Gupta, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50567305 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50567305&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164624039 471057450 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51404166 COc1cc(\C=C\C(=O)N2CCN(Cc3ccccc3F)CC2)ccc1O InChI=1S/C21H23FN2O3/c1-27-20-14-16(6-8-19(20)25)7-9-21(26)24-12-10-23(11-13-24)15-17-4-2-3-5-18(17)22/h2-9,14,25H,10-13,15H2,1H3/b9-7+ CERCFZRVVIDLPB-VQHVLOKHSA-N 50567306 CHEMBL4856377 Cholinesterase 15890 ChEMBL 10.1016/j.bmc.2021.116385 10.7270/Q28W3J18 34481338 Singh, YP; Shankar, G; Jahan, S; Singh, G; Kumar, N; Barik, A; Upadhyay, P; Singh, L; Kamble, K; Singh, GK; Tiwari, S; Garg, P; Gupta, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50567306 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50567306&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164611374 471057451 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51404167 COc1cc(\C=C\C(=O)N2CCN(Cc3cccc(F)c3)CC2)ccc1O InChI=1S/C21H23FN2O3/c1-27-20-14-16(5-7-19(20)25)6-8-21(26)24-11-9-23(10-12-24)15-17-3-2-4-18(22)13-17/h2-8,13-14,25H,9-12,15H2,1H3/b8-6+ WCESATJMEGZLEK-SOFGYWHQSA-N 50567293 CHEMBL4873165 Cholinesterase 14030 ChEMBL 10.1016/j.bmc.2021.116385 10.7270/Q28W3J18 34481338 Singh, YP; Shankar, G; Jahan, S; Singh, G; Kumar, N; Barik, A; Upadhyay, P; Singh, L; Kamble, K; Singh, GK; Tiwari, S; Garg, P; Gupta, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50567293 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50567293&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164624825 471057438 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51404168 COc1cc(\C=C\C(=O)N2CCN(Cc3ccc(F)cc3)CC2)ccc1O InChI=1S/C21H23FN2O3/c1-27-20-14-16(4-8-19(20)25)5-9-21(26)24-12-10-23(11-13-24)15-17-2-6-18(22)7-3-17/h2-9,14,25H,10-13,15H2,1H3/b9-5+ MUHIHOQVQVDBRM-WEVVVXLNSA-N 50567294 CHEMBL4864801 Cholinesterase 14850 ChEMBL 10.1016/j.bmc.2021.116385 10.7270/Q28W3J18 34481338 Singh, YP; Shankar, G; Jahan, S; Singh, G; Kumar, N; Barik, A; Upadhyay, P; Singh, L; Kamble, K; Singh, GK; Tiwari, S; Garg, P; Gupta, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50567294 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50567294&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164624960 471057439 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51404169 COc1cc(\C=C\C(=O)N2CCN(Cc3ccccc3C#N)CC2)ccc1O InChI=1S/C22H23N3O3/c1-28-21-14-17(6-8-20(21)26)7-9-22(27)25-12-10-24(11-13-25)16-19-5-3-2-4-18(19)15-23/h2-9,14,26H,10-13,16H2,1H3/b9-7+ ODKGCRJKEJOGFU-VQHVLOKHSA-N 50567307 CHEMBL4863005 Cholinesterase 14890 ChEMBL 10.1016/j.bmc.2021.116385 10.7270/Q28W3J18 34481338 Singh, YP; Shankar, G; Jahan, S; Singh, G; Kumar, N; Barik, A; Upadhyay, P; Singh, L; Kamble, K; Singh, GK; Tiwari, S; Garg, P; Gupta, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50567307 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50567307&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164619981 471057452 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51404170 COc1cc(\C=C\C(=O)N2CCN(Cc3cccc(c3)C#N)CC2)ccc1O InChI=1S/C22H23N3O3/c1-28-21-14-17(5-7-20(21)26)6-8-22(27)25-11-9-24(10-12-25)16-19-4-2-3-18(13-19)15-23/h2-8,13-14,26H,9-12,16H2,1H3/b8-6+ OTXYKGJQYRLHRX-SOFGYWHQSA-N 50567308 CHEMBL4865179 Cholinesterase 14730 ChEMBL 10.1016/j.bmc.2021.116385 10.7270/Q28W3J18 34481338 Singh, YP; Shankar, G; Jahan, S; Singh, G; Kumar, N; Barik, A; Upadhyay, P; Singh, L; Kamble, K; Singh, GK; Tiwari, S; Garg, P; Gupta, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50567308 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50567308&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164622231 471057453 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51404171 COc1cc(\C=C\C(=O)N2CCN(Cc3ccc(cc3)C#N)CC2)ccc1O InChI=1S/C22H23N3O3/c1-28-21-14-17(6-8-20(21)26)7-9-22(27)25-12-10-24(11-13-25)16-19-4-2-18(15-23)3-5-19/h2-9,14,26H,10-13,16H2,1H3/b9-7+ MQZJAPDJFVDHSZ-VQHVLOKHSA-N 50567309 CHEMBL4850916 Cholinesterase 15580 ChEMBL 10.1016/j.bmc.2021.116385 10.7270/Q28W3J18 34481338 Singh, YP; Shankar, G; Jahan, S; Singh, G; Kumar, N; Barik, A; Upadhyay, P; Singh, L; Kamble, K; Singh, GK; Tiwari, S; Garg, P; Gupta, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50567309 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50567309&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164618406 471057454 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51404172 COc1cc(\C=C\C(=O)N2CCN(Cc3cccc(c3)[N+]([O-])=O)CC2)ccc1O InChI=1S/C21H23N3O5/c1-29-20-14-16(5-7-19(20)25)6-8-21(26)23-11-9-22(10-12-23)15-17-3-2-4-18(13-17)24(27)28/h2-8,13-14,25H,9-12,15H2,1H3/b8-6+ BDSQEOVTDXHPCA-SOFGYWHQSA-N 50567310 CHEMBL4863669 Cholinesterase 14620 ChEMBL 10.1016/j.bmc.2021.116385 10.7270/Q28W3J18 34481338 Singh, YP; Shankar, G; Jahan, S; Singh, G; Kumar, N; Barik, A; Upadhyay, P; Singh, L; Kamble, K; Singh, GK; Tiwari, S; Garg, P; Gupta, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50567310 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50567310&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164619578 471057455 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51404173 COc1cc(\C=C\C(=O)NCCC(=O)Nc2ccccc2)ccc1O InChI=1S/C19H20N2O4/c1-25-17-13-14(7-9-16(17)22)8-10-18(23)20-12-11-19(24)21-15-5-3-2-4-6-15/h2-10,13,22H,11-12H2,1H3,(H,20,23)(H,21,24)/b10-8+ PBRBOZMXARYISY-CSKARUKUSA-N 50567295 CHEMBL4860467 Cholinesterase 16380 ChEMBL 10.1016/j.bmc.2021.116385 10.7270/Q28W3J18 34481338 Singh, YP; Shankar, G; Jahan, S; Singh, G; Kumar, N; Barik, A; Upadhyay, P; Singh, L; Kamble, K; Singh, GK; Tiwari, S; Garg, P; Gupta, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50567295 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50567295&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164616037 471057440 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51404174 COc1cccc(NC(=O)CCNC(=O)\C=C\c2ccc(O)c(OC)c2)c1 InChI=1S/C20H22N2O5/c1-26-16-5-3-4-15(13-16)22-20(25)10-11-21-19(24)9-7-14-6-8-17(23)18(12-14)27-2/h3-9,12-13,23H,10-11H2,1-2H3,(H,21,24)(H,22,25)/b9-7+ CVIGIFUFGSHWDX-VQHVLOKHSA-N 50567296 CHEMBL4848548 Cholinesterase 11340 ChEMBL 10.1016/j.bmc.2021.116385 10.7270/Q28W3J18 34481338 Singh, YP; Shankar, G; Jahan, S; Singh, G; Kumar, N; Barik, A; Upadhyay, P; Singh, L; Kamble, K; Singh, GK; Tiwari, S; Garg, P; Gupta, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50567296 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50567296&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164609980 471057441 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51404175 COc1cc(\C=C\C(=O)NCCC(=O)Nc2ccc(Cl)cc2)ccc1O InChI=1S/C19H19ClN2O4/c1-26-17-12-13(2-8-16(17)23)3-9-18(24)21-11-10-19(25)22-15-6-4-14(20)5-7-15/h2-9,12,23H,10-11H2,1H3,(H,21,24)(H,22,25)/b9-3+ MJLZXQPGFGKYKG-YCRREMRBSA-N 50567297 CHEMBL4856181 Cholinesterase 7130 ChEMBL 10.1016/j.bmc.2021.116385 10.7270/Q28W3J18 34481338 Singh, YP; Shankar, G; Jahan, S; Singh, G; Kumar, N; Barik, A; Upadhyay, P; Singh, L; Kamble, K; Singh, GK; Tiwari, S; Garg, P; Gupta, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50567297 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50567297&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164610270 471057442 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51404176 COc1cc(\C=C\C(=O)NCC(=O)NCCc2c[nH]c3ccccc23)ccc1O InChI=1S/C22H23N3O4/c1-29-20-12-15(6-8-19(20)26)7-9-21(27)25-14-22(28)23-11-10-16-13-24-18-5-3-2-4-17(16)18/h2-9,12-13,24,26H,10-11,14H2,1H3,(H,23,28)(H,25,27)/b9-7+ WFZLZUMSNYZMQL-VQHVLOKHSA-N 50567298 CHEMBL4854322 Cholinesterase 3140 ChEMBL 10.1016/j.bmc.2021.116385 10.7270/Q28W3J18 34481338 Singh, YP; Shankar, G; Jahan, S; Singh, G; Kumar, N; Barik, A; Upadhyay, P; Singh, L; Kamble, K; Singh, GK; Tiwari, S; Garg, P; Gupta, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50567298 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50567298&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164612921 471057443 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51404177 COc1ccc2[nH]cc(CCNC(=O)CNC(=O)\C=C\c3ccc(O)c(OC)c3)c2c1 InChI=1S/C23H25N3O5/c1-30-17-5-6-19-18(12-17)16(13-25-19)9-10-24-23(29)14-26-22(28)8-4-15-3-7-20(27)21(11-15)31-2/h3-8,11-13,25,27H,9-10,14H2,1-2H3,(H,24,29)(H,26,28)/b8-4+ LDZYHULYKCNQFT-XBXARRHUSA-N 50567299 CHEMBL4869703 Cholinesterase 1230 ChEMBL 10.1016/j.bmc.2021.116385 10.7270/Q28W3J18 34481338 Singh, YP; Shankar, G; Jahan, S; Singh, G; Kumar, N; Barik, A; Upadhyay, P; Singh, L; Kamble, K; Singh, GK; Tiwari, S; Garg, P; Gupta, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50567299 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50567299&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 163408828 471057444 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51404178 COc1cc(\C=C\C(=O)NCC(=O)NCCc2c[nH]c3ccc(Cl)cc23)ccc1O InChI=1S/C22H22ClN3O4/c1-30-20-10-14(2-6-19(20)27)3-7-21(28)26-13-22(29)24-9-8-15-12-25-18-5-4-16(23)11-17(15)18/h2-7,10-12,25,27H,8-9,13H2,1H3,(H,24,29)(H,26,28)/b7-3+ OYIPLAHDKDNEPE-XVNBXDOJSA-N 50567300 CHEMBL4866457 Cholinesterase 1290 ChEMBL 10.1016/j.bmc.2021.116385 10.7270/Q28W3J18 34481338 Singh, YP; Shankar, G; Jahan, S; Singh, G; Kumar, N; Barik, A; Upadhyay, P; Singh, L; Kamble, K; Singh, GK; Tiwari, S; Garg, P; Gupta, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50567300 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50567300&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164620135 471057445 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51404179 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 2160 ChEMBL 10.1016/j.bmc.2021.116385 10.7270/Q28W3J18 34481338 Singh, YP; Shankar, G; Jahan, S; Singh, G; Kumar, N; Barik, A; Upadhyay, P; Singh, L; Kamble, K; Singh, GK; Tiwari, S; Garg, P; Gupta, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51404180 COc1cc(\C=C\C(=O)NCC(=O)Nc2ccc3[nH]ccc3c2)ccc1O InChI=1S/C20H19N3O4/c1-27-18-10-13(2-6-17(18)24)3-7-19(25)22-12-20(26)23-15-4-5-16-14(11-15)8-9-21-16/h2-11,21,24H,12H2,1H3,(H,22,25)(H,23,26)/b7-3+ XVKHPTDTSZLRHX-XVNBXDOJSA-N 50564501 CHEMBL4799941 Cholinesterase 14050 ChEMBL 10.1016/j.bmc.2021.116385 10.7270/Q28W3J18 34481338 Singh, YP; Shankar, G; Jahan, S; Singh, G; Kumar, N; Barik, A; Upadhyay, P; Singh, L; Kamble, K; Singh, GK; Tiwari, S; Garg, P; Gupta, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50564501 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50564501&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162676464 461684839 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51402606 O=C(Nc1ccc2nc3CCCn3c(=O)c2c1)c1cc2ccccc2[nH]1 InChI=1S/C20H16N4O2/c25-19(17-10-12-4-1-2-5-15(12)22-17)21-13-7-8-16-14(11-13)20(26)24-9-3-6-18(24)23-16/h1-2,4-5,7-8,10-11,22H,3,6,9H2,(H,21,25) WMVNKXATYYASHC-UHFFFAOYSA-N 50566640 CHEMBL4874567 Cholinesterase 900 ChEMBL 10.1016/j.bmcl.2021.128212 10.7270/Q2XS605F 34153471 Nerella, A; Jeripothula, M Kakatiya University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50566640 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50566640&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164627187 471056785 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51402607 COc1ccc2[nH]c(cc2c1)C(=O)Nc1ccc2nc3CCCn3c(=O)c2c1 InChI=1S/C21H18N4O3/c1-28-14-5-7-16-12(9-14)10-18(23-16)20(26)22-13-4-6-17-15(11-13)21(27)25-8-2-3-19(25)24-17/h4-7,9-11,23H,2-3,8H2,1H3,(H,22,26) BCHSBAPBQXDRKS-UHFFFAOYSA-N 50566641 CHEMBL4861956 Cholinesterase 150 ChEMBL 10.1016/j.bmcl.2021.128212 10.7270/Q2XS605F 34153471 Nerella, A; Jeripothula, M Kakatiya University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50566641 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50566641&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164620793 471056786 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51402608 Fc1ccc2[nH]c(cc2c1)C(=O)Nc1ccc2nc3CCCn3c(=O)c2c1 InChI=1S/C20H15FN4O2/c21-12-3-5-15-11(8-12)9-17(23-15)19(26)22-13-4-6-16-14(10-13)20(27)25-7-1-2-18(25)24-16/h3-6,8-10,23H,1-2,7H2,(H,22,26) ANBJDEWIAPJPGU-UHFFFAOYSA-N 50566642 CHEMBL4854341 Cholinesterase 750 ChEMBL 10.1016/j.bmcl.2021.128212 10.7270/Q2XS605F 34153471 Nerella, A; Jeripothula, M Kakatiya University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50566642 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50566642&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164613462 471056787 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51402609 Clc1ccc2[nH]c(cc2c1)C(=O)Nc1ccc2nc3CCCn3c(=O)c2c1 InChI=1S/C20H15ClN4O2/c21-12-3-5-15-11(8-12)9-17(23-15)19(26)22-13-4-6-16-14(10-13)20(27)25-7-1-2-18(25)24-16/h3-6,8-10,23H,1-2,7H2,(H,22,26) SRGQTDMWOMYASR-UHFFFAOYSA-N 50566643 CHEMBL4871461 Cholinesterase 770 ChEMBL 10.1016/j.bmcl.2021.128212 10.7270/Q2XS605F 34153471 Nerella, A; Jeripothula, M Kakatiya University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50566643 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50566643&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164620335 471056788 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51402610 O=C(Nc1ccc2nc3CCCn3c(=O)c2c1)c1cc2ccccc2o1 InChI=1S/C20H15N3O3/c24-19(17-10-12-4-1-2-5-16(12)26-17)21-13-7-8-15-14(11-13)20(25)23-9-3-6-18(23)22-15/h1-2,4-5,7-8,10-11H,3,6,9H2,(H,21,24) VXWLIDOWNKGMDA-UHFFFAOYSA-N 50566644 CHEMBL4864253 Cholinesterase 1850 ChEMBL 10.1016/j.bmcl.2021.128212 10.7270/Q2XS605F 34153471 Nerella, A; Jeripothula, M Kakatiya University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50566644 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50566644&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164622202 471056789 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51402611 O=C(Nc1ccc2nc3CCCn3c(=O)c2c1)c1cc2ccccc2s1 InChI=1S/C20H15N3O2S/c24-19(17-10-12-4-1-2-5-16(12)26-17)21-13-7-8-15-14(11-13)20(25)23-9-3-6-18(23)22-15/h1-2,4-5,7-8,10-11H,3,6,9H2,(H,21,24) QVJHCVJHGYQBSY-UHFFFAOYSA-N 50566645 CHEMBL4871713 Cholinesterase 1900 ChEMBL 10.1016/j.bmcl.2021.128212 10.7270/Q2XS605F 34153471 Nerella, A; Jeripothula, M Kakatiya University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50566645 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50566645&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 99457881 471056790 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51402612 O=C(Cc1cc2ccccc2[nH]1)Nc1ccc2nc3CCCn3c(=O)c2c1 InChI=1S/C21H18N4O2/c26-20(12-15-10-13-4-1-2-5-17(13)22-15)23-14-7-8-18-16(11-14)21(27)25-9-3-6-19(25)24-18/h1-2,4-5,7-8,10-11,22H,3,6,9,12H2,(H,23,26) KBBLFMBCCQYUGI-UHFFFAOYSA-N 50566646 CHEMBL4878452 Cholinesterase 1380 ChEMBL 10.1016/j.bmcl.2021.128212 10.7270/Q2XS605F 34153471 Nerella, A; Jeripothula, M Kakatiya University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50566646 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50566646&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164628329 471056791 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51402613 O=C(Nc1ccc2nc3CCCn3c(=O)c2c1)\C=C\c1cc2ccccc2[nH]1 InChI=1S/C22H18N4O2/c27-21(10-8-15-12-14-4-1-2-5-18(14)23-15)24-16-7-9-19-17(13-16)22(28)26-11-3-6-20(26)25-19/h1-2,4-5,7-10,12-13,23H,3,6,11H2,(H,24,27)/b10-8+ WYMLEIQVIDRSKO-CSKARUKUSA-N 50566647 CHEMBL4853181 Cholinesterase 4470 ChEMBL 10.1016/j.bmcl.2021.128212 10.7270/Q2XS605F 34153471 Nerella, A; Jeripothula, M Kakatiya University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50566647 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50566647&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164613438 471056792 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51402614 O=C(CCCc1cc2ccccc2[nH]1)Nc1ccc2nc3CCCn3c(=O)c2c1 InChI=1S/C23H22N4O2/c28-22(9-3-6-16-13-15-5-1-2-7-19(15)24-16)25-17-10-11-20-18(14-17)23(29)27-12-4-8-21(27)26-20/h1-2,5,7,10-11,13-14,24H,3-4,6,8-9,12H2,(H,25,28) WUZKCOPCMADHEJ-UHFFFAOYSA-N 50566648 CHEMBL4870177 Cholinesterase 1600 ChEMBL 10.1016/j.bmcl.2021.128212 10.7270/Q2XS605F 34153471 Nerella, A; Jeripothula, M Kakatiya University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50566648 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50566648&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164618570 471056793 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51402615 COc1ccc2[nH]c(cc2c1)C(=O)Nc1cc2c(cc1C)nc1CCCn1c2=O InChI=1S/C22H20N4O3/c1-12-8-18-15(22(28)26-7-3-4-20(26)24-18)11-17(12)25-21(27)19-10-13-9-14(29-2)5-6-16(13)23-19/h5-6,8-11,23H,3-4,7H2,1-2H3,(H,25,27) XLIHLGPVJKZBHE-UHFFFAOYSA-N 50566649 CHEMBL4861631 Cholinesterase 5230 ChEMBL 10.1016/j.bmcl.2021.128212 10.7270/Q2XS605F 34153471 Nerella, A; Jeripothula, M Kakatiya University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50566649 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50566649&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164617606 471056794 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51402616 Cc1cc2nc3CCCn3c(=O)c2cc1NC(=O)c1cc2cc(F)ccc2[nH]1 InChI=1S/C21H17FN4O2/c1-11-7-17-14(21(28)26-6-2-3-19(26)24-17)10-16(11)25-20(27)18-9-12-8-13(22)4-5-15(12)23-18/h4-5,7-10,23H,2-3,6H2,1H3,(H,25,27) XJPSIHQTVULAQO-UHFFFAOYSA-N 50566650 CHEMBL4856921 Cholinesterase 1720 ChEMBL 10.1016/j.bmcl.2021.128212 10.7270/Q2XS605F 34153471 Nerella, A; Jeripothula, M Kakatiya University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50566650 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50566650&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164610870 471056795 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51402617 Cc1cc2nc3CCCn3c(=O)c2cc1NC(=O)c1cc2cc(Cl)ccc2[nH]1 InChI=1S/C21H17ClN4O2/c1-11-7-17-14(21(28)26-6-2-3-19(26)24-17)10-16(11)25-20(27)18-9-12-8-13(22)4-5-15(12)23-18/h4-5,7-10,23H,2-3,6H2,1H3,(H,25,27) FLCSQEKQWJVTSU-UHFFFAOYSA-N 50566651 CHEMBL4854859 Cholinesterase 4670 ChEMBL 10.1016/j.bmcl.2021.128212 10.7270/Q2XS605F 34153471 Nerella, A; Jeripothula, M Kakatiya University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50566651 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50566651&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164609662 471056796 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51402618 O=c1n2CCCc2nc2ccccc12 InChI=1S/C11H10N2O/c14-11-8-4-1-2-5-9(8)12-10-6-3-7-13(10)11/h1-2,4-5H,3,6-7H2 VARHXCYGZKSOOO-UHFFFAOYSA-N 50244216 2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-one::CHEMBL456881::cid_68261 Cholinesterase 25000 ChEMBL 10.1016/j.bmcl.2021.128212 10.7270/Q2XS605F 34153471 Nerella, A; Jeripothula, M Kakatiya University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50244216 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50244216&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 68261 104100285 CHEMBL456881 C10659 ZINC00226366 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51402619 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 10800 ChEMBL 10.1016/j.bmcl.2021.128212 10.7270/Q2XS605F 34153471 Nerella, A; Jeripothula, M Kakatiya University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51418393 Oc1ccc(cc1)C1CC(=O)c2c(O)cc(OC(=O)N3CCCCC3)cc2O1 InChI=1S/C21H21NO6/c23-14-6-4-13(5-7-14)18-12-17(25)20-16(24)10-15(11-19(20)28-18)27-21(26)22-8-2-1-3-9-22/h4-7,10-11,18,23-24H,1-3,8-9,12H2 JJBJGWQQJZMGGD-UHFFFAOYSA-N 50573079 CHEMBL4872071 Cholinesterase 1597 ChEMBL 10.1016/j.bmcl.2021.128316 10.7270/Q2P84GPV 34391893 Wu, J; Kou, X; Ju, H; Zhang, H; Yang, A; Shen, R Tianjin University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50573079 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50573079&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164624318 471063224 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51418400 Oc1ccc(cc1)C1CC(=O)c2c(O)cc(OC(=O)N3CCCCC3)cc2O1 InChI=1S/C21H21NO6/c23-14-6-4-13(5-7-14)18-12-17(25)20-16(24)10-15(11-19(20)28-18)27-21(26)22-8-2-1-3-9-22/h4-7,10-11,18,23-24H,1-3,8-9,12H2 JJBJGWQQJZMGGD-UHFFFAOYSA-N 50573079 CHEMBL4872071 Cholinesterase 94 ChEMBL 10.1016/j.bmcl.2021.128316 10.7270/Q2P84GPV 34391893 Wu, J; Kou, X; Ju, H; Zhang, H; Yang, A; Shen, R Tianjin University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50573079 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50573079&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164624318 471063224 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51418401 Oc1ccc(cc1)C1CC(=O)c2c(O)cc(OC(=O)N3CCOCC3)cc2O1 InChI=1S/C20H19NO7/c22-13-3-1-12(2-4-13)17-11-16(24)19-15(23)9-14(10-18(19)28-17)27-20(25)21-5-7-26-8-6-21/h1-4,9-10,17,22-23H,5-8,11H2 NJIZZBSOBHHSCY-UHFFFAOYSA-N 50573080 CHEMBL4848543 Cholinesterase 13720 ChEMBL 10.1016/j.bmcl.2021.128316 10.7270/Q2P84GPV 34391893 Wu, J; Kou, X; Ju, H; Zhang, H; Yang, A; Shen, R Tianjin University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50573080 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50573080&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164618311 471063225 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51418402 CCN(C)C(=O)Oc1cc(O)c2C(=O)CC(Oc2c1)c1ccc(O)cc1 InChI=1S/C19H19NO6/c1-3-20(2)19(24)25-13-8-14(22)18-15(23)10-16(26-17(18)9-13)11-4-6-12(21)7-5-11/h4-9,16,21-22H,3,10H2,1-2H3 AHNAMNHCXRAYTF-UHFFFAOYSA-N 50573081 CHEMBL4852914 Cholinesterase 3415 ChEMBL 10.1016/j.bmcl.2021.128316 10.7270/Q2P84GPV 34391893 Wu, J; Kou, X; Ju, H; Zhang, H; Yang, A; Shen, R Tianjin University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50573081 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50573081&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164612871 471063226 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51418403 CN(C)C(=O)Oc1ccc(cc1)C1CC(=O)c2c(O)cc(OC(=O)N(C)C)cc2O1 InChI=1S/C21H22N2O7/c1-22(2)20(26)28-13-7-5-12(6-8-13)17-11-16(25)19-15(24)9-14(10-18(19)30-17)29-21(27)23(3)4/h5-10,17,24H,11H2,1-4H3 RUTGPFSWZCDEEC-UHFFFAOYSA-N 50573082 CHEMBL4850938 Cholinesterase 12180 ChEMBL 10.1016/j.bmcl.2021.128316 10.7270/Q2P84GPV 34391893 Wu, J; Kou, X; Ju, H; Zhang, H; Yang, A; Shen, R Tianjin University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50573082 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50573082&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164610047 471063227 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51418404 Oc1ccc(cc1)[C@@H]1CC(=O)c2c(O)cc(O)cc2O1 InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2/t13-/m0/s1 FTVWIRXFELQLPI-ZDUSSCGKSA-N 23419 (2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one::CHEMBL9352::Naringenin Cholinesterase >100000 ChEMBL 10.1016/j.bmcl.2021.128316 10.7270/Q2P84GPV 34391893 Wu, J; Kou, X; Ju, H; Zhang, H; Yang, A; Shen, R Tianjin University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=23419 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=23419&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search NAR 4A87,2UXU,4DEU,7BUR,4D06,1CGK,2BRT,6MS8,1EYQ,7VF0,4EH3,6G8H,7VEZ,5WKS,5WKR,7YJ9,7YJ7 439246 50091683 17846 CHEMBL9352 DB03467 C00509 ZINC00156701 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51418405 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 4.0 ChEMBL 10.1016/j.bmcl.2021.128316 10.7270/Q2P84GPV 34391893 Wu, J; Kou, X; Ju, H; Zhang, H; Yang, A; Shen, R Tianjin University of Traditional Chinese Medicine http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412361 CCOC(=O)C(=N/Nc1ccccc1)\C(=O)C(F)(F)F InChI=1S/C12H11F3N2O3/c1-2-20-11(19)9(10(18)12(13,14)15)17-16-8-6-4-3-5-7-8/h3-7,16H,2H2,1H3/b17-9- HIVZWGFKJDAQNI-MFOYZWKCSA-N 50570549 CHEMBL4853742 Cholinesterase 8420 ChEMBL 10.1016/j.ejmech.2021.113385 10.7270/Q2FJ2MK0 33831780 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Kovaleva, NV; Rudakova, EV; Elkina, NA; Shchegolkov, EV; Burgart, YV; Stupina, TS; Terentiev, AA; Radchenko, EV; Palyulin, VA; Saloutin, VI; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570549 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570549&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 135431286 471060694 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412362 CCOC(=O)C(=N/Nc1ccc(C)cc1)\C(=O)C(F)(F)F InChI=1S/C13H13F3N2O3/c1-3-21-12(20)10(11(19)13(14,15)16)18-17-9-6-4-8(2)5-7-9/h4-7,17H,3H2,1-2H3/b18-10- MXVXMWJOHZMDDT-ZDLGFXPLSA-N 50570550 CHEMBL4849361 Cholinesterase 8340 ChEMBL 10.1016/j.ejmech.2021.113385 10.7270/Q2FJ2MK0 33831780 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Kovaleva, NV; Rudakova, EV; Elkina, NA; Shchegolkov, EV; Burgart, YV; Stupina, TS; Terentiev, AA; Radchenko, EV; Palyulin, VA; Saloutin, VI; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570550 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570550&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137225885 471060695 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412363 CCOC(=O)C(=N/Nc1cccc(C)c1)\C(=O)C(F)(F)F InChI=1S/C13H13F3N2O3/c1-3-21-12(20)10(11(19)13(14,15)16)18-17-9-6-4-5-8(2)7-9/h4-7,17H,3H2,1-2H3/b18-10- RXXUZBDXCWVDIB-ZDLGFXPLSA-N 50570551 CHEMBL4853637 Cholinesterase 38100 ChEMBL 10.1016/j.ejmech.2021.113385 10.7270/Q2FJ2MK0 33831780 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Kovaleva, NV; Rudakova, EV; Elkina, NA; Shchegolkov, EV; Burgart, YV; Stupina, TS; Terentiev, AA; Radchenko, EV; Palyulin, VA; Saloutin, VI; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570551 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570551&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 135475578 471060696 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412364 CCOC(=O)C(=N/Nc1ccccc1[N+]([O-])=O)\C(=O)C(F)(F)F InChI=1S/C12H10F3N3O5/c1-2-23-11(20)9(10(19)12(13,14)15)17-16-7-5-3-4-6-8(7)18(21)22/h3-6,16H,2H2,1H3/b17-9- PXWCYACVBRUFQF-MFOYZWKCSA-N 50570553 CHEMBL4854298 Cholinesterase 8060 ChEMBL 10.1016/j.ejmech.2021.113385 10.7270/Q2FJ2MK0 33831780 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Kovaleva, NV; Rudakova, EV; Elkina, NA; Shchegolkov, EV; Burgart, YV; Stupina, TS; Terentiev, AA; Radchenko, EV; Palyulin, VA; Saloutin, VI; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570553 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570553&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 142766658 471060698 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412365 CCOC(=O)C(=N/Nc1ccc(F)cc1)\C(=O)C(F)(F)F InChI=1S/C12H10F4N2O3/c1-2-21-11(20)9(10(19)12(14,15)16)18-17-8-5-3-7(13)4-6-8/h3-6,17H,2H2,1H3/b18-9- JNMIFBYVUUFRPR-NVMNQCDNSA-N 50570554 CHEMBL4858186 Cholinesterase 11300 ChEMBL 10.1016/j.ejmech.2021.113385 10.7270/Q2FJ2MK0 33831780 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Kovaleva, NV; Rudakova, EV; Elkina, NA; Shchegolkov, EV; Burgart, YV; Stupina, TS; Terentiev, AA; Radchenko, EV; Palyulin, VA; Saloutin, VI; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570554 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570554&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 135475549 471060699 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412366 CCOC(=O)C(=N/Nc1ccc(Br)cc1)\C(=O)C(F)(F)F InChI=1S/C12H10BrF3N2O3/c1-2-21-11(20)9(10(19)12(14,15)16)18-17-8-5-3-7(13)4-6-8/h3-6,17H,2H2,1H3/b18-9- STBKQHPFABRPSI-NVMNQCDNSA-N 50570555 CHEMBL4868014 Cholinesterase 2020 ChEMBL 10.1016/j.ejmech.2021.113385 10.7270/Q2FJ2MK0 33831780 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Kovaleva, NV; Rudakova, EV; Elkina, NA; Shchegolkov, EV; Burgart, YV; Stupina, TS; Terentiev, AA; Radchenko, EV; Palyulin, VA; Saloutin, VI; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570555 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570555&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 163255941 471060700 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412367 CCOC(=O)C(=N/Nc1ccccc1C(=O)OCC)\C(=O)C(F)(F)F InChI=1S/C15H15F3N2O5/c1-3-24-13(22)9-7-5-6-8-10(9)19-20-11(14(23)25-4-2)12(21)15(16,17)18/h5-8,19H,3-4H2,1-2H3/b20-11- AZFNOGDHVUHHHQ-JAIQZWGSSA-N 50570556 CHEMBL4847987 Cholinesterase 122 ChEMBL 10.1016/j.ejmech.2021.113385 10.7270/Q2FJ2MK0 33831780 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Kovaleva, NV; Rudakova, EV; Elkina, NA; Shchegolkov, EV; Burgart, YV; Stupina, TS; Terentiev, AA; Radchenko, EV; Palyulin, VA; Saloutin, VI; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570556 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570556&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164617720 471060701 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412368 CCOC(=O)C(=N/Nc1ccc(cc1)C(=O)OCC)\C(=O)C(F)(F)F InChI=1S/C15H15F3N2O5/c1-3-24-13(22)9-5-7-10(8-6-9)19-20-11(14(23)25-4-2)12(21)15(16,17)18/h5-8,19H,3-4H2,1-2H3/b20-11- VWFUHGNXIZJAQZ-JAIQZWGSSA-N 50570557 CHEMBL4856140 Cholinesterase 19600 ChEMBL 10.1016/j.ejmech.2021.113385 10.7270/Q2FJ2MK0 33831780 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Kovaleva, NV; Rudakova, EV; Elkina, NA; Shchegolkov, EV; Burgart, YV; Stupina, TS; Terentiev, AA; Radchenko, EV; Palyulin, VA; Saloutin, VI; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570557 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570557&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164609735 471060702 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412369 COC(=O)C(=N/Nc1ccccc1)\C(=O)C(F)(F)F InChI=1S/C11H9F3N2O3/c1-19-10(18)8(9(17)11(12,13)14)16-15-7-5-3-2-4-6-7/h2-6,15H,1H3/b16-8- WWZILGNFFPBJFT-PXNMLYILSA-N 50570558 CHEMBL4849436 Cholinesterase 14500 ChEMBL 10.1016/j.ejmech.2021.113385 10.7270/Q2FJ2MK0 33831780 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Kovaleva, NV; Rudakova, EV; Elkina, NA; Shchegolkov, EV; Burgart, YV; Stupina, TS; Terentiev, AA; Radchenko, EV; Palyulin, VA; Saloutin, VI; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570558 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570558&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164611089 471060703 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412370 COC(=O)C(=N/Nc1ccc(C)cc1)\C(=O)C(F)(F)F InChI=1S/C12H11F3N2O3/c1-7-3-5-8(6-4-7)16-17-9(11(19)20-2)10(18)12(13,14)15/h3-6,16H,1-2H3/b17-9- WBTOVOOOKUVTED-MFOYZWKCSA-N 50570559 CHEMBL4868687 Cholinesterase 33000 ChEMBL 10.1016/j.ejmech.2021.113385 10.7270/Q2FJ2MK0 33831780 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Kovaleva, NV; Rudakova, EV; Elkina, NA; Shchegolkov, EV; Burgart, YV; Stupina, TS; Terentiev, AA; Radchenko, EV; Palyulin, VA; Saloutin, VI; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570559 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570559&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164625142 471060704 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412371 COC(=O)C(=N/Nc1ccc(OC)cc1)\C(=O)C(F)(F)F InChI=1S/C12H11F3N2O4/c1-20-8-5-3-7(4-6-8)16-17-9(11(19)21-2)10(18)12(13,14)15/h3-6,16H,1-2H3/b17-9- VGLPFRXIRIXZEU-MFOYZWKCSA-N 50570560 CHEMBL4872772 Cholinesterase 49600 ChEMBL 10.1016/j.ejmech.2021.113385 10.7270/Q2FJ2MK0 33831780 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Kovaleva, NV; Rudakova, EV; Elkina, NA; Shchegolkov, EV; Burgart, YV; Stupina, TS; Terentiev, AA; Radchenko, EV; Palyulin, VA; Saloutin, VI; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570560 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570560&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164621601 471060705 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412372 COC(=O)C(=N/Nc1ccccc1[N+]([O-])=O)\C(=O)C(F)(F)F InChI=1S/C11H8F3N3O5/c1-22-10(19)8(9(18)11(12,13)14)16-15-6-4-2-3-5-7(6)17(20)21/h2-5,15H,1H3/b16-8- OOBCFWHYVFQICX-PXNMLYILSA-N 50570561 CHEMBL4855838 Cholinesterase 45100 ChEMBL 10.1016/j.ejmech.2021.113385 10.7270/Q2FJ2MK0 33831780 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Kovaleva, NV; Rudakova, EV; Elkina, NA; Shchegolkov, EV; Burgart, YV; Stupina, TS; Terentiev, AA; Radchenko, EV; Palyulin, VA; Saloutin, VI; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570561 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570561&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164609701 471060706 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412373 CCOC(=O)C(=N/Nc1ccc(C)cc1)\C(=O)C(F)(F)C(F)(F)F InChI=1S/C14H13F5N2O3/c1-3-24-12(23)10(11(22)13(15,16)14(17,18)19)21-20-9-6-4-8(2)5-7-9/h4-7,20H,3H2,1-2H3/b21-10- BKMKVCVTLAKWRB-FBHDLOMBSA-N 50570564 CHEMBL4853013 Cholinesterase 31100 ChEMBL 10.1016/j.ejmech.2021.113385 10.7270/Q2FJ2MK0 33831780 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Kovaleva, NV; Rudakova, EV; Elkina, NA; Shchegolkov, EV; Burgart, YV; Stupina, TS; Terentiev, AA; Radchenko, EV; Palyulin, VA; Saloutin, VI; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570564 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570564&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164616813 471060709 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412374 CCOC(=O)C(=N/Nc1ccc(C)cc1)\C(=O)C(F)(F)C(F)(F)C(F)(F)F InChI=1S/C15H13F7N2O3/c1-3-27-12(26)10(24-23-9-6-4-8(2)5-7-9)11(25)13(16,17)14(18,19)15(20,21)22/h4-7,23H,3H2,1-2H3/b24-10- JTTPEKAPMACWEK-VROXFSQNSA-N 50570565 CHEMBL4879228 Cholinesterase 42100 ChEMBL 10.1016/j.ejmech.2021.113385 10.7270/Q2FJ2MK0 33831780 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Kovaleva, NV; Rudakova, EV; Elkina, NA; Shchegolkov, EV; Burgart, YV; Stupina, TS; Terentiev, AA; Radchenko, EV; Palyulin, VA; Saloutin, VI; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570565 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570565&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164629229 471060710 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412377 COC(=O)C(=N/Nc1ccc(C)cc1)\C(=O)C(F)(F)F InChI=1S/C12H11F3N2O3/c1-7-3-5-8(6-4-7)16-17-9(11(19)20-2)10(18)12(13,14)15/h3-6,16H,1-2H3/b17-9- WBTOVOOOKUVTED-MFOYZWKCSA-N 50570559 CHEMBL4868687 Cholinesterase 29200 ChEMBL 10.1016/j.ejmech.2021.113385 10.7270/Q2FJ2MK0 33831780 Makhaeva, GF; Lushchekina, SV; Boltneva, NP; Serebryakova, OG; Kovaleva, NV; Rudakova, EV; Elkina, NA; Shchegolkov, EV; Burgart, YV; Stupina, TS; Terentiev, AA; Radchenko, EV; Palyulin, VA; Saloutin, VI; Bachurin, SO; Richardson, RJ Institute of Physiologically Active Compounds Russian Academy of Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570559 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570559&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164625142 471060704 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412408 O[C@H](CNCc1ccccc1)[C@H](Cc1ccccc1)NCC(c1ccccc1)c1ccccc1 InChI=1S/C31H34N2O/c34-31(24-32-22-26-15-7-2-8-16-26)30(21-25-13-5-1-6-14-25)33-23-29(27-17-9-3-10-18-27)28-19-11-4-12-20-28/h1-20,29-34H,21-24H2/t30-,31+/m0/s1 ZZHQZFYDXFWGDL-IOWSJCHKSA-N 50570572 CHEMBL4854010 Cholinesterase 950 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570572 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570572&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164617454 471060717 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412409 O[C@H](CNCc1ccccc1)[C@H](Cc1ccccc1)NCCC(c1ccccc1)c1ccccc1 InChI=1S/C32H36N2O/c35-32(25-33-24-27-15-7-2-8-16-27)31(23-26-13-5-1-6-14-26)34-22-21-30(28-17-9-3-10-18-28)29-19-11-4-12-20-29/h1-20,30-35H,21-25H2/t31-,32+/m0/s1 SXFRVTNEKMZFOT-AJQTZOPKSA-N 50570573 CHEMBL4850659 Cholinesterase 1540 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570573 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570573&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164610030 471060718 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412410 O[C@@H](CNCc1ccccc1)[C@H](Cc1ccccc1)NCCC(c1ccccc1)c1ccccc1 InChI=1S/C32H36N2O/c35-32(25-33-24-27-15-7-2-8-16-27)31(23-26-13-5-1-6-14-26)34-22-21-30(28-17-9-3-10-18-28)29-19-11-4-12-20-29/h1-20,30-35H,21-25H2/t31-,32-/m0/s1 SXFRVTNEKMZFOT-ACHIHNKUSA-N 50570574 CHEMBL4866859 Cholinesterase 650 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570574 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570574&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164623763 471060719 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412411 COc1ccccc1CNC[C@H](O)[C@H](Cc1ccccc1)NCC(c1ccccc1)c1ccccc1 InChI=1S/C32H36N2O2/c1-36-32-20-12-11-19-28(32)22-33-24-31(35)30(21-25-13-5-2-6-14-25)34-23-29(26-15-7-3-8-16-26)27-17-9-4-10-18-27/h2-20,29-31,33-35H,21-24H2,1H3/t30-,31-/m0/s1 DKIXHOZZKOEROH-CONSDPRKSA-N 50570575 CHEMBL4867049 Cholinesterase 320 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570575 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570575&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164621802 471060720 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412412 COc1ccccc1CNC[C@H](O)[C@H](Cc1ccccc1)NCCC(c1ccccc1)c1ccccc1 InChI=1S/C33H38N2O2/c1-37-33-20-12-11-19-29(33)24-34-25-32(36)31(23-26-13-5-2-6-14-26)35-22-21-30(27-15-7-3-8-16-27)28-17-9-4-10-18-28/h2-20,30-32,34-36H,21-25H2,1H3/t31-,32-/m0/s1 JGHKFGWGQMDYBE-ACHIHNKUSA-N 50570576 CHEMBL4878052 Cholinesterase 1010 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570576 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570576&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164626044 471060721 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412413 COc1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NCCC(c2ccccc2)c2ccccc2)c1 InChI=1S/C33H38N2O2/c1-37-30-19-11-14-27(22-30)24-34-25-33(36)32(23-26-12-5-2-6-13-26)35-21-20-31(28-15-7-3-8-16-28)29-17-9-4-10-18-29/h2-19,22,31-36H,20-21,23-25H2,1H3/t32-,33+/m0/s1 HIFISKNVBVFICL-JHOUSYSJSA-N 50570577 CHEMBL4862223 Cholinesterase 2040 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570577 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570577&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164622565 471060722 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412414 CC(C)c1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NCCC(c2ccccc2)c2ccccc2)c1 InChI=1S/C35H42N2O/c1-27(2)32-20-12-15-29(23-32)25-36-26-35(38)34(24-28-13-6-3-7-14-28)37-22-21-33(30-16-8-4-9-17-30)31-18-10-5-11-19-31/h3-20,23,27,33-38H,21-22,24-26H2,1-2H3/t34-,35+/m0/s1 WRNDRGCONGZDSY-OIDHKYIRSA-N 50570578 CHEMBL4861746 Cholinesterase 1840 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570578 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570578&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164611490 471060723 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412415 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NCC(c1ccccc1)c1ccccc1)c1ccccc1 InChI=1S/C32H36N2O/c1-25(27-16-8-3-9-17-27)33-24-32(35)31(22-26-14-6-2-7-15-26)34-23-30(28-18-10-4-11-19-28)29-20-12-5-13-21-29/h2-21,25,30-35H,22-24H2,1H3/t25-,31-,32+/m0/s1 COHDKWGFXGVKNA-FWGANANOSA-N 50570579 CHEMBL4858536 Cholinesterase 950 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570579 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570579&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164609916 471060724 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412416 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NCCC(c1ccccc1)c1ccccc1)c1ccccc1 InChI=1S/C33H38N2O/c1-26(28-16-8-3-9-17-28)35-25-33(36)32(24-27-14-6-2-7-15-27)34-23-22-31(29-18-10-4-11-19-29)30-20-12-5-13-21-30/h2-21,26,31-36H,22-25H2,1H3/t26-,32-,33+/m0/s1 UNVCFZXHNFZPFJ-FRJUPVQCSA-N 50570580 CHEMBL4862581 Cholinesterase 980 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570580 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570580&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164621650 471060725 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412417 CC(C)(NC[C@@H](O)[C@H](Cc1ccccc1)NCCC(c1ccccc1)c1ccccc1)c1ccccc1 InChI=1S/C34H40N2O/c1-34(2,30-21-13-6-14-22-30)36-26-33(37)32(25-27-15-7-3-8-16-27)35-24-23-31(28-17-9-4-10-18-28)29-19-11-5-12-20-29/h3-22,31-33,35-37H,23-26H2,1-2H3/t32-,33+/m0/s1 HTRWHSIODNCCFP-JHOUSYSJSA-N 50570581 CHEMBL4875470 Cholinesterase 1600 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570581 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570581&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164627928 471060726 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412418 CC(C)(C)NC[C@H](O)[C@H](Cc1ccccc1)NCCC(c1ccccc1)c1ccccc1 InChI=1S/C29H38N2O/c1-29(2,3)31-22-28(32)27(21-23-13-7-4-8-14-23)30-20-19-26(24-15-9-5-10-16-24)25-17-11-6-12-18-25/h4-18,26-28,30-32H,19-22H2,1-3H3/t27-,28-/m0/s1 RNIUHYMGHIOXSX-NSOVKSMOSA-N 50570582 CHEMBL4868522 Cholinesterase 190 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570582 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570582&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164620627 471060727 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412419 CC(C)(C)CNC[C@@H](O)[C@H](Cc1ccccc1)NCC(c1ccccc1)c1ccccc1 InChI=1S/C29H38N2O/c1-29(2,3)22-30-21-28(32)27(19-23-13-7-4-8-14-23)31-20-26(24-15-9-5-10-16-24)25-17-11-6-12-18-25/h4-18,26-28,30-32H,19-22H2,1-3H3/t27-,28+/m0/s1 VYNVIHJDBGWNKO-WUFINQPMSA-N 50570583 CHEMBL4862200 Cholinesterase 590 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570583 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570583&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164622120 471060728 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412420 CC(C)(C)c1cccc(CNCC(O)CNCCC(c2ccccc2)c2ccccc2)c1 InChI=1S/C29H38N2O/c1-29(2,3)26-16-10-11-23(19-26)20-31-22-27(32)21-30-18-17-28(24-12-6-4-7-13-24)25-14-8-5-9-15-25/h4-16,19,27-28,30-32H,17-18,20-22H2,1-3H3 QEVPSMYJQDNACG-UHFFFAOYSA-N 50570584 CHEMBL4860825 Cholinesterase 2920 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570584 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570584&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 154701599 471060729 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412421 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 15 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412422 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 1830 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412423 O[C@H](CNCc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C(c1ccccc1)c1ccccc1 InChI=1S/C31H32N2O2/c34-29(23-32-22-25-15-7-2-8-16-25)28(21-24-13-5-1-6-14-24)33-31(35)30(26-17-9-3-10-18-26)27-19-11-4-12-20-27/h1-20,28-30,32,34H,21-23H2,(H,33,35)/t28-,29+/m0/s1 PRXGHCUDNWBFEE-URLMMPGGSA-N 50570585 CHEMBL4878092 Cholinesterase 1510 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570585 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570585&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164626646 471060730 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412424 O[C@@H](CNCc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C(c1ccccc1)c1ccccc1 InChI=1S/C31H32N2O2/c34-29(23-32-22-25-15-7-2-8-16-25)28(21-24-13-5-1-6-14-24)33-31(35)30(26-17-9-3-10-18-26)27-19-11-4-12-20-27/h1-20,28-30,32,34H,21-23H2,(H,33,35)/t28-,29-/m0/s1 PRXGHCUDNWBFEE-VMPREFPWSA-N 50570586 CHEMBL4860122 Cholinesterase 230 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570586 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570586&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164618064 471060731 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412425 O[C@H](CNCc1ccccc1)[C@H](Cc1ccccc1)NC(=O)CC(c1ccccc1)c1ccccc1 InChI=1S/C32H34N2O2/c35-31(24-33-23-26-15-7-2-8-16-26)30(21-25-13-5-1-6-14-25)34-32(36)22-29(27-17-9-3-10-18-27)28-19-11-4-12-20-28/h1-20,29-31,33,35H,21-24H2,(H,34,36)/t30-,31+/m0/s1 YOQXSWBHQDKMDY-IOWSJCHKSA-N 50570587 CHEMBL4869613 Cholinesterase 1380 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570587 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570587&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164623843 471060732 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412426 O[C@@H](CNCc1ccccc1)[C@H](Cc1ccccc1)NC(=O)CC(c1ccccc1)c1ccccc1 InChI=1S/C32H34N2O2/c35-31(24-33-23-26-15-7-2-8-16-26)30(21-25-13-5-1-6-14-25)34-32(36)22-29(27-17-9-3-10-18-27)28-19-11-4-12-20-28/h1-20,29-31,33,35H,21-24H2,(H,34,36)/t30-,31-/m0/s1 YOQXSWBHQDKMDY-CONSDPRKSA-N 50570588 CHEMBL4845832 Cholinesterase 2940 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570588 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570588&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164609475 471060733 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412427 COc1ccccc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)C(c1ccccc1)c1ccccc1 InChI=1S/C32H34N2O3/c1-37-30-20-12-11-19-27(30)22-33-23-29(35)28(21-24-13-5-2-6-14-24)34-32(36)31(25-15-7-3-8-16-25)26-17-9-4-10-18-26/h2-20,28-29,31,33,35H,21-23H2,1H3,(H,34,36)/t28-,29-/m0/s1 MNFKVBXMVYFICG-VMPREFPWSA-N 50570589 CHEMBL4870994 Cholinesterase 110 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570589 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570589&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164623463 471060734 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412428 COc1ccccc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)CC(c1ccccc1)c1ccccc1 InChI=1S/C33H36N2O3/c1-38-32-20-12-11-19-28(32)23-34-24-31(36)30(21-25-13-5-2-6-14-25)35-33(37)22-29(26-15-7-3-8-16-26)27-17-9-4-10-18-27/h2-20,29-31,34,36H,21-24H2,1H3,(H,35,37)/t30-,31-/m0/s1 WOKVMEHUXJOESF-CONSDPRKSA-N 50570590 CHEMBL4847981 Cholinesterase 330 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570590 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570590&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164617714 471060735 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412429 COc1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)C(c2ccccc2)c2ccccc2)c1 InChI=1S/C32H34N2O3/c1-37-28-19-11-14-25(20-28)22-33-23-30(35)29(21-24-12-5-2-6-13-24)34-32(36)31(26-15-7-3-8-16-26)27-17-9-4-10-18-27/h2-20,29-31,33,35H,21-23H2,1H3,(H,34,36)/t29-,30+/m0/s1 PPHOEEHPKILQIL-XZWHSSHBSA-N 50570591 CHEMBL4873295 Cholinesterase 1550 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570591 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570591&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164620393 471060736 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412430 COc1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)CC(c2ccccc2)c2ccccc2)c1 InChI=1S/C33H36N2O3/c1-38-29-19-11-14-26(20-29)23-34-24-32(36)31(21-25-12-5-2-6-13-25)35-33(37)22-30(27-15-7-3-8-16-27)28-17-9-4-10-18-28/h2-20,30-32,34,36H,21-24H2,1H3,(H,35,37)/t31-,32+/m0/s1 LDNMOSILVHRALK-AJQTZOPKSA-N 50570592 CHEMBL4877962 Cholinesterase 1280 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570592 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570592&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164628732 471060737 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412431 CC(C)(C)c1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)C(c2ccccc2)c2ccccc2)c1 InChI=1S/C35H40N2O2/c1-35(2,3)30-21-13-16-27(22-30)24-36-25-32(38)31(23-26-14-7-4-8-15-26)37-34(39)33(28-17-9-5-10-18-28)29-19-11-6-12-20-29/h4-22,31-33,36,38H,23-25H2,1-3H3,(H,37,39)/t31-,32+/m0/s1 FDZZTBAHBJUANF-AJQTZOPKSA-N 50570570 CHEMBL4874266 Cholinesterase 60 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570570 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570570&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164628439 471060715 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412432 CC(C)(C)c1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)CC(c2ccccc2)c2ccccc2)c1 InChI=1S/C36H42N2O2/c1-36(2,3)31-21-13-16-28(22-31)25-37-26-34(39)33(23-27-14-7-4-8-15-27)38-35(40)24-32(29-17-9-5-10-18-29)30-19-11-6-12-20-30/h4-22,32-34,37,39H,23-26H2,1-3H3,(H,38,40)/t33-,34+/m0/s1 AEWDEIZUNAQJFJ-SZAHLOSFSA-N 50570593 CHEMBL4858894 Cholinesterase 450 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570593 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570593&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164615921 471060738 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412433 CC(C)c1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)C(c2ccccc2)c2ccccc2)c1 InChI=1S/C34H38N2O2/c1-25(2)30-20-12-15-27(21-30)23-35-24-32(37)31(22-26-13-6-3-7-14-26)36-34(38)33(28-16-8-4-9-17-28)29-18-10-5-11-19-29/h3-21,25,31-33,35,37H,22-24H2,1-2H3,(H,36,38)/t31-,32+/m0/s1 JNNOQIIIKZZGMK-AJQTZOPKSA-N 50570571 CHEMBL4851264 Cholinesterase 500 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570571 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570571&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164611185 471060716 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412434 CC(C)c1cccc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)C(c2ccccc2)c2ccccc2)c1 InChI=1S/C34H38N2O2/c1-25(2)30-20-12-15-27(21-30)23-35-24-32(37)31(22-26-13-6-3-7-14-26)36-34(38)33(28-16-8-4-9-17-28)29-18-10-5-11-19-29/h3-21,25,31-33,35,37H,22-24H2,1-2H3,(H,36,38)/t31-,32-/m0/s1 JNNOQIIIKZZGMK-ACHIHNKUSA-N 50570594 CHEMBL4868077 Cholinesterase 200 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570594 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570594&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164620211 471060739 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412435 CC(C)c1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)CC(c2ccccc2)c2ccccc2)c1 InChI=1S/C35H40N2O2/c1-26(2)31-20-12-15-28(21-31)24-36-25-34(38)33(22-27-13-6-3-7-14-27)37-35(39)23-32(29-16-8-4-9-17-29)30-18-10-5-11-19-30/h3-21,26,32-34,36,38H,22-25H2,1-2H3,(H,37,39)/t33-,34+/m0/s1 FSNRTXIQLFBFDM-SZAHLOSFSA-N 50570595 CHEMBL4876288 Cholinesterase 650 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570595 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570595&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164627701 471060740 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412436 O[C@@H](CNCc1cccc(c1)C(F)(F)F)[C@H](Cc1ccccc1)NC(=O)C(c1ccccc1)c1ccccc1 InChI=1S/C32H31F3N2O2/c33-32(34,35)27-18-10-13-24(19-27)21-36-22-29(38)28(20-23-11-4-1-5-12-23)37-31(39)30(25-14-6-2-7-15-25)26-16-8-3-9-17-26/h1-19,28-30,36,38H,20-22H2,(H,37,39)/t28-,29-/m0/s1 TVGSEUZKRHWEAC-VMPREFPWSA-N 50570596 CHEMBL4856694 Cholinesterase 390 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570596 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570596&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164614126 471060741 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412437 CC(C)(C)c1ccc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)C(c2ccccc2)c2ccccc2)cc1 InChI=1S/C35H40N2O2/c1-35(2,3)30-21-19-27(20-22-30)24-36-25-32(38)31(23-26-13-7-4-8-14-26)37-34(39)33(28-15-9-5-10-16-28)29-17-11-6-12-18-29/h4-22,31-33,36,38H,23-25H2,1-3H3,(H,37,39)/t31-,32-/m0/s1 HIHITZUYLBWQEI-ACHIHNKUSA-N 50570597 CHEMBL4857933 Cholinesterase 3440 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570597 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570597&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164610907 471060742 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412438 CC(C)(C)c1ccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)CC(c2ccccc2)c2ccccc2)cc1 InChI=1S/C36H42N2O2/c1-36(2,3)31-21-19-28(20-22-31)25-37-26-34(39)33(23-27-13-7-4-8-14-27)38-35(40)24-32(29-15-9-5-10-16-29)30-17-11-6-12-18-30/h4-22,32-34,37,39H,23-26H2,1-3H3,(H,38,40)/t33-,34+/m0/s1 APFPMBCRUQDCQZ-SZAHLOSFSA-N 50570598 CHEMBL4851448 Cholinesterase 170 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570598 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570598&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164617334 471060743 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412439 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)C(c1ccccc1)c1ccccc1)c1ccccc1 InChI=1S/C32H34N2O2/c1-24(26-16-8-3-9-17-26)33-23-30(35)29(22-25-14-6-2-7-15-25)34-32(36)31(27-18-10-4-11-19-27)28-20-12-5-13-21-28/h2-21,24,29-31,33,35H,22-23H2,1H3,(H,34,36)/t24-,29-,30+/m0/s1 DYTURKHMGUMVBB-QZFRTWIZSA-N 50570599 CHEMBL4857510 Cholinesterase 1820 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570599 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570599&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164616358 471060744 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412440 C[C@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)CC(c1ccccc1)c1ccccc1)c1ccccc1 InChI=1S/C33H36N2O2/c1-25(27-16-8-3-9-17-27)34-24-32(36)31(22-26-14-6-2-7-15-26)35-33(37)23-30(28-18-10-4-11-19-28)29-20-12-5-13-21-29/h2-21,25,30-32,34,36H,22-24H2,1H3,(H,35,37)/t25-,31-,32+/m0/s1 NBYDUFRCQFUAHA-FWGANANOSA-N 50570600 CHEMBL4869848 Cholinesterase 8860 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570600 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570600&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164625198 471060745 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412441 CC(C)(NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)CC(c1ccccc1)c1ccccc1)c1ccccc1 InChI=1S/C34H38N2O2/c1-34(2,29-21-13-6-14-22-29)35-25-32(37)31(23-26-15-7-3-8-16-26)36-33(38)24-30(27-17-9-4-10-18-27)28-19-11-5-12-20-28/h3-22,30-32,35,37H,23-25H2,1-2H3,(H,36,38)/t31-,32+/m0/s1 LUGJCZXQWVGSMN-AJQTZOPKSA-N 50570601 CHEMBL4873410 Cholinesterase 3230 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570601 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570601&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164625351 471060746 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412442 CC(C)(C)NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)C(c1ccccc1)c1ccccc1 InChI=1S/C28H34N2O2/c1-28(2,3)29-20-25(31)24(19-21-13-7-4-8-14-21)30-27(32)26(22-15-9-5-10-16-22)23-17-11-6-12-18-23/h4-18,24-26,29,31H,19-20H2,1-3H3,(H,30,32)/t24-,25-/m0/s1 JLQUKLIKVDVYRH-DQEYMECFSA-N 50570602 CHEMBL4861616 Cholinesterase 840 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570602 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570602&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164615874 471060747 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412443 CC(C)(C)NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)CC(c1ccccc1)c1ccccc1 InChI=1S/C29H36N2O2/c1-29(2,3)30-21-27(32)26(19-22-13-7-4-8-14-22)31-28(33)20-25(23-15-9-5-10-16-23)24-17-11-6-12-18-24/h4-18,25-27,30,32H,19-21H2,1-3H3,(H,31,33)/t26-,27-/m0/s1 SBBWEMNNOSYAIQ-SVBPBHIXSA-N 50570603 CHEMBL4857439 Cholinesterase 11800 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570603 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570603&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164614188 471060748 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412444 CC(C)(C)CNC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)C(c1ccccc1)c1ccccc1 InChI=1S/C29H36N2O2/c1-29(2,3)21-30-20-26(32)25(19-22-13-7-4-8-14-22)31-28(33)27(23-15-9-5-10-16-23)24-17-11-6-12-18-24/h4-18,25-27,30,32H,19-21H2,1-3H3,(H,31,33)/t25-,26+/m0/s1 SGKQSSMGZUXLMP-IZZNHLLZSA-N 50570604 CHEMBL4855794 Cholinesterase 100 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570604 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570604&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155920141 471060749 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412445 CC(C)(C)CNC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)CC(c1ccccc1)c1ccccc1 InChI=1S/C30H38N2O2/c1-30(2,3)22-31-21-28(33)27(19-23-13-7-4-8-14-23)32-29(34)20-26(24-15-9-5-10-16-24)25-17-11-6-12-18-25/h4-18,26-28,31,33H,19-22H2,1-3H3,(H,32,34)/t27-,28+/m0/s1 ANNGDRKIZUKLFR-WUFINQPMSA-N 50570605 CHEMBL4860617 Cholinesterase 2770 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570605 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570605&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164614314 471060750 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412446 O[C@H](CNCC1CC1)[C@H](Cc1ccccc1)NC(=O)C(c1ccccc1)c1ccccc1 InChI=1S/C28H32N2O2/c31-26(20-29-19-22-16-17-22)25(18-21-10-4-1-5-11-21)30-28(32)27(23-12-6-2-7-13-23)24-14-8-3-9-15-24/h1-15,22,25-27,29,31H,16-20H2,(H,30,32)/t25-,26+/m0/s1 ZXMUIRBSTBAFID-IZZNHLLZSA-N 50570606 CHEMBL4856275 Cholinesterase 3210 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570606 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570606&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164612391 471060751 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51412447 O[C@H](CNCC1CC1)[C@H](Cc1ccccc1)NC(=O)CC(c1ccccc1)c1ccccc1 InChI=1S/C29H34N2O2/c32-28(21-30-20-23-16-17-23)27(18-22-10-4-1-5-11-22)31-29(33)19-26(24-12-6-2-7-13-24)25-14-8-3-9-15-25/h1-15,23,26-28,30,32H,16-21H2,(H,31,33)/t27-,28+/m0/s1 FNHPSIAGJOGIQE-WUFINQPMSA-N 50570607 CHEMBL4865539 Cholinesterase 3230 ChEMBL 10.1016/j.ejmech.2021.113397 10.7270/Q29S1VTT 33838585 Pasieka, A; Panek, D; Jończyk, J; Godyń, J; Szałaj, N; Latacz, G; Tabor, J; Mezeiova, E; Chantegreil, F; Dias, J; Knez, D; Lu, J; Pi, R; Korabecny, J; Brazzolotto, X; Gobec, S; Höfner, G; Wanner, K; Więckowska, A; Malawska, B Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570607 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570607&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164624990 471060752 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51416262 CN1CCc2c(C1)c1ccccc1n2CCC(=O)N1c2ccccc2Sc2ccccc12 InChI=1S/C27H25N3OS/c1-28-16-14-22-20(18-28)19-8-2-3-9-21(19)29(22)17-15-27(31)30-23-10-4-6-12-25(23)32-26-13-7-5-11-24(26)30/h2-13H,14-18H2,1H3 CZOTVKAOVGNSQX-UHFFFAOYSA-N 50572075 CHEMBL4860501 Cholinesterase 170 ChEMBL 10.1016/j.bmc.2021.116355 10.7270/Q2JS9V7D 34391122 Schwarthoff, S; Tischer, N; Sager, H; Schätz, B; Rohrbach, MM; Raztsou, I; Robaa, D; Gaube, F; Arndt, HD; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50572075 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50572075&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 129766431 471062220 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51416263 C(N1CCc2[nH]c3ccccc3c2C1)c1ccccc1 InChI=1S/C18H18N2/c1-2-6-14(7-3-1)12-20-11-10-18-16(13-20)15-8-4-5-9-17(15)19-18/h1-9,19H,10-13H2 TWZCZLLZJDKWFN-UHFFFAOYSA-N 50572076 CHEMBL1712867 Cholinesterase 6500 ChEMBL 10.1016/j.bmc.2021.116355 10.7270/Q2JS9V7D 34391122 Schwarthoff, S; Tischer, N; Sager, H; Schätz, B; Rohrbach, MM; Raztsou, I; Robaa, D; Gaube, F; Arndt, HD; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50572076 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50572076&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 275438 471062221 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51416264 Fc1ccc2[nH]c3CCN(Cc4ccccc4)Cc3c2c1 InChI=1S/C18H17FN2/c19-14-6-7-17-15(10-14)16-12-21(9-8-18(16)20-17)11-13-4-2-1-3-5-13/h1-7,10,20H,8-9,11-12H2 QQDXGEMPVMCBOD-UHFFFAOYSA-N 50572077 CHEMBL4859070 Cholinesterase 2100 ChEMBL 10.1016/j.bmc.2021.116355 10.7270/Q2JS9V7D 34391122 Schwarthoff, S; Tischer, N; Sager, H; Schätz, B; Rohrbach, MM; Raztsou, I; Robaa, D; Gaube, F; Arndt, HD; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50572077 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50572077&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 4445525 471062222 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51416265 Cc1ccc2[nH]c3CCN(Cc4ccccc4)Cc3c2c1 InChI=1S/C19H20N2/c1-14-7-8-18-16(11-14)17-13-21(10-9-19(17)20-18)12-15-5-3-2-4-6-15/h2-8,11,20H,9-10,12-13H2,1H3 HLKQPYUVQYSQSX-UHFFFAOYSA-N 50572078 CHEMBL4856643 Cholinesterase 1400 ChEMBL 10.1016/j.bmc.2021.116355 10.7270/Q2JS9V7D 34391122 Schwarthoff, S; Tischer, N; Sager, H; Schätz, B; Rohrbach, MM; Raztsou, I; Robaa, D; Gaube, F; Arndt, HD; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50572078 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50572078&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 6619043 471062223 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51416266 COc1ccc2[nH]c3CCN(Cc4ccccc4)Cc3c2c1 InChI=1S/C19H20N2O/c1-22-15-7-8-18-16(11-15)17-13-21(10-9-19(17)20-18)12-14-5-3-2-4-6-14/h2-8,11,20H,9-10,12-13H2,1H3 FCUJMVMWOLCXGK-UHFFFAOYSA-N 50572079 CHEMBL4849640 Cholinesterase 6300 ChEMBL 10.1016/j.bmc.2021.116355 10.7270/Q2JS9V7D 34391122 Schwarthoff, S; Tischer, N; Sager, H; Schätz, B; Rohrbach, MM; Raztsou, I; Robaa, D; Gaube, F; Arndt, HD; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50572079 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50572079&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 132599 471062224 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51416267 c1ccc2c(c1)[nH]c1ccncc21 InChI=1S/C11H8N2/c1-2-4-10-8(3-1)9-7-12-6-5-11(9)13-10/h1-7,13H RDMFHRSPDKWERA-UHFFFAOYSA-N 50572080 5H-Pyrido[4,3-B]Indole::CHEMBL12540::Gama-Carboline Cholinesterase 1200 ChEMBL 10.1016/j.bmc.2021.116355 10.7270/Q2JS9V7D 34391122 Schwarthoff, S; Tischer, N; Sager, H; Schätz, B; Rohrbach, MM; Raztsou, I; Robaa, D; Gaube, F; Arndt, HD; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50572080 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50572080&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 130802 471062225 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51416268 Fc1ccc2[nH]c3ccncc3c2c1 InChI=1S/C11H7FN2/c12-7-1-2-10-8(5-7)9-6-13-4-3-11(9)14-10/h1-6,14H XDMDASHVJGGFLB-UHFFFAOYSA-N 50572081 CHEMBL4863376 Cholinesterase 550 ChEMBL 10.1016/j.bmc.2021.116355 10.7270/Q2JS9V7D 34391122 Schwarthoff, S; Tischer, N; Sager, H; Schätz, B; Rohrbach, MM; Raztsou, I; Robaa, D; Gaube, F; Arndt, HD; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50572081 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50572081&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 604196 471062226 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51416269 Cc1ccc2[nH]c3ccncc3c2c1 InChI=1S/C12H10N2/c1-8-2-3-11-9(6-8)10-7-13-5-4-12(10)14-11/h2-7,14H,1H3 FWFZLMCEYFKUTG-UHFFFAOYSA-N 50572082 CHEMBL261855 Cholinesterase 1400 ChEMBL 10.1016/j.bmc.2021.116355 10.7270/Q2JS9V7D 34391122 Schwarthoff, S; Tischer, N; Sager, H; Schätz, B; Rohrbach, MM; Raztsou, I; Robaa, D; Gaube, F; Arndt, HD; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50572082 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50572082&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44451575 471062227 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51416270 COc1ccc2[nH]c3ccncc3c2c1 InChI=1S/C12H10N2O/c1-15-8-2-3-11-9(6-8)10-7-13-5-4-12(10)14-11/h2-7,14H,1H3 JDDPTXUPKJEPTE-UHFFFAOYSA-N 50572083 CHEMBL4846730 Cholinesterase 12600 ChEMBL 10.1016/j.bmc.2021.116355 10.7270/Q2JS9V7D 34391122 Schwarthoff, S; Tischer, N; Sager, H; Schätz, B; Rohrbach, MM; Raztsou, I; Robaa, D; Gaube, F; Arndt, HD; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50572083 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50572083&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 91665961 471062228 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51416271 O=C(CCn1c2ccccc2c2cnccc12)N1c2ccccc2Sc2ccccc12 InChI=1S/C26H19N3OS/c30-26(29-22-9-3-5-11-24(22)31-25-12-6-4-10-23(25)29)14-16-28-20-8-2-1-7-18(20)19-17-27-15-13-21(19)28/h1-13,15,17H,14,16H2 FYRFGJSXHGSSRA-UHFFFAOYSA-N 50572066 CHEMBL4848411 Cholinesterase 8.0 ChEMBL 10.1016/j.bmc.2021.116355 10.7270/Q2JS9V7D 34391122 Schwarthoff, S; Tischer, N; Sager, H; Schätz, B; Rohrbach, MM; Raztsou, I; Robaa, D; Gaube, F; Arndt, HD; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50572066 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50572066&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164613856 471062211 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51416272 Fc1ccc2n(CCC(=O)N3c4ccccc4Sc4ccccc34)c3ccncc3c2c1 InChI=1S/C26H18FN3OS/c27-17-9-10-20-18(15-17)19-16-28-13-11-21(19)29(20)14-12-26(31)30-22-5-1-3-7-24(22)32-25-8-4-2-6-23(25)30/h1-11,13,15-16H,12,14H2 GUDOKVFOWONHLZ-UHFFFAOYSA-N 50572067 CHEMBL4864593 Cholinesterase 8.0 ChEMBL 10.1016/j.bmc.2021.116355 10.7270/Q2JS9V7D 34391122 Schwarthoff, S; Tischer, N; Sager, H; Schätz, B; Rohrbach, MM; Raztsou, I; Robaa, D; Gaube, F; Arndt, HD; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50572067 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50572067&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164624952 471062212 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51416273 Cc1ccc2n(CCC(=O)N3c4ccccc4Sc4ccccc34)c3ccncc3c2c1 InChI=1S/C27H21N3OS/c1-18-10-11-21-19(16-18)20-17-28-14-12-22(20)29(21)15-13-27(31)30-23-6-2-4-8-25(23)32-26-9-5-3-7-24(26)30/h2-12,14,16-17H,13,15H2,1H3 OHLLCAOZLCURLY-UHFFFAOYSA-N 50572068 CHEMBL4855045 Cholinesterase 16 ChEMBL 10.1016/j.bmc.2021.116355 10.7270/Q2JS9V7D 34391122 Schwarthoff, S; Tischer, N; Sager, H; Schätz, B; Rohrbach, MM; Raztsou, I; Robaa, D; Gaube, F; Arndt, HD; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50572068 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50572068&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164616318 471062213 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51416274 COc1ccc2n(CCC(=O)N3c4ccccc4Sc4ccccc34)c3ccncc3c2c1 InChI=1S/C27H21N3O2S/c1-32-18-10-11-21-19(16-18)20-17-28-14-12-22(20)29(21)15-13-27(31)30-23-6-2-4-8-25(23)33-26-9-5-3-7-24(26)30/h2-12,14,16-17H,13,15H2,1H3 BTQBWKICBNYTJF-UHFFFAOYSA-N 50572069 CHEMBL4850585 Cholinesterase 37 ChEMBL 10.1016/j.bmc.2021.116355 10.7270/Q2JS9V7D 34391122 Schwarthoff, S; Tischer, N; Sager, H; Schätz, B; Rohrbach, MM; Raztsou, I; Robaa, D; Gaube, F; Arndt, HD; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50572069 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50572069&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164616141 471062214 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51416275 [I-].C[n+]1ccc2n(CCC(=O)N3c4ccccc4Sc4ccccc34)c3ccccc3c2c1 InChI=1S/C27H22N3OS.HI/c1-28-16-14-22-20(18-28)19-8-2-3-9-21(19)29(22)17-15-27(31)30-23-10-4-6-12-25(23)32-26-13-7-5-11-24(26)30;/h2-14,16,18H,15,17H2,1H3;1H/q+1;/p-1 CIOBROXMDRKRND-UHFFFAOYSA-M 50572070 CHEMBL4870561 Cholinesterase 41 ChEMBL 10.1016/j.bmc.2021.116355 10.7270/Q2JS9V7D 34391122 Schwarthoff, S; Tischer, N; Sager, H; Schätz, B; Rohrbach, MM; Raztsou, I; Robaa, D; Gaube, F; Arndt, HD; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50572070 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50572070&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164621978 471062215 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51416276 [I-].C[n+]1ccc2n(CCC(=O)N3c4ccccc4Sc4ccccc34)c3ccc(F)cc3c2c1 InChI=1S/C27H21FN3OS.HI/c1-29-14-12-22-20(17-29)19-16-18(28)10-11-21(19)30(22)15-13-27(32)31-23-6-2-4-8-25(23)33-26-9-5-3-7-24(26)31;/h2-12,14,16-17H,13,15H2,1H3;1H/q+1;/p-1 UFUNJAXKRQLFJP-UHFFFAOYSA-M 50572071 CHEMBL4874126 Cholinesterase 32 ChEMBL 10.1016/j.bmc.2021.116355 10.7270/Q2JS9V7D 34391122 Schwarthoff, S; Tischer, N; Sager, H; Schätz, B; Rohrbach, MM; Raztsou, I; Robaa, D; Gaube, F; Arndt, HD; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50572071 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50572071&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164626951 471062216 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51416277 [I-].Cc1ccc2n(CCC(=O)N3c4ccccc4Sc4ccccc34)c3cc[n+](C)cc3c2c1 InChI=1S/C28H24N3OS.HI/c1-19-11-12-22-20(17-19)21-18-29(2)15-13-23(21)30(22)16-14-28(32)31-24-7-3-5-9-26(24)33-27-10-6-4-8-25(27)31;/h3-13,15,17-18H,14,16H2,1-2H3;1H/q+1;/p-1 BIUNFSSTZHGILH-UHFFFAOYSA-M 50572072 CHEMBL4873748 Cholinesterase 32 ChEMBL 10.1016/j.bmc.2021.116355 10.7270/Q2JS9V7D 34391122 Schwarthoff, S; Tischer, N; Sager, H; Schätz, B; Rohrbach, MM; Raztsou, I; Robaa, D; Gaube, F; Arndt, HD; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50572072 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50572072&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164621225 471062217 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51416278 [I-].COc1ccc2n(CCC(=O)N3c4ccccc4Sc4ccccc34)c3cc[n+](C)cc3c2c1 InChI=1S/C28H24N3O2S.HI/c1-29-15-13-23-21(18-29)20-17-19(33-2)11-12-22(20)30(23)16-14-28(32)31-24-7-3-5-9-26(24)34-27-10-6-4-8-25(27)31;/h3-13,15,17-18H,14,16H2,1-2H3;1H/q+1;/p-1 KVNGRUIHOVASGF-UHFFFAOYSA-M 50572073 CHEMBL4878924 Cholinesterase 41 ChEMBL 10.1016/j.bmc.2021.116355 10.7270/Q2JS9V7D 34391122 Schwarthoff, S; Tischer, N; Sager, H; Schätz, B; Rohrbach, MM; Raztsou, I; Robaa, D; Gaube, F; Arndt, HD; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50572073 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50572073&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164627534 471062218 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51416279 [Br-].O=C(CCn1c2ccccc2c2c[n+](Cc3ccccc3)ccc12)N1c2ccccc2Sc2ccccc12 InChI=1S/C33H26N3OS.BrH/c37-33(36-29-14-6-8-16-31(29)38-32-17-9-7-15-30(32)36)19-21-35-27-13-5-4-12-25(27)26-23-34(20-18-28(26)35)22-24-10-2-1-3-11-24;/h1-18,20,23H,19,21-22H2;1H/q+1;/p-1 XMDNJVWLAXFRON-UHFFFAOYSA-M 50572074 CHEMBL4850804 Cholinesterase 11 ChEMBL 10.1016/j.bmc.2021.116355 10.7270/Q2JS9V7D 34391122 Schwarthoff, S; Tischer, N; Sager, H; Schätz, B; Rohrbach, MM; Raztsou, I; Robaa, D; Gaube, F; Arndt, HD; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50572074 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50572074&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164612789 471062219 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51416280 I.Cn1ccc2nc3ccccc3c2c1 InChI=1S/C12H10N2.HI/c1-14-7-6-12-10(8-14)9-4-2-3-5-11(9)13-12;/h2-8H,1H3;1H RFHYRRSTSZAGPX-UHFFFAOYSA-N 50572084 CHEMBL596112 Cholinesterase 890 ChEMBL 10.1016/j.bmc.2021.116355 10.7270/Q2JS9V7D 34391122 Schwarthoff, S; Tischer, N; Sager, H; Schätz, B; Rohrbach, MM; Raztsou, I; Robaa, D; Gaube, F; Arndt, HD; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50572084 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50572084&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 46228115 471062229 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51416281 [I-].C[n+]1ccc2[nH]c3ccc(F)cc3c2c1 InChI=1S/C12H9FN2.HI/c1-15-5-4-12-10(7-15)9-6-8(13)2-3-11(9)14-12;/h2-7H,1H3;1H DSHSZSVVNRGDOH-UHFFFAOYSA-N 50572085 CHEMBL4849276 Cholinesterase 2700 ChEMBL 10.1016/j.bmc.2021.116355 10.7270/Q2JS9V7D 34391122 Schwarthoff, S; Tischer, N; Sager, H; Schätz, B; Rohrbach, MM; Raztsou, I; Robaa, D; Gaube, F; Arndt, HD; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50572085 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50572085&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164614926 471062230 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51416282 [I-].Cc1ccc2[nH]c3cc[n+](C)cc3c2c1 InChI=1S/C13H12N2.HI/c1-9-3-4-12-10(7-9)11-8-15(2)6-5-13(11)14-12;/h3-8H,1-2H3;1H SJRRVCFKDUWHBE-UHFFFAOYSA-N 50572086 CHEMBL4865927 Cholinesterase 5500 ChEMBL 10.1016/j.bmc.2021.116355 10.7270/Q2JS9V7D 34391122 Schwarthoff, S; Tischer, N; Sager, H; Schätz, B; Rohrbach, MM; Raztsou, I; Robaa, D; Gaube, F; Arndt, HD; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50572086 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50572086&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164620546 471062231 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51416283 [I-].COc1ccc2[nH]c3cc[n+](C)cc3c2c1 InChI=1S/C13H12N2O.HI/c1-15-6-5-13-11(8-15)10-7-9(16-2)3-4-12(10)14-13;/h3-8H,1-2H3;1H BFNZZJUMQUNABL-UHFFFAOYSA-N 50572087 CHEMBL4857977 Cholinesterase 9800 ChEMBL 10.1016/j.bmc.2021.116355 10.7270/Q2JS9V7D 34391122 Schwarthoff, S; Tischer, N; Sager, H; Schätz, B; Rohrbach, MM; Raztsou, I; Robaa, D; Gaube, F; Arndt, HD; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50572087 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50572087&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164611936 471062232 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51416284 [Br-].C(c1ccccc1)[n+]1ccc2[nH]c3ccccc3c2c1 InChI=1S/C18H14N2.BrH/c1-2-6-14(7-3-1)12-20-11-10-18-16(13-20)15-8-4-5-9-17(15)19-18;/h1-11,13H,12H2;1H ZHWSYUFCBCAESV-UHFFFAOYSA-N 50572088 CHEMBL4850464 Cholinesterase 1900 ChEMBL 10.1016/j.bmc.2021.116355 10.7270/Q2JS9V7D 34391122 Schwarthoff, S; Tischer, N; Sager, H; Schätz, B; Rohrbach, MM; Raztsou, I; Robaa, D; Gaube, F; Arndt, HD; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50572088 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50572088&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164612162 471062233 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51416285 CN1CCc2[nH]c3ccccc3c2C1 InChI=1S/C12H14N2/c1-14-7-6-12-10(8-14)9-4-2-3-5-11(9)13-12/h2-5,13H,6-8H2,1H3 FYHWPFXPFFPQRT-UHFFFAOYSA-N 50485640 CHEMBL1984135 Cholinesterase 6500 ChEMBL 10.1016/j.bmc.2021.116355 10.7270/Q2JS9V7D 34391122 Schwarthoff, S; Tischer, N; Sager, H; Schätz, B; Rohrbach, MM; Raztsou, I; Robaa, D; Gaube, F; Arndt, HD; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50485640 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50485640&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 97424 433952905 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51416286 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 1300 ChEMBL 10.1016/j.bmc.2021.116355 10.7270/Q2JS9V7D 34391122 Schwarthoff, S; Tischer, N; Sager, H; Schätz, B; Rohrbach, MM; Raztsou, I; Robaa, D; Gaube, F; Arndt, HD; Winckler, T University of Jena http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51427379 Oc1ccccc1CNc1ccc2nc3CCCn3c(=O)c2c1 InChI=1S/C18H17N3O2/c22-16-5-2-1-4-12(16)11-19-13-7-8-15-14(10-13)18(23)21-9-3-6-17(21)20-15/h1-2,4-5,7-8,10,19,22H,3,6,9,11H2 GPASUWAUVPEWRH-UHFFFAOYSA-N 50576577 CHEMBL4846102 Cholinesterase 18190 ChEMBL 10.1016/j.bmc.2021.116311 10.7270/Q24F1VKP 34304133 Bowroju, SK; Penthala, NR; Lakkaniga, NR; Balasubramaniam, M; Ayyadevara, S; Shmookler Reis, RJ; Crooks, PA University of Arkansas for Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50576577 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50576577&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164609593 471052700 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51427380 Oc1c(Br)cccc1CNc1ccc2nc3CCCn3c(=O)c2c1 InChI=1S/C18H16BrN3O2/c19-14-4-1-3-11(17(14)23)10-20-12-6-7-15-13(9-12)18(24)22-8-2-5-16(22)21-15/h1,3-4,6-7,9,20,23H,2,5,8,10H2 XNIIZXAGWLPTRZ-UHFFFAOYSA-N 50576578 CHEMBL4871074 Cholinesterase 20920 ChEMBL 10.1016/j.bmc.2021.116311 10.7270/Q24F1VKP 34304133 Bowroju, SK; Penthala, NR; Lakkaniga, NR; Balasubramaniam, M; Ayyadevara, S; Shmookler Reis, RJ; Crooks, PA University of Arkansas for Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50576578 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50576578&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164618591 471052701 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51427381 Oc1cc(Cl)ccc1CNc1ccc2nc3CCCn3c(=O)c2c1 InChI=1S/C18H16ClN3O2/c19-12-4-3-11(16(23)8-12)10-20-13-5-6-15-14(9-13)18(24)22-7-1-2-17(22)21-15/h3-6,8-9,20,23H,1-2,7,10H2 TVQYUDLGIGPQTI-UHFFFAOYSA-N 50576579 CHEMBL4876164 Cholinesterase 21650 ChEMBL 10.1016/j.bmc.2021.116311 10.7270/Q24F1VKP 34304133 Bowroju, SK; Penthala, NR; Lakkaniga, NR; Balasubramaniam, M; Ayyadevara, S; Shmookler Reis, RJ; Crooks, PA University of Arkansas for Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50576579 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50576579&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164628667 471052702 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51427382 COc1cccc(CNc2ccc3nc4CCCn4c(=O)c3c2)c1O InChI=1S/C19H19N3O3/c1-25-16-5-2-4-12(18(16)23)11-20-13-7-8-15-14(10-13)19(24)22-9-3-6-17(22)21-15/h2,4-5,7-8,10,20,23H,3,6,9,11H2,1H3 GOBRQURQCPYHCP-UHFFFAOYSA-N 50576580 CHEMBL4874834 Cholinesterase 16050 ChEMBL 10.1016/j.bmc.2021.116311 10.7270/Q24F1VKP 34304133 Bowroju, SK; Penthala, NR; Lakkaniga, NR; Balasubramaniam, M; Ayyadevara, S; Shmookler Reis, RJ; Crooks, PA University of Arkansas for Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50576580 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50576580&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164627892 471052703 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51427383 Oc1ccc(Br)cc1CNc1ccc2nc3CCCn3c(=O)c2c1 InChI=1S/C18H16BrN3O2/c19-12-3-6-16(23)11(8-12)10-20-13-4-5-15-14(9-13)18(24)22-7-1-2-17(22)21-15/h3-6,8-9,20,23H,1-2,7,10H2 FGJRCJIYVGSSQV-UHFFFAOYSA-N 50576581 CHEMBL4871454 Cholinesterase 21490 ChEMBL 10.1016/j.bmc.2021.116311 10.7270/Q24F1VKP 34304133 Bowroju, SK; Penthala, NR; Lakkaniga, NR; Balasubramaniam, M; Ayyadevara, S; Shmookler Reis, RJ; Crooks, PA University of Arkansas for Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50576581 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50576581&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164620330 471052704 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51427384 Oc1ccc(F)cc1CNc1ccc2nc3CCCn3c(=O)c2c1 InChI=1S/C18H16FN3O2/c19-12-3-6-16(23)11(8-12)10-20-13-4-5-15-14(9-13)18(24)22-7-1-2-17(22)21-15/h3-6,8-9,20,23H,1-2,7,10H2 PDTGQFZPCGXYQE-UHFFFAOYSA-N 50576582 CHEMBL4861468 Cholinesterase 19860 ChEMBL 10.1016/j.bmc.2021.116311 10.7270/Q24F1VKP 34304133 Bowroju, SK; Penthala, NR; Lakkaniga, NR; Balasubramaniam, M; Ayyadevara, S; Shmookler Reis, RJ; Crooks, PA University of Arkansas for Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50576582 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50576582&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164613185 471052705 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51427385 COc1ccc(CNc2ccc3nc4CCCn4c(=O)c3c2)c(O)c1 InChI=1S/C19H19N3O3/c1-25-14-6-4-12(17(23)10-14)11-20-13-5-7-16-15(9-13)19(24)22-8-2-3-18(22)21-16/h4-7,9-10,20,23H,2-3,8,11H2,1H3 JFABMAWFPIKNHR-UHFFFAOYSA-N 50576583 CHEMBL4852660 Cholinesterase 15380 ChEMBL 10.1016/j.bmc.2021.116311 10.7270/Q24F1VKP 34304133 Bowroju, SK; Penthala, NR; Lakkaniga, NR; Balasubramaniam, M; Ayyadevara, S; Shmookler Reis, RJ; Crooks, PA University of Arkansas for Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50576583 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50576583&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164617891 471052706 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51427386 Cc1cc2nc3CCCn3c(=O)c2cc1NCc1ccccc1O InChI=1S/C19H19N3O2/c1-12-9-16-14(19(24)22-8-4-7-18(22)21-16)10-15(12)20-11-13-5-2-3-6-17(13)23/h2-3,5-6,9-10,20,23H,4,7-8,11H2,1H3 BGHPQGWCHCMYRN-UHFFFAOYSA-N 50576584 CHEMBL4849288 Cholinesterase 18470 ChEMBL 10.1016/j.bmc.2021.116311 10.7270/Q24F1VKP 34304133 Bowroju, SK; Penthala, NR; Lakkaniga, NR; Balasubramaniam, M; Ayyadevara, S; Shmookler Reis, RJ; Crooks, PA University of Arkansas for Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50576584 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50576584&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164614935 471052707 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51427387 Cc1cc2nc3CCCn3c(=O)c2cc1NCc1cccc(Br)c1O InChI=1S/C19H18BrN3O2/c1-11-8-16-13(19(25)23-7-3-6-17(23)22-16)9-15(11)21-10-12-4-2-5-14(20)18(12)24/h2,4-5,8-9,21,24H,3,6-7,10H2,1H3 USWKFGHOSRPPQF-UHFFFAOYSA-N 50576585 CHEMBL4879281 Cholinesterase 21600 ChEMBL 10.1016/j.bmc.2021.116311 10.7270/Q24F1VKP 34304133 Bowroju, SK; Penthala, NR; Lakkaniga, NR; Balasubramaniam, M; Ayyadevara, S; Shmookler Reis, RJ; Crooks, PA University of Arkansas for Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50576585 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50576585&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164627131 471052708 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51427388 Cc1cc2nc3CCCn3c(=O)c2cc1NCc1ccc(Cl)cc1O InChI=1S/C19H18ClN3O2/c1-11-7-16-14(19(25)23-6-2-3-18(23)22-16)9-15(11)21-10-12-4-5-13(20)8-17(12)24/h4-5,7-9,21,24H,2-3,6,10H2,1H3 OYJAEYRVAJZLSF-UHFFFAOYSA-N 50576586 CHEMBL4875354 Cholinesterase 20520 ChEMBL 10.1016/j.bmc.2021.116311 10.7270/Q24F1VKP 34304133 Bowroju, SK; Penthala, NR; Lakkaniga, NR; Balasubramaniam, M; Ayyadevara, S; Shmookler Reis, RJ; Crooks, PA University of Arkansas for Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50576586 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50576586&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164625933 471052709 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51427389 COc1cccc(CNc2cc3c(cc2C)nc2CCCn2c3=O)c1O InChI=1S/C20H21N3O3/c1-12-9-16-14(20(25)23-8-4-7-18(23)22-16)10-15(12)21-11-13-5-3-6-17(26-2)19(13)24/h3,5-6,9-10,21,24H,4,7-8,11H2,1-2H3 YWVUFDZNTCBLDO-UHFFFAOYSA-N 50576587 CHEMBL4870217 Cholinesterase 16180 ChEMBL 10.1016/j.bmc.2021.116311 10.7270/Q24F1VKP 34304133 Bowroju, SK; Penthala, NR; Lakkaniga, NR; Balasubramaniam, M; Ayyadevara, S; Shmookler Reis, RJ; Crooks, PA University of Arkansas for Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50576587 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50576587&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164621107 471052710 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51427390 Cc1cc2nc3CCCn3c(=O)c2cc1NCc1cc(Br)ccc1O InChI=1S/C19H18BrN3O2/c1-11-7-16-14(19(25)23-6-2-3-18(23)22-16)9-15(11)21-10-12-8-13(20)4-5-17(12)24/h4-5,7-9,21,24H,2-3,6,10H2,1H3 KJCMHRMMWHGUTE-UHFFFAOYSA-N 50576588 CHEMBL4853059 Cholinesterase 20820 ChEMBL 10.1016/j.bmc.2021.116311 10.7270/Q24F1VKP 34304133 Bowroju, SK; Penthala, NR; Lakkaniga, NR; Balasubramaniam, M; Ayyadevara, S; Shmookler Reis, RJ; Crooks, PA University of Arkansas for Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50576588 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50576588&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164617903 471052711 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51427391 Cc1cc2nc3CCCn3c(=O)c2cc1NCc1cc(F)ccc1O InChI=1S/C19H18FN3O2/c1-11-7-16-14(19(25)23-6-2-3-18(23)22-16)9-15(11)21-10-12-8-13(20)4-5-17(12)24/h4-5,7-9,21,24H,2-3,6,10H2,1H3 VBNOCCNNEJJYNI-UHFFFAOYSA-N 50576589 CHEMBL4856085 Cholinesterase 20420 ChEMBL 10.1016/j.bmc.2021.116311 10.7270/Q24F1VKP 34304133 Bowroju, SK; Penthala, NR; Lakkaniga, NR; Balasubramaniam, M; Ayyadevara, S; Shmookler Reis, RJ; Crooks, PA University of Arkansas for Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50576589 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50576589&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164610816 471052712 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51427392 COc1ccc(CNc2cc3c(cc2C)nc2CCCn2c3=O)c(O)c1 InChI=1S/C20H21N3O3/c1-12-8-17-15(20(25)23-7-3-4-19(23)22-17)10-16(12)21-11-13-5-6-14(26-2)9-18(13)24/h5-6,8-10,21,24H,3-4,7,11H2,1-2H3 OYIGHVWTUBUKDT-UHFFFAOYSA-N 50576590 CHEMBL4860689 Cholinesterase 14600 ChEMBL 10.1016/j.bmc.2021.116311 10.7270/Q24F1VKP 34304133 Bowroju, SK; Penthala, NR; Lakkaniga, NR; Balasubramaniam, M; Ayyadevara, S; Shmookler Reis, RJ; Crooks, PA University of Arkansas for Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50576590 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50576590&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164616487 471052713 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51427393 O=c1n2CCCc2nc2ccccc12 InChI=1S/C11H10N2O/c14-11-8-4-1-2-5-9(8)12-10-6-3-7-13(10)11/h1-2,4-5H,3,6-7H2 VARHXCYGZKSOOO-UHFFFAOYSA-N 50244216 2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-one::CHEMBL456881::cid_68261 Cholinesterase 25000 ChEMBL 10.1016/j.bmc.2021.116311 10.7270/Q24F1VKP 34304133 Bowroju, SK; Penthala, NR; Lakkaniga, NR; Balasubramaniam, M; Ayyadevara, S; Shmookler Reis, RJ; Crooks, PA University of Arkansas for Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50244216 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50244216&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 68261 104100285 CHEMBL456881 C10659 ZINC00226366 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51422648 CCCCCc1cc(O)c([C@@H]2C=C(C)CC[C@H]2C(C)=C)c(O)c1 InChI=1S/C21H30O2/c1-5-6-7-8-16-12-19(22)21(20(23)13-16)18-11-15(4)9-10-17(18)14(2)3/h11-13,17-18,22-23H,2,5-10H2,1,3-4H3/t17-,18+/m0/s1 QHMBSVQNZZTUGM-ZWKOTPCHSA-N 50318484 2-((1R,6R)-6-Isopropenyl-3-methyl-cyclohex-2-enyl)-5-pentyl-benzene-1,3-diol::CANNABIDIOL::CHEMBL190461 Cholinesterase 670 ChEMBL 10.1016/j.ejmech.2021.113735 10.7270/Q2H41W7X 34371367 Jiang, X; Zhang, Z; Zuo, J; Wu, C; Zha, L; Xu, Y; Wang, S; Shi, J; Liu, XH; Zhang, J; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50318484 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50318484&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search P0T 8FX8,7TE8,8FXG,6U88,6U8A,7T37 644019 104152845 69478 CHEMBL190461 4150 C07578 ZINC04097406 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51422649 CCCCCc1cc(O)c([C@@H]2C=C(C)CC[C@H]2C(C)=C)c(OC(=O)N(C)CC)c1 InChI=1S/C25H37NO3/c1-7-9-10-11-19-15-22(27)24(23(16-19)29-25(28)26(6)8-2)21-14-18(5)12-13-20(21)17(3)4/h14-16,20-21,27H,3,7-13H2,1-2,4-6H3/t20-,21+/m0/s1 HUNHKOCOXRQNLM-LEWJYISDSA-N 50574798 CHEMBL4867218 Cholinesterase 77 ChEMBL 10.1016/j.ejmech.2021.113735 10.7270/Q2H41W7X 34371367 Jiang, X; Zhang, Z; Zuo, J; Wu, C; Zha, L; Xu, Y; Wang, S; Shi, J; Liu, XH; Zhang, J; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574798 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574798&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155448212 471064943 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51422650 CCCCCc1cc(O)c([C@@H]2C=C(C)CC[C@H]2C(C)=C)c(OC(=O)N2CCCC2)c1 InChI=1S/C26H37NO3/c1-5-6-7-10-20-16-23(28)25(22-15-19(4)11-12-21(22)18(2)3)24(17-20)30-26(29)27-13-8-9-14-27/h15-17,21-22,28H,2,5-14H2,1,3-4H3/t21-,22+/m0/s1 LUUMJPDLULEIGC-FCHUYYIVSA-N 50574801 CHEMBL4847128 Cholinesterase 390 ChEMBL 10.1016/j.ejmech.2021.113735 10.7270/Q2H41W7X 34371367 Jiang, X; Zhang, Z; Zuo, J; Wu, C; Zha, L; Xu, Y; Wang, S; Shi, J; Liu, XH; Zhang, J; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574801 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574801&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164608933 471064946 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51422651 CCCCCc1cc(O)c([C@@H]2C=C(C)CC[C@H]2C(C)=C)c(OC(=O)N2CCOCC2)c1 InChI=1S/C26H37NO4/c1-5-6-7-8-20-16-23(28)25(22-15-19(4)9-10-21(22)18(2)3)24(17-20)31-26(29)27-11-13-30-14-12-27/h15-17,21-22,28H,2,5-14H2,1,3-4H3/t21-,22+/m0/s1 MEOQYPYRTJXVNX-FCHUYYIVSA-N 50574802 CHEMBL4857281 Cholinesterase 1890 ChEMBL 10.1016/j.ejmech.2021.113735 10.7270/Q2H41W7X 34371367 Jiang, X; Zhang, Z; Zuo, J; Wu, C; Zha, L; Xu, Y; Wang, S; Shi, J; Liu, XH; Zhang, J; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574802 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574802&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164615820 471064947 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51422652 CCCCCc1cc(OC(=O)N(C)CC)c([C@@H]2C=C(C)CC[C@H]2C(C)=C)c(OC(=O)N(C)CC)c1 InChI=1S/C29H44N2O4/c1-9-12-13-14-22-18-25(34-28(32)30(7)10-2)27(26(19-22)35-29(33)31(8)11-3)24-17-21(6)15-16-23(24)20(4)5/h17-19,23-24H,4,9-16H2,1-3,5-8H3/t23-,24+/m0/s1 PQWMLYNOSZRGOH-BJKOFHAPSA-N 50574803 CHEMBL4878990 Cholinesterase 290 ChEMBL 10.1016/j.ejmech.2021.113735 10.7270/Q2H41W7X 34371367 Jiang, X; Zhang, Z; Zuo, J; Wu, C; Zha, L; Xu, Y; Wang, S; Shi, J; Liu, XH; Zhang, J; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574803 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574803&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164628778 471064948 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51422653 CCCCCc1cc(OC(=O)N2CCCC2)c([C@@H]2C=C(C)CC[C@H]2C(C)=C)c(OC(=O)N2CCCC2)c1 InChI=1S/C31H44N2O4/c1-5-6-7-12-24-20-27(36-30(34)32-15-8-9-16-32)29(26-19-23(4)13-14-25(26)22(2)3)28(21-24)37-31(35)33-17-10-11-18-33/h19-21,25-26H,2,5-18H2,1,3-4H3/t25-,26+/m0/s1 NZLKICCGDPKVAX-IZZNHLLZSA-N 50574804 CHEMBL4848046 Cholinesterase 530 ChEMBL 10.1016/j.ejmech.2021.113735 10.7270/Q2H41W7X 34371367 Jiang, X; Zhang, Z; Zuo, J; Wu, C; Zha, L; Xu, Y; Wang, S; Shi, J; Liu, XH; Zhang, J; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574804 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574804&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164609964 471064949 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51422654 CCCCCc1cc(OC(=O)N2CCOCC2)c([C@@H]2C=C(C)CC[C@H]2C(C)=C)c(OC(=O)N2CCOCC2)c1 InChI=1S/C31H44N2O6/c1-5-6-7-8-24-20-27(38-30(34)32-11-15-36-16-12-32)29(26-19-23(4)9-10-25(26)22(2)3)28(21-24)39-31(35)33-13-17-37-18-14-33/h19-21,25-26H,2,5-18H2,1,3-4H3/t25-,26+/m0/s1 ZFUJAVCOKRFKCQ-IZZNHLLZSA-N 50574805 CHEMBL4857516 Cholinesterase 3360 ChEMBL 10.1016/j.ejmech.2021.113735 10.7270/Q2H41W7X 34371367 Jiang, X; Zhang, Z; Zuo, J; Wu, C; Zha, L; Xu, Y; Wang, S; Shi, J; Liu, XH; Zhang, J; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574805 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574805&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164616957 471064950 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51422655 CCCCCc1cc(O)c([C@@H]2C=C(C)CC[C@H]2C(C)=C)c(OC(=O)N(C)Cc2ccccc2)c1 InChI=1S/C30H39NO3/c1-6-7-9-14-24-18-27(32)29(26-17-22(4)15-16-25(26)21(2)3)28(19-24)34-30(33)31(5)20-23-12-10-8-11-13-23/h8,10-13,17-19,25-26,32H,2,6-7,9,14-16,20H2,1,3-5H3/t25-,26+/m0/s1 ASYFMSICPWIMEW-IZZNHLLZSA-N 50574806 CHEMBL4851490 Cholinesterase 46 ChEMBL 10.1016/j.ejmech.2021.113735 10.7270/Q2H41W7X 34371367 Jiang, X; Zhang, Z; Zuo, J; Wu, C; Zha, L; Xu, Y; Wang, S; Shi, J; Liu, XH; Zhang, J; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574806 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574806&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164618419 471064951 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51422656 CCCCCc1cc(OC(=O)N(C)Cc2ccccc2)c([C@@H]2C=C(C)CC[C@H]2C(C)=C)c(OC(=O)N(C)Cc2ccccc2)c1 InChI=1S/C39H48N2O4/c1-7-8-11-20-32-24-35(44-38(42)40(5)26-30-16-12-9-13-17-30)37(34-23-29(4)21-22-33(34)28(2)3)36(25-32)45-39(43)41(6)27-31-18-14-10-15-19-31/h9-10,12-19,23-25,33-34H,2,7-8,11,20-22,26-27H2,1,3-6H3/t33-,34+/m0/s1 XHLSEWKDCGFEGX-SZAHLOSFSA-N 50574807 CHEMBL4847688 Cholinesterase 380 ChEMBL 10.1016/j.ejmech.2021.113735 10.7270/Q2H41W7X 34371367 Jiang, X; Zhang, Z; Zuo, J; Wu, C; Zha, L; Xu, Y; Wang, S; Shi, J; Liu, XH; Zhang, J; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574807 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574807&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164612640 471064952 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51422657 CCCCCc1cc(O)c([C@@H]2C=C(C)CC[C@H]2C(C)=C)c(OC(=O)N(C)C)c1 InChI=1S/C24H35NO3/c1-7-8-9-10-18-14-21(26)23(22(15-18)28-24(27)25(5)6)20-13-17(4)11-12-19(20)16(2)3/h13-15,19-20,26H,2,7-12H2,1,3-6H3/t19-,20+/m0/s1 WVIPEZCTQKARBD-VQTJNVASSA-N 50574808 CHEMBL4849316 Cholinesterase 200 ChEMBL 10.1016/j.ejmech.2021.113735 10.7270/Q2H41W7X 34371367 Jiang, X; Zhang, Z; Zuo, J; Wu, C; Zha, L; Xu, Y; Wang, S; Shi, J; Liu, XH; Zhang, J; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574808 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574808&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164616119 471064953 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51422658 CCCCCc1cc(O)c([C@@H]2C=C(C)CC[C@H]2C(C)=C)c(OC(=O)N(CC)CC)c1 InChI=1S/C26H39NO3/c1-7-10-11-12-20-16-23(28)25(22-15-19(6)13-14-21(22)18(4)5)24(17-20)30-26(29)27(8-2)9-3/h15-17,21-22,28H,4,7-14H2,1-3,5-6H3/t21-,22+/m0/s1 NHCRVTANKSUIFF-FCHUYYIVSA-N 50574809 CHEMBL4864375 Cholinesterase 370 ChEMBL 10.1016/j.ejmech.2021.113735 10.7270/Q2H41W7X 34371367 Jiang, X; Zhang, Z; Zuo, J; Wu, C; Zha, L; Xu, Y; Wang, S; Shi, J; Liu, XH; Zhang, J; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574809 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574809&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164618777 471064954 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51422659 CCCCCc1cc(O)c([C@@H]2C=C(C)CC[C@H]2C(C)=C)c(OC(=O)N2CCCCC2)c1 InChI=1S/C27H39NO3/c1-5-6-8-11-21-17-24(29)26(23-16-20(4)12-13-22(23)19(2)3)25(18-21)31-27(30)28-14-9-7-10-15-28/h16-18,22-23,29H,2,5-15H2,1,3-4H3/t22-,23+/m0/s1 MMJFFEVWMLPQQD-XZOQPEGZSA-N 50574810 CHEMBL4870305 Cholinesterase 530 ChEMBL 10.1016/j.ejmech.2021.113735 10.7270/Q2H41W7X 34371367 Jiang, X; Zhang, Z; Zuo, J; Wu, C; Zha, L; Xu, Y; Wang, S; Shi, J; Liu, XH; Zhang, J; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574810 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574810&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164622419 471064955 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51422660 CCCCCc1cc(O)c([C@@H]2C=C(C)CC[C@H]2C(C)=C)c(OC(=O)N(C)Cc2cccc(F)c2)c1 InChI=1S/C30H38FNO3/c1-6-7-8-10-22-17-27(33)29(26-15-21(4)13-14-25(26)20(2)3)28(18-22)35-30(34)32(5)19-23-11-9-12-24(31)16-23/h9,11-12,15-18,25-26,33H,2,6-8,10,13-14,19H2,1,3-5H3/t25-,26+/m0/s1 KVZALTFJTVNFPC-IZZNHLLZSA-N 50574811 CHEMBL4866008 Cholinesterase 4870 ChEMBL 10.1016/j.ejmech.2021.113735 10.7270/Q2H41W7X 34371367 Jiang, X; Zhang, Z; Zuo, J; Wu, C; Zha, L; Xu, Y; Wang, S; Shi, J; Liu, XH; Zhang, J; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574811 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574811&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164624566 471064956 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51422661 CCCCCc1cc(O)c([C@@H]2C=C(C)CC[C@H]2C(C)=C)c(OC(=O)N(C)Cc2cccc(Cl)c2)c1 InChI=1S/C30H38ClNO3/c1-6-7-8-10-22-17-27(33)29(26-15-21(4)13-14-25(26)20(2)3)28(18-22)35-30(34)32(5)19-23-11-9-12-24(31)16-23/h9,11-12,15-18,25-26,33H,2,6-8,10,13-14,19H2,1,3-5H3/t25-,26+/m0/s1 ZZEAWAIPAYYTHU-IZZNHLLZSA-N 50574812 CHEMBL4863945 Cholinesterase 2820 ChEMBL 10.1016/j.ejmech.2021.113735 10.7270/Q2H41W7X 34371367 Jiang, X; Zhang, Z; Zuo, J; Wu, C; Zha, L; Xu, Y; Wang, S; Shi, J; Liu, XH; Zhang, J; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574812 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574812&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164625510 471064957 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51422662 CCCCCc1cc(O)c([C@@H]2C=C(C)CC[C@H]2C(C)=C)c(OC(=O)N(C)Cc2cccc(Br)c2)c1 InChI=1S/C30H38BrNO3/c1-6-7-8-10-22-17-27(33)29(26-15-21(4)13-14-25(26)20(2)3)28(18-22)35-30(34)32(5)19-23-11-9-12-24(31)16-23/h9,11-12,15-18,25-26,33H,2,6-8,10,13-14,19H2,1,3-5H3/t25-,26+/m0/s1 ADYBAPQENREYTO-IZZNHLLZSA-N 50574813 CHEMBL4853892 Cholinesterase 2400 ChEMBL 10.1016/j.ejmech.2021.113735 10.7270/Q2H41W7X 34371367 Jiang, X; Zhang, Z; Zuo, J; Wu, C; Zha, L; Xu, Y; Wang, S; Shi, J; Liu, XH; Zhang, J; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574813 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574813&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164612917 471064958 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51422663 CCCCCc1cc(O)c([C@@H]2C=C(C)CC[C@H]2C(C)=C)c(OC(=O)N(C)Cc2ccc(F)cc2)c1 InChI=1S/C30H38FNO3/c1-6-7-8-9-23-17-27(33)29(26-16-21(4)10-15-25(26)20(2)3)28(18-23)35-30(34)32(5)19-22-11-13-24(31)14-12-22/h11-14,16-18,25-26,33H,2,6-10,15,19H2,1,3-5H3/t25-,26+/m0/s1 ZPTQXVAFWPNDIC-IZZNHLLZSA-N 50574814 CHEMBL4872000 Cholinesterase 69 ChEMBL 10.1016/j.ejmech.2021.113735 10.7270/Q2H41W7X 34371367 Jiang, X; Zhang, Z; Zuo, J; Wu, C; Zha, L; Xu, Y; Wang, S; Shi, J; Liu, XH; Zhang, J; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574814 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574814&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164624729 471064959 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51422664 CCCCCc1cc(O)c([C@@H]2C=C(C)CC[C@H]2C(C)=C)c(OC(=O)N(C)Cc2ccc(Cl)cc2)c1 InChI=1S/C30H38ClNO3/c1-6-7-8-9-23-17-27(33)29(26-16-21(4)10-15-25(26)20(2)3)28(18-23)35-30(34)32(5)19-22-11-13-24(31)14-12-22/h11-14,16-18,25-26,33H,2,6-10,15,19H2,1,3-5H3/t25-,26+/m0/s1 OHHCIRJUIDNYFH-IZZNHLLZSA-N 50574799 CHEMBL4870785 Cholinesterase 5.3 ChEMBL 10.1016/j.ejmech.2021.113735 10.7270/Q2H41W7X 34371367 Jiang, X; Zhang, Z; Zuo, J; Wu, C; Zha, L; Xu, Y; Wang, S; Shi, J; Liu, XH; Zhang, J; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574799 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574799&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164622442 471064944 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51422665 CCCCCc1cc(O)c([C@@H]2C=C(C)CC[C@H]2C(C)=C)c(OC(=O)N(C)Cc2ccc(Br)cc2)c1 InChI=1S/C30H38BrNO3/c1-6-7-8-9-23-17-27(33)29(26-16-21(4)10-15-25(26)20(2)3)28(18-23)35-30(34)32(5)19-22-11-13-24(31)14-12-22/h11-14,16-18,25-26,33H,2,6-10,15,19H2,1,3-5H3/t25-,26+/m0/s1 BPMDMDROJOGDRW-IZZNHLLZSA-N 50574800 CHEMBL4858546 Cholinesterase 7.3 ChEMBL 10.1016/j.ejmech.2021.113735 10.7270/Q2H41W7X 34371367 Jiang, X; Zhang, Z; Zuo, J; Wu, C; Zha, L; Xu, Y; Wang, S; Shi, J; Liu, XH; Zhang, J; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574800 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574800&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164609922 471064945 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51422666 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 9240 ChEMBL 10.1016/j.ejmech.2021.113735 10.7270/Q2H41W7X 34371367 Jiang, X; Zhang, Z; Zuo, J; Wu, C; Zha, L; Xu, Y; Wang, S; Shi, J; Liu, XH; Zhang, J; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51422667 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 11682 2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::Rivastigmine.tartrate::US9586925, Rivastigmine Cholinesterase 58 ChEMBL 10.1016/j.ejmech.2021.113735 10.7270/Q2H41W7X 34371367 Jiang, X; Zhang, Z; Zuo, J; Wu, C; Zha, L; Xu, Y; Wang, S; Shi, J; Liu, XH; Zhang, J; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=11682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=11682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46512204 DB00989 C11766 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51422672 CCCCCc1cc(O)c([C@@H]2C=C(C)CC[C@H]2C(C)=C)c(OC(=O)N2CCCC2)c1 InChI=1S/C26H37NO3/c1-5-6-7-10-20-16-23(28)25(22-15-19(4)11-12-21(22)18(2)3)24(17-20)30-26(29)27-13-8-9-14-27/h15-17,21-22,28H,2,5-14H2,1,3-4H3/t21-,22+/m0/s1 LUUMJPDLULEIGC-FCHUYYIVSA-N 50574801 CHEMBL4847128 Cholinesterase 350 ChEMBL 10.1016/j.ejmech.2021.113735 10.7270/Q2H41W7X 34371367 Jiang, X; Zhang, Z; Zuo, J; Wu, C; Zha, L; Xu, Y; Wang, S; Shi, J; Liu, XH; Zhang, J; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574801 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574801&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164608933 471064946 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51422673 CCCCCc1cc(O)c([C@@H]2C=C(C)CC[C@H]2C(C)=C)c(OC(=O)N(C)Cc2ccc(Cl)cc2)c1 InChI=1S/C30H38ClNO3/c1-6-7-8-9-23-17-27(33)29(26-16-21(4)10-15-25(26)20(2)3)28(18-23)35-30(34)32(5)19-22-11-13-24(31)14-12-22/h11-14,16-18,25-26,33H,2,6-10,15,19H2,1,3-5H3/t25-,26+/m0/s1 OHHCIRJUIDNYFH-IZZNHLLZSA-N 50574799 CHEMBL4870785 Cholinesterase 13 ChEMBL 10.1016/j.ejmech.2021.113735 10.7270/Q2H41W7X 34371367 Jiang, X; Zhang, Z; Zuo, J; Wu, C; Zha, L; Xu, Y; Wang, S; Shi, J; Liu, XH; Zhang, J; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574799 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574799&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164622442 471064944 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51422674 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 11682 2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::Rivastigmine.tartrate::US9586925, Rivastigmine Cholinesterase 1150 ChEMBL 10.1016/j.ejmech.2021.113735 10.7270/Q2H41W7X 34371367 Jiang, X; Zhang, Z; Zuo, J; Wu, C; Zha, L; Xu, Y; Wang, S; Shi, J; Liu, XH; Zhang, J; Tang, W Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=11682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=11682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46512204 DB00989 C11766 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430016 CC(C)(C)NC(=O)C1(N2CCC2=O)C(=O)Nc2ccccc12 InChI=1S/C16H19N3O3/c1-15(2,3)18-14(22)16(19-9-8-12(19)20)10-6-4-5-7-11(10)17-13(16)21/h4-7H,8-9H2,1-3H3,(H,17,21)(H,18,22) XPVRNAQGXHDYQQ-UHFFFAOYSA-N 50577718 CHEMBL4851878 Cholinesterase >100000 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577718 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577718&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164617866 471053841 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430017 CC(C)(C)NC(=O)C1(N2CCC2=O)C(=O)N(c2ccccc12)c1ccccc1 InChI=1S/C22H23N3O3/c1-21(2,3)23-19(27)22(24-14-13-18(24)26)16-11-7-8-12-17(16)25(20(22)28)15-9-5-4-6-10-15/h4-12H,13-14H2,1-3H3,(H,23,27) TUTGUNYJYJAICV-UHFFFAOYSA-N 50577719 CHEMBL4858873 Cholinesterase 22000 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577719 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577719&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164615906 471053842 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430018 CC(C)(C)NC(=O)C1(N2CCC2=O)C(=O)N(Cc2ccccc2)c2ccccc12 InChI=1S/C23H25N3O3/c1-22(2,3)24-20(28)23(26-14-13-19(26)27)17-11-7-8-12-18(17)25(21(23)29)15-16-9-5-4-6-10-16/h4-12H,13-15H2,1-3H3,(H,24,28) YTYYKCIOIAMBNW-UHFFFAOYSA-N 50577720 CHEMBL4851111 Cholinesterase 51000 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577720 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577720&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164615604 471053843 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430019 CC(C)(C)NC(=O)C1(N2CCC2=O)C(=O)Nc2ccc(Br)cc12 InChI=1S/C16H18BrN3O3/c1-15(2,3)19-14(23)16(20-7-6-12(20)21)10-8-9(17)4-5-11(10)18-13(16)22/h4-5,8H,6-7H2,1-3H3,(H,18,22)(H,19,23) NRICGNAXAHIMNS-UHFFFAOYSA-N 50577721 CHEMBL4878019 Cholinesterase >100000 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577721 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577721&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164625809 471053844 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430020 CC(C)(C)NC(=O)C1(N2CCC2=O)C(=O)Nc2ccc(I)cc12 InChI=1S/C16H18IN3O3/c1-15(2,3)19-14(23)16(20-7-6-12(20)21)10-8-9(17)4-5-11(10)18-13(16)22/h4-5,8H,6-7H2,1-3H3,(H,18,22)(H,19,23) LYOACLKGYOOPGE-UHFFFAOYSA-N 50577722 CHEMBL4869063 Cholinesterase 80000 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577722 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577722&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164622360 471053845 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430021 CC(C)(C)NC(=O)C1(N2CCC2=O)C(=O)Nc2ccc(cc12)[N+]([O-])=O InChI=1S/C16H18N4O5/c1-15(2,3)18-14(23)16(19-7-6-12(19)21)10-8-9(20(24)25)4-5-11(10)17-13(16)22/h4-5,8H,6-7H2,1-3H3,(H,17,22)(H,18,23) GRKJNQDNEQDBTR-UHFFFAOYSA-N 50577723 CHEMBL4863677 Cholinesterase >100000 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577723 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577723&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164620473 471053846 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430022 Cc1cc2c(NC(=O)C2(N2CCC2=O)C(=O)NC(C)(C)C)c(C)c1 InChI=1S/C18H23N3O3/c1-10-8-11(2)14-12(9-10)18(15(23)19-14,21-7-6-13(21)22)16(24)20-17(3,4)5/h8-9H,6-7H2,1-5H3,(H,19,23)(H,20,24) AAGONSNLOPDKSJ-UHFFFAOYSA-N 50577724 CHEMBL4853987 Cholinesterase 57000 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577724 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577724&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164616860 471053847 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430023 CC(C)(C)NC(=O)C1(N2CCC2=O)C(=O)Nc2c1cccc2C(F)(F)F InChI=1S/C17H18F3N3O3/c1-15(2,3)22-14(26)16(23-8-7-11(23)24)9-5-4-6-10(17(18,19)20)12(9)21-13(16)25/h4-6H,7-8H2,1-3H3,(H,21,25)(H,22,26) VZNBCQJNAWFDRP-UHFFFAOYSA-N 50577725 CHEMBL4848556 Cholinesterase >100000 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577725 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577725&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164610492 471053848 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430024 CC(C)(C)CC(C)(C)NC(=O)C1(N2CCC2=O)C(=O)Nc2ccccc12 InChI=1S/C20H27N3O3/c1-18(2,3)12-19(4,5)22-17(26)20(23-11-10-15(23)24)13-8-6-7-9-14(13)21-16(20)25/h6-9H,10-12H2,1-5H3,(H,21,25)(H,22,26) LHQMUNARCQVEIB-UHFFFAOYSA-N 50577726 CHEMBL4864474 Cholinesterase 42000 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577726 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577726&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164621695 471053849 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430025 O=C(NCc1ccccc1)C1(N2CCC2=O)C(=O)Nc2ccccc12 InChI=1S/C19H17N3O3/c23-16-10-11-22(16)19(14-8-4-5-9-15(14)21-18(19)25)17(24)20-12-13-6-2-1-3-7-13/h1-9H,10-12H2,(H,20,24)(H,21,25) UOXQXIUOJZRHCK-UHFFFAOYSA-N 50577714 CHEMBL4868728 Cholinesterase >100000 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577714 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577714&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164618473 471053837 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430026 CC(C)(C)CC(C)(C)NC(=O)C1(N2CCC2=O)C(=O)N(Cc2ccccc2)c2ccccc12 InChI=1S/C27H33N3O3/c1-25(2,3)18-26(4,5)28-23(32)27(30-16-15-22(30)31)20-13-9-10-14-21(20)29(24(27)33)17-19-11-7-6-8-12-19/h6-14H,15-18H2,1-5H3,(H,28,32) XHBAUSPPWDKTQB-UHFFFAOYSA-N 50577715 CHEMBL4866640 Cholinesterase 1800 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577715 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577715&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164625043 471053838 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430027 O=C(NCc1ccccc1)C1(N2CCC2=O)C(=O)N(CC#C)c2ccccc12 InChI=1S/C22H19N3O3/c1-2-13-24-18-11-7-6-10-17(18)22(21(24)28,25-14-12-19(25)26)20(27)23-15-16-8-4-3-5-9-16/h1,3-11H,12-15H2,(H,23,27) QILRWZMLQSKQFZ-UHFFFAOYSA-N 50577727 CHEMBL4874385 Cholinesterase >100000 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577727 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577727&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164626763 471053850 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430028 CC(C)(C)NC(=O)C1(N2CCCC2=O)C(=O)Nc2ccccc12 InChI=1S/C17H21N3O3/c1-16(2,3)19-15(23)17(20-10-6-9-13(20)21)11-7-4-5-8-12(11)18-14(17)22/h4-5,7-8H,6,9-10H2,1-3H3,(H,18,22)(H,19,23) HZNAUNXYJPJPMT-UHFFFAOYSA-N 50577728 CHEMBL4874271 Cholinesterase 54000 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577728 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577728&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164628444 471053851 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430029 CN1C(=O)C(N2CCCC2=O)(C(=O)NC(C)(C)C)c2ccccc12 InChI=1S/C18H23N3O3/c1-17(2,3)19-15(23)18(21-11-7-10-14(21)22)12-8-5-6-9-13(12)20(4)16(18)24/h5-6,8-9H,7,10-11H2,1-4H3,(H,19,23) KUTDAEBPZYXGTM-UHFFFAOYSA-N 50577729 CHEMBL4860185 Cholinesterase >100000 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577729 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577729&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164618072 471053852 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430030 CC(C)(C)NC(=O)C1(N2CCCC2=O)C(=O)N(c2ccccc12)c1ccccc1 InChI=1S/C23H25N3O3/c1-22(2,3)24-20(28)23(25-15-9-14-19(25)27)17-12-7-8-13-18(17)26(21(23)29)16-10-5-4-6-11-16/h4-8,10-13H,9,14-15H2,1-3H3,(H,24,28) BZTIQVPFGTXSNZ-UHFFFAOYSA-N 50577730 CHEMBL4870225 Cholinesterase 6200 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577730 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577730&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164621112 471053853 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430031 CC(C)(C)NC(=O)C1(N2CCCC2=O)C(=O)N(Cc2ccccc2)c2ccccc12 InChI=1S/C24H27N3O3/c1-23(2,3)25-21(29)24(27-15-9-14-20(27)28)18-12-7-8-13-19(18)26(22(24)30)16-17-10-5-4-6-11-17/h4-8,10-13H,9,14-16H2,1-3H3,(H,25,29) ALNAEAODJHBWQC-UHFFFAOYSA-N 50577731 CHEMBL4856304 Cholinesterase 32000 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577731 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577731&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164609745 471053854 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430032 CC(C)(C)NC(=O)C1(N2CCCC2=O)C(=O)Nc2ccc(Br)cc12 InChI=1S/C17H20BrN3O3/c1-16(2,3)20-15(24)17(21-8-4-5-13(21)22)11-9-10(18)6-7-12(11)19-14(17)23/h6-7,9H,4-5,8H2,1-3H3,(H,19,23)(H,20,24) FHNFVIJEXLIUHK-UHFFFAOYSA-N 50577732 CHEMBL4857448 Cholinesterase >100000 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577732 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577732&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164614696 471053855 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430033 CC(C)(C)NC(=O)C1(N2CCCC2=O)C(=O)Nc2ccc(I)cc12 InChI=1S/C17H20IN3O3/c1-16(2,3)20-15(24)17(21-8-4-5-13(21)22)11-9-10(18)6-7-12(11)19-14(17)23/h6-7,9H,4-5,8H2,1-3H3,(H,19,23)(H,20,24) FFHCJSBBEJWOAZ-UHFFFAOYSA-N 50577733 CHEMBL4852315 Cholinesterase 68000 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577733 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577733&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164612844 471053856 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430034 CC(C)(C)NC(=O)C1(N2CCCC2=O)C(=O)Nc2ccc(cc12)[N+]([O-])=O InChI=1S/C17H20N4O5/c1-16(2,3)19-15(24)17(20-8-4-5-13(20)22)11-9-10(21(25)26)6-7-12(11)18-14(17)23/h6-7,9H,4-5,8H2,1-3H3,(H,18,23)(H,19,24) SYZWJJFNKUFZDM-UHFFFAOYSA-N 50577716 CHEMBL4857019 Cholinesterase 94000 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577716 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577716&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164614158 471053839 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430035 Cc1cc2c(NC(=O)C2(N2CCCC2=O)C(=O)NC(C)(C)C)c(C)c1 InChI=1S/C19H25N3O3/c1-11-9-12(2)15-13(10-11)19(16(24)20-15,17(25)21-18(3,4)5)22-8-6-7-14(22)23/h9-10H,6-8H2,1-5H3,(H,20,24)(H,21,25) WRZCDFRSNIHXIJ-UHFFFAOYSA-N 50577734 CHEMBL4874143 Cholinesterase >100000 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577734 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577734&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164627165 471053857 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430036 O=C(NC1CCCCC1)C1(N2CCCC2=O)C(=O)Nc2ccccc12 InChI=1S/C19H23N3O3/c23-16-11-6-12-22(16)19(17(24)20-13-7-2-1-3-8-13)14-9-4-5-10-15(14)21-18(19)25/h4-5,9-10,13H,1-3,6-8,11-12H2,(H,20,24)(H,21,25) PMDISCZLTLKDBO-UHFFFAOYSA-N 50577735 CHEMBL4849159 Cholinesterase 44000 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577735 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577735&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164611077 471053858 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430037 CC(C)(C)CC(C)(C)NC(=O)C1(N2CCCC2=O)C(=O)Nc2ccccc12 InChI=1S/C21H29N3O3/c1-19(2,3)13-20(4,5)23-18(27)21(24-12-8-11-16(24)25)14-9-6-7-10-15(14)22-17(21)26/h6-7,9-10H,8,11-13H2,1-5H3,(H,22,26)(H,23,27) SDYJYOJIRRVVJZ-UHFFFAOYSA-N 50577717 CHEMBL4858862 Cholinesterase 8400 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577717 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577717&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164614850 471053840 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430038 O=C(NCc1ccccc1)C1(N2CCCC2=O)C(=O)Nc2ccccc12 InChI=1S/C20H19N3O3/c24-17-11-6-12-23(17)20(15-9-4-5-10-16(15)22-19(20)26)18(25)21-13-14-7-2-1-3-8-14/h1-5,7-10H,6,11-13H2,(H,21,25)(H,22,26) YLWSNAGNRQXQJQ-UHFFFAOYSA-N 50577736 CHEMBL4863422 Cholinesterase 71000 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577736 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577736&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164624474 471053859 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430039 CN1C(=O)C(N2CCCC2=O)(C(=O)NC(C)(C)CC(C)(C)C)c2ccccc12 InChI=1S/C22H31N3O3/c1-20(2,3)14-21(4,5)23-18(27)22(25-13-9-12-17(25)26)15-10-7-8-11-16(15)24(6)19(22)28/h7-8,10-11H,9,12-14H2,1-6H3,(H,23,27) XUPWMEVELMVXJA-UHFFFAOYSA-N 50577737 CHEMBL4853721 Cholinesterase 18000 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577737 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577737&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164615712 471053860 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430040 O=C(NCc1ccccc1)C1(N2CCCC2=O)C(=O)N(CC#C)c2ccccc12 InChI=1S/C23H21N3O3/c1-2-14-25-19-12-7-6-11-18(19)23(22(25)29,26-15-8-13-20(26)27)21(28)24-16-17-9-4-3-5-10-17/h1,3-7,9-12H,8,13-16H2,(H,24,28) FHIBAPDNZACCFR-UHFFFAOYSA-N 50577738 CHEMBL4846143 Cholinesterase >100000 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577738 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577738&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164608894 471053861 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430041 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 3900 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430045 CC(C)(C)CC(C)(C)NC(=O)C1(N2CCC2=O)C(=O)N(Cc2ccccc2)c2ccccc12 InChI=1S/C27H33N3O3/c1-25(2,3)18-26(4,5)28-23(32)27(30-16-15-22(30)31)20-13-9-10-14-21(20)29(24(27)33)17-19-11-7-6-8-12-19/h6-14H,15-18H2,1-5H3,(H,28,32) XHBAUSPPWDKTQB-UHFFFAOYSA-N 50577715 CHEMBL4866640 Cholinesterase 4800 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577715 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577715&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164625043 471053838 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430046 CC(C)(C)NC(=O)C1(N2CCCC2=O)C(=O)N(c2ccccc12)c1ccccc1 InChI=1S/C23H25N3O3/c1-22(2,3)24-20(28)23(25-15-9-14-19(25)27)17-12-7-8-13-18(17)26(21(23)29)16-10-5-4-6-11-16/h4-8,10-13H,9,14-15H2,1-3H3,(H,24,28) BZTIQVPFGTXSNZ-UHFFFAOYSA-N 50577730 CHEMBL4870225 Cholinesterase 18000 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577730 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577730&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164621112 471053853 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51430047 CC(C)(C)CC(C)(C)NC(=O)C1(N2CCCC2=O)C(=O)Nc2ccccc12 InChI=1S/C21H29N3O3/c1-19(2,3)13-20(4,5)23-18(27)21(24-12-8-11-16(24)25)14-9-6-7-10-15(14)22-17(21)26/h6-7,9-10H,8,11-13H2,1-5H3,(H,22,26)(H,23,27) SDYJYOJIRRVVJZ-UHFFFAOYSA-N 50577717 CHEMBL4858862 Cholinesterase 15000 ChEMBL 10.1021/acsmedchemlett.1c00344 10.7270/Q2QV3RBG 34795859 Brandão, P; López, Ó; Leitzbach, L; Stark, H; Fernández-Bolaños, JG; Burke, AJ; Pineiro, M University of Coimbra http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577717 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577717&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164614850 471053840 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421399 O=S(=O)(c1ccccc1)n1ccc2c(OCCNCc3ccccc3)cccc12 InChI=1S/C23H22N2O3S/c26-29(27,20-10-5-2-6-11-20)25-16-14-21-22(25)12-7-13-23(21)28-17-15-24-18-19-8-3-1-4-9-19/h1-14,16,24H,15,17-18H2 WWCIYLXNRVTMRO-UHFFFAOYSA-N 50574162 CHEMBL368698 Cholinesterase 473 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574162 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574162&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search S6Q 7AWG 44389529 471064307 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421400 CN(CCOc1cccc2n(ccc12)S(=O)(=O)c1ccccc1)Cc1ccccc1 InChI=1S/C24H24N2O3S/c1-25(19-20-9-4-2-5-10-20)17-18-29-24-14-8-13-23-22(24)15-16-26(23)30(27,28)21-11-6-3-7-12-21/h2-16H,17-19H2,1H3 VLCCVJKHNSXKPG-UHFFFAOYSA-N 50574163 CHEMBL4872905 Cholinesterase 1422 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574163 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574163&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164622054 471064308 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421401 Cc1cccc(CNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)c1 InChI=1S/C24H24N2O3S/c1-19-7-5-8-20(17-19)18-25-14-16-29-24-12-6-11-23-22(24)13-15-26(23)30(27,28)21-9-3-2-4-10-21/h2-13,15,17,25H,14,16,18H2,1H3 KPULSQQTOLRHKW-UHFFFAOYSA-N 50574164 CHEMBL4849477 Cholinesterase 401 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574164 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574164&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164612119 471064309 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421402 Clc1ccccc1CNCCOc1cccc2n(ccc12)S(=O)(=O)c1ccccc1 InChI=1S/C23H21ClN2O3S/c24-21-10-5-4-7-18(21)17-25-14-16-29-23-12-6-11-22-20(23)13-15-26(22)30(27,28)19-8-2-1-3-9-19/h1-13,15,25H,14,16-17H2 KAYDYSWEBWGTPA-UHFFFAOYSA-N 50574165 CHEMBL4863079 Cholinesterase 881 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574165 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574165&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164623135 471064310 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421403 Clc1cccc(CNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)c1 InChI=1S/C23H21ClN2O3S/c24-19-7-4-6-18(16-19)17-25-13-15-29-23-11-5-10-22-21(23)12-14-26(22)30(27,28)20-8-2-1-3-9-20/h1-12,14,16,25H,13,15,17H2 VELMVRPOZLZKKY-UHFFFAOYSA-N 50574166 CHEMBL4849917 Cholinesterase 580 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574166 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574166&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164613324 471064311 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421404 Clc1ccc(CNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)cc1 InChI=1S/C23H21ClN2O3S/c24-19-11-9-18(10-12-19)17-25-14-16-29-23-8-4-7-22-21(23)13-15-26(22)30(27,28)20-5-2-1-3-6-20/h1-13,15,25H,14,16-17H2 ZBQQKKVZHBBGSY-UHFFFAOYSA-N 50574167 CHEMBL4862131 Cholinesterase 1323 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574167 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574167&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164619953 471064312 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421405 Clc1cc(Cl)cc(CNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)c1 InChI=1S/C23H20Cl2N2O3S/c24-18-13-17(14-19(25)15-18)16-26-10-12-30-23-8-4-7-22-21(23)9-11-27(22)31(28,29)20-5-2-1-3-6-20/h1-9,11,13-15,26H,10,12,16H2 YFTFGRVEPHQRAJ-UHFFFAOYSA-N 50574168 CHEMBL4845762 Cholinesterase 414 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574168 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574168&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164609111 471064313 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421406 FC(F)(F)c1cccc(CNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)c1 InChI=1S/C24H21F3N2O3S/c25-24(26,27)19-7-4-6-18(16-19)17-28-13-15-32-23-11-5-10-22-21(23)12-14-29(22)33(30,31)20-8-2-1-3-9-20/h1-12,14,16,28H,13,15,17H2 AGZZEEHMCBOBFY-UHFFFAOYSA-N 50574169 CHEMBL4849702 Cholinesterase 2205 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574169 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574169&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164612125 471064314 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421407 Fc1ccc(CNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)cc1 InChI=1S/C23H21FN2O3S/c24-19-11-9-18(10-12-19)17-25-14-16-29-23-8-4-7-22-21(23)13-15-26(22)30(27,28)20-5-2-1-3-6-20/h1-13,15,25H,14,16-17H2 AQDWXWZTCBXVCR-UHFFFAOYSA-N 50574170 CHEMBL4863101 Cholinesterase 985 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574170 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574170&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164623148 471064315 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421408 [O-][N+](=O)c1ccc(CNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)cc1 InChI=1S/C23H21N3O5S/c27-26(28)19-11-9-18(10-12-19)17-24-14-16-31-23-8-4-7-22-21(23)13-15-25(22)32(29,30)20-5-2-1-3-6-20/h1-13,15,24H,14,16-17H2 QHHNTWHCMAUHEH-UHFFFAOYSA-N 50574171 CHEMBL4850275 Cholinesterase 18330 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574171 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574171&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164612743 471064316 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421409 CN(C)c1cccc(CNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)c1 InChI=1S/C25H27N3O3S/c1-27(2)21-9-6-8-20(18-21)19-26-15-17-31-25-13-7-12-24-23(25)14-16-28(24)32(29,30)22-10-4-3-5-11-22/h3-14,16,18,26H,15,17,19H2,1-2H3 GYAPSPMVYQLOEV-UHFFFAOYSA-N 50574172 CHEMBL4850764 Cholinesterase 894 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574172 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574172&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164612180 471064317 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421410 CN(C)c1ccc(CNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)cc1 InChI=1S/C25H27N3O3S/c1-27(2)21-13-11-20(12-14-21)19-26-16-18-31-25-10-6-9-24-23(25)15-17-28(24)32(29,30)22-7-4-3-5-8-22/h3-15,17,26H,16,18-19H2,1-2H3 YUDOJWULIRBXOO-UHFFFAOYSA-N 50574173 CHEMBL4871678 Cholinesterase 3081 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574173 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574173&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164622459 471064318 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421411 COc1cccc(CNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)c1 InChI=1S/C24H24N2O4S/c1-29-20-8-5-7-19(17-20)18-25-14-16-30-24-12-6-11-23-22(24)13-15-26(23)31(27,28)21-9-3-2-4-10-21/h2-13,15,17,25H,14,16,18H2,1H3 AIIHXULHGYZIGI-UHFFFAOYSA-N 50574174 CHEMBL4871357 Cholinesterase 1661 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574174 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574174&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10113909 471064319 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421412 COc1ccc(CNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)cc1 InChI=1S/C24H24N2O4S/c1-29-20-12-10-19(11-13-20)18-25-15-17-30-24-9-5-8-23-22(24)14-16-26(23)31(27,28)21-6-3-2-4-7-21/h2-14,16,25H,15,17-18H2,1H3 MLRJTPPRQGQUPO-UHFFFAOYSA-N 50574175 CHEMBL4864854 Cholinesterase 1326 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574175 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574175&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164619210 471064320 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421413 COc1ccc(CNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)cc1OC InChI=1S/C25H26N2O5S/c1-30-24-12-11-19(17-25(24)31-2)18-26-14-16-32-23-10-6-9-22-21(23)13-15-27(22)33(28,29)20-7-4-3-5-8-20/h3-13,15,17,26H,14,16,18H2,1-2H3 MXCHZZBIUUARTL-UHFFFAOYSA-N 50574176 CHEMBL4866390 Cholinesterase 3322 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574176 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574176&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164625599 471064321 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421414 O=S(=O)(c1ccccc1)n1ccc2c(OCCNCc3ccc4OCCOc4c3)cccc12 InChI=1S/C25H24N2O5S/c28-33(29,20-5-2-1-3-6-20)27-13-11-21-22(27)7-4-8-23(21)30-14-12-26-18-19-9-10-24-25(17-19)32-16-15-31-24/h1-11,13,17,26H,12,14-16,18H2 MTBVVAYIBBFTRT-UHFFFAOYSA-N 50574177 CHEMBL4871652 Cholinesterase 2165 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574177 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574177&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164622030 471064322 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421415 CCOc1cccc(CNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)c1 InChI=1S/C25H26N2O4S/c1-2-30-21-9-6-8-20(18-21)19-26-15-17-31-25-13-7-12-24-23(25)14-16-27(24)32(28,29)22-10-4-3-5-11-22/h3-14,16,18,26H,2,15,17,19H2,1H3 NLMMDLYWUUMIGF-UHFFFAOYSA-N 50574178 CHEMBL4862752 Cholinesterase 2412 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574178 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574178&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164618728 471064323 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421416 CCOc1ccc(CNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)cc1 InChI=1S/C25H26N2O4S/c1-2-30-21-13-11-20(12-14-21)19-26-16-18-31-25-10-6-9-24-23(25)15-17-27(24)32(28,29)22-7-4-3-5-8-22/h3-15,17,26H,2,16,18-19H2,1H3 LBOPVBNPFMAZKR-UHFFFAOYSA-N 50574179 CHEMBL4879036 Cholinesterase 3297 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574179 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574179&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164625863 471064324 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421417 CC(=O)Oc1cccc(CNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)c1 InChI=1S/C25H24N2O5S/c1-19(28)32-21-8-5-7-20(17-21)18-26-14-16-31-25-12-6-11-24-23(25)13-15-27(24)33(29,30)22-9-3-2-4-10-22/h2-13,15,17,26H,14,16,18H2,1H3 WTQRCQQYTSHRRJ-UHFFFAOYSA-N 50574180 CHEMBL4867606 Cholinesterase 474 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574180 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574180&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164624187 471064325 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421418 CC(=O)Oc1ccc(CNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)cc1 InChI=1S/C25H24N2O5S/c1-19(28)32-21-12-10-20(11-13-21)18-26-15-17-31-25-9-5-8-24-23(25)14-16-27(24)33(29,30)22-6-3-2-4-7-22/h2-14,16,26H,15,17-18H2,1H3 HZVUCOMKFCQRBX-UHFFFAOYSA-N 50574181 CHEMBL4846931 Cholinesterase 228 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574181 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574181&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164609145 471064326 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421419 COC(=O)c1ccc(CNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)cc1 InChI=1S/C25H24N2O5S/c1-31-25(28)20-12-10-19(11-13-20)18-26-15-17-32-24-9-5-8-23-22(24)14-16-27(23)33(29,30)21-6-3-2-4-7-21/h2-14,16,26H,15,17-18H2,1H3 IJUVLRQDHNRBCW-UHFFFAOYSA-N 50574182 CHEMBL4849680 Cholinesterase 14300 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574182 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574182&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164611615 471064327 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421420 CC(=O)Nc1ccc(CNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)cc1 InChI=1S/C25H25N3O4S/c1-19(29)27-21-12-10-20(11-13-21)18-26-15-17-32-25-9-5-8-24-23(25)14-16-28(24)33(30,31)22-6-3-2-4-7-22/h2-14,16,26H,15,17-18H2,1H3,(H,27,29) AEFKQXHMADIPHK-UHFFFAOYSA-N 50574183 CHEMBL4855991 Cholinesterase 3800 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574183 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574183&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164610804 471064328 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421421 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 1830 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421422 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 2.0 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421423 O=S(=O)(c1ccccc1)n1ccc2c(OCCNCC3CCCCC3)cccc12 InChI=1S/C23H28N2O3S/c26-29(27,20-10-5-2-6-11-20)25-16-14-21-22(25)12-7-13-23(21)28-17-15-24-18-19-8-3-1-4-9-19/h2,5-7,10-14,16,19,24H,1,3-4,8-9,15,17-18H2 MBFYHWHICKMNAR-UHFFFAOYSA-N 50574185 CHEMBL4854460 Cholinesterase 90 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574185 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574185&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164610173 471064330 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421424 O=S(=O)(c1ccccc1)n1ccc2c(OCCNCC3CCCC3)cccc12 InChI=1S/C22H26N2O3S/c25-28(26,19-9-2-1-3-10-19)24-15-13-20-21(24)11-6-12-22(20)27-16-14-23-17-18-7-4-5-8-18/h1-3,6,9-13,15,18,23H,4-5,7-8,14,16-17H2 ZILBYNKRTASLQG-UHFFFAOYSA-N 50574186 CHEMBL4853545 Cholinesterase 269 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574186 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574186&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164610136 471064331 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421425 O=S(=O)(c1ccccc1)n1ccc2c(OCCNCC3CC3)cccc12 InChI=1S/C20H22N2O3S/c23-26(24,17-5-2-1-3-6-17)22-13-11-18-19(22)7-4-8-20(18)25-14-12-21-15-16-9-10-16/h1-8,11,13,16,21H,9-10,12,14-15H2 XVBRENVJHDFZHI-UHFFFAOYSA-N 50574187 CHEMBL4873700 Cholinesterase 2222 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574187 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574187&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164621197 471064332 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421426 O=S(=O)(c1ccccc1)n1ccc2c(OCCNCC3CCCNC3)cccc12 InChI=1S/C22H27N3O3S/c26-29(27,19-7-2-1-3-8-19)25-14-11-20-21(25)9-4-10-22(20)28-15-13-24-17-18-6-5-12-23-16-18/h1-4,7-11,14,18,23-24H,5-6,12-13,15-17H2 IVKVXSWFWQQKLZ-UHFFFAOYSA-N 50574188 CHEMBL4865076 Cholinesterase 2263 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574188 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574188&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164620074 471064333 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421427 CC(C)(C)OC(=O)N1CCCC(CNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)C1 InChI=1S/C27H35N3O5S/c1-27(2,3)35-26(31)29-16-8-9-21(20-29)19-28-15-18-34-25-13-7-12-24-23(25)14-17-30(24)36(32,33)22-10-5-4-6-11-22/h4-7,10-14,17,21,28H,8-9,15-16,18-20H2,1-3H3 PAIRCARNMCVGAC-UHFFFAOYSA-N 50574189 CHEMBL4852840 Cholinesterase 125 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574189 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574189&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search S8K 7AWH 164616796 471064334 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421428 CC(C)(C)OC(=O)N1CCC(CNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)CC1 InChI=1S/C27H35N3O5S/c1-27(2,3)35-26(31)29-16-12-21(13-17-29)20-28-15-19-34-25-11-7-10-24-23(25)14-18-30(24)36(32,33)22-8-5-4-6-9-22/h4-11,14,18,21,28H,12-13,15-17,19-20H2,1-3H3 WFNXOOWTLDRZSS-UHFFFAOYSA-N 50574190 CHEMBL4854568 Cholinesterase 4824 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574190 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574190&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164615124 471064335 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421429 O=S(=O)(c1ccccc1)n1ccc2c(OCCNCc3ccccn3)cccc12 InChI=1S/C22H21N3O3S/c26-29(27,19-8-2-1-3-9-19)25-15-12-20-21(25)10-6-11-22(20)28-16-14-23-17-18-7-4-5-13-24-18/h1-13,15,23H,14,16-17H2 MGKCOHPNSFRCAW-UHFFFAOYSA-N 50574192 CHEMBL4850738 Cholinesterase 1294 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574192 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574192&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164611660 471064337 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421430 Cc1ccc(CNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)o1 InChI=1S/C22H22N2O4S/c1-17-10-11-18(28-17)16-23-13-15-27-22-9-5-8-21-20(22)12-14-24(21)29(25,26)19-6-3-2-4-7-19/h2-12,14,23H,13,15-16H2,1H3 ATAVBALWDGSEPM-UHFFFAOYSA-N 50574194 CHEMBL4862289 Cholinesterase 2997 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574194 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574194&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164623617 471064339 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421431 O=S(=O)(N1CCc2c1cccc2OCCNCc1ccccc1)c1ccccc1 InChI=1S/C23H24N2O3S/c26-29(27,20-10-5-2-6-11-20)25-16-14-21-22(25)12-7-13-23(21)28-17-15-24-18-19-8-3-1-4-9-19/h1-13,24H,14-18H2 HIDNHCHBEZOPSZ-UHFFFAOYSA-N 50574195 CHEMBL4860124 Cholinesterase 1319 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574195 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574195&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164618065 471064340 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421432 Cc1cccc(CNCCOc2cccc3N(CCc23)S(=O)(=O)c2ccccc2)c1 InChI=1S/C24H26N2O3S/c1-19-7-5-8-20(17-19)18-25-14-16-29-24-12-6-11-23-22(24)13-15-26(23)30(27,28)21-9-3-2-4-10-21/h2-12,17,25H,13-16,18H2,1H3 IIRVWIJOWBVCJG-UHFFFAOYSA-N 50574196 CHEMBL4872078 Cholinesterase 2304 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574196 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574196&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164624322 471064341 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421433 CC(C)(C)OC(=O)N1CCCC(CNCCOc2cccc3N(CCc23)S(=O)(=O)c2ccccc2)C1 InChI=1S/C27H37N3O5S/c1-27(2,3)35-26(31)29-16-8-9-21(20-29)19-28-15-18-34-25-13-7-12-24-23(25)14-17-30(24)36(32,33)22-10-5-4-6-11-22/h4-7,10-13,21,28H,8-9,14-20H2,1-3H3 MNDYCVQCRNHOTO-UHFFFAOYSA-N 50574197 CHEMBL4845699 Cholinesterase 201 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574197 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574197&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164608791 471064342 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421434 CC(=O)Oc1ccc(CNCCOc2cccc3N(CCc23)S(=O)(=O)c2ccccc2)cc1 InChI=1S/C25H26N2O5S/c1-19(28)32-21-12-10-20(11-13-21)18-26-15-17-31-25-9-5-8-24-23(25)14-16-27(24)33(29,30)22-6-3-2-4-7-22/h2-13,26H,14-18H2,1H3 WFUNOEVGNBXQEQ-UHFFFAOYSA-N 50574198 CHEMBL4863967 Cholinesterase 660 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574198 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574198&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164618761 471064343 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421435 O=S(=O)(c1cccc2ccccc12)n1ccc2c(OCCNCc3ccccc3)cccc12 InChI=1S/C27H24N2O3S/c30-33(31,27-15-6-11-22-10-4-5-12-23(22)27)29-18-16-24-25(29)13-7-14-26(24)32-19-17-28-20-21-8-2-1-3-9-21/h1-16,18,28H,17,19-20H2 KDUPOZXXJNAMJQ-UHFFFAOYSA-N 50574199 CHEMBL4872486 Cholinesterase 401 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574199 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574199&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164623922 471064344 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421436 Cc1cccc(CNCCOc2cccc3n(ccc23)S(=O)(=O)c2cccc3ccccc23)c1 InChI=1S/C28H26N2O3S/c1-21-7-4-8-22(19-21)20-29-16-18-33-27-13-6-12-26-25(27)15-17-30(26)34(31,32)28-14-5-10-23-9-2-3-11-24(23)28/h2-15,17,19,29H,16,18,20H2,1H3 TUJNEQDEURDKIV-UHFFFAOYSA-N 50574200 CHEMBL4874512 Cholinesterase 148 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574200 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574200&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164629020 471064345 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421437 CC(C)(C)OC(=O)N1CCCC(CNCCOc2cccc3n(ccc23)S(=O)(=O)c2cccc3ccccc23)C1 InChI=1S/C31H37N3O5S/c1-31(2,3)39-30(35)33-18-8-9-23(22-33)21-32-17-20-38-28-14-7-13-27-26(28)16-19-34(27)40(36,37)29-15-6-11-24-10-4-5-12-25(24)29/h4-7,10-16,19,23,32H,8-9,17-18,20-22H2,1-3H3 LYWSOANQCURJQG-UHFFFAOYSA-N 50574201 CHEMBL4861756 Cholinesterase 5.8 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574201 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574201&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164611496 471064346 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421438 CC(=O)Oc1ccc(CNCCOc2cccc3n(ccc23)S(=O)(=O)c2cccc3ccccc23)cc1 InChI=1S/C29H26N2O5S/c1-21(32)36-24-14-12-22(13-15-24)20-30-17-19-35-28-10-5-9-27-26(28)16-18-31(27)37(33,34)29-11-4-7-23-6-2-3-8-25(23)29/h2-16,18,30H,17,19-20H2,1H3 VOGBRQUNKLLWPV-UHFFFAOYSA-N 50574202 CHEMBL4874372 Cholinesterase 261 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574202 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574202&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164626757 471064347 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421439 C(COc1cccc2n(Cc3ccccc3)ccc12)NCc1ccccc1 InChI=1S/C24H24N2O/c1-3-8-20(9-4-1)18-25-15-17-27-24-13-7-12-23-22(24)14-16-26(23)19-21-10-5-2-6-11-21/h1-14,16,25H,15,17-19H2 CODKOIBVVWPLHQ-UHFFFAOYSA-N 50574203 CHEMBL4862516 Cholinesterase 626 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574203 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574203&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164625434 471064348 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421440 Cc1cccc(CNCCOc2cccc3n(Cc4ccccc4)ccc23)c1 InChI=1S/C25H26N2O/c1-20-7-5-10-22(17-20)18-26-14-16-28-25-12-6-11-24-23(25)13-15-27(24)19-21-8-3-2-4-9-21/h2-13,15,17,26H,14,16,18-19H2,1H3 FIOBTXCHUKCEGJ-UHFFFAOYSA-N 50574204 CHEMBL4857018 Cholinesterase 958 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574204 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574204&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164614157 471064349 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421441 CC(C)(C)OC(=O)N1CCCC(CNCCOc2cccc3n(Cc4ccccc4)ccc23)C1 InChI=1S/C28H37N3O3/c1-28(2,3)34-27(32)31-16-8-11-23(21-31)19-29-15-18-33-26-13-7-12-25-24(26)14-17-30(25)20-22-9-5-4-6-10-22/h4-7,9-10,12-14,17,23,29H,8,11,15-16,18-21H2,1-3H3 JFPVRNAGSDCRRM-UHFFFAOYSA-N 50574205 CHEMBL4859019 Cholinesterase 11 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574205 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574205&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164616980 471064350 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421442 C(COc1cccc2N(Cc3ccccc3)CCc12)NCc1ccccc1 InChI=1S/C24H26N2O/c1-3-8-20(9-4-1)18-25-15-17-27-24-13-7-12-23-22(24)14-16-26(23)19-21-10-5-2-6-11-21/h1-13,25H,14-19H2 BBUYKTOCSJFCFH-UHFFFAOYSA-N 50574206 CHEMBL4855189 Cholinesterase 997 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574206 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574206&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164613499 471064351 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421443 Cc1cccc(CNCCOc2cccc3N(Cc4ccccc4)CCc23)c1 InChI=1S/C25H28N2O/c1-20-7-5-10-22(17-20)18-26-14-16-28-25-12-6-11-24-23(25)13-15-27(24)19-21-8-3-2-4-9-21/h2-12,17,26H,13-16,18-19H2,1H3 IHQMUBXDTGCLJV-UHFFFAOYSA-N 50574207 CHEMBL4856695 Cholinesterase 1263 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574207 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574207&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164614127 471064352 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421444 CC(C)(C)OC(=O)N1CCCC(CNCCOc2cccc3N(Cc4ccccc4)CCc23)C1 InChI=1S/C28H39N3O3/c1-28(2,3)34-27(32)31-16-8-11-23(21-31)19-29-15-18-33-26-13-7-12-25-24(26)14-17-30(25)20-22-9-5-4-6-10-22/h4-7,9-10,12-13,23,29H,8,11,14-21H2,1-3H3 DVIJBQYVTIZOAJ-UHFFFAOYSA-N 50574208 CHEMBL4866550 Cholinesterase 26 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574208 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574208&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164621422 471064353 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421445 O=C1Cc2c(cccc2OCCNCc2ccccc2)N1Cc1ccccc1 InChI=1S/C24H24N2O2/c27-24-16-21-22(26(24)18-20-10-5-2-6-11-20)12-7-13-23(21)28-15-14-25-17-19-8-3-1-4-9-19/h1-13,25H,14-18H2 FMHXVPVWIUUUBY-UHFFFAOYSA-N 50574209 CHEMBL4874675 Cholinesterase 4431 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574209 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574209&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164625686 471064354 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421446 Cc1cccc(CNCCOc2cccc3N(Cc4ccccc4)C(=O)Cc23)c1 InChI=1S/C25H26N2O2/c1-19-7-5-10-21(15-19)17-26-13-14-29-24-12-6-11-23-22(24)16-25(28)27(23)18-20-8-3-2-4-9-20/h2-12,15,26H,13-14,16-18H2,1H3 JGMWMHBTXUDMOB-UHFFFAOYSA-N 50574210 CHEMBL4873096 Cholinesterase 1847 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574210 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574210&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164619932 471064355 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421447 CC(C)(C)OC(=O)N1CCCC(CNCCOc2cccc3N(Cc4ccccc4)C(=O)Cc23)C1 InChI=1S/C28H37N3O4/c1-28(2,3)35-27(33)30-15-8-11-22(19-30)18-29-14-16-34-25-13-7-12-24-23(25)17-26(32)31(24)20-21-9-5-4-6-10-21/h4-7,9-10,12-13,22,29H,8,11,14-20H2,1-3H3 NKZAARTZOVUBBE-UHFFFAOYSA-N 50574211 CHEMBL4870158 Cholinesterase 1085 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574211 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574211&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164618556 471064356 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421448 O=c1[nH]c2c(OCCNCc3ccccc3)cccc2n1Cc1ccccc1 InChI=1S/C23H23N3O2/c27-23-25-22-20(26(23)17-19-10-5-2-6-11-19)12-7-13-21(22)28-15-14-24-16-18-8-3-1-4-9-18/h1-13,24H,14-17H2,(H,25,27) ANHGJPIQEGVWNM-UHFFFAOYSA-N 50574212 CHEMBL4849430 Cholinesterase 1844 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574212 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574212&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164611085 471064357 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421449 Cc1cccc(CNCCOc2cccc3n(Cc4ccccc4)c(=O)[nH]c23)c1 InChI=1S/C24H25N3O2/c1-18-7-5-10-20(15-18)16-25-13-14-29-22-12-6-11-21-23(22)26-24(28)27(21)17-19-8-3-2-4-9-19/h2-12,15,25H,13-14,16-17H2,1H3,(H,26,28) HAJBVPAHTUVAOI-UHFFFAOYSA-N 50574213 CHEMBL4866962 Cholinesterase 1501 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574213 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574213&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164619282 471064358 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51421450 CC(C)(C)OC(=O)N1CCCC(CNCCOc2cccc3n(Cc4ccccc4)c(=O)[nH]c23)C1 50574214 CHEMBL4858014 Cholinesterase 467 ChEMBL 10.1016/j.ejmech.2021.113792 10.7270/Q2514325 34530376 Wichur, T; Godyń, J; Góral, I; Latacz, G; Bucki, A; Siwek, A; Głuch-Lutwin, M; Mordyl, B; Śniecikowska, J; Walczak, M; Knez, D; Jukič, M; Sałat, K; Gobec, S; Kołaczkowski, M; Malawska, B; Brazzolotto, X; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50574214 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50574214&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164610373 471064359 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51433951 O=S(=O)(c1ccccc1)n1ccc2c(OCCNCCNc3c4CCCCc4nc4ccccc34)cccc12 InChI=1S/C31H32N4O3S/c36-39(37,23-9-2-1-3-10-23)35-21-17-26-29(35)15-8-16-30(26)38-22-20-32-18-19-33-31-24-11-4-6-13-27(24)34-28-14-7-5-12-25(28)31/h1-4,6,8-11,13,15-17,21,32H,5,7,12,14,18-20,22H2,(H,33,34) ZJGZDAGZMPYZKM-UHFFFAOYSA-N 50579318 CHEMBL4850546 Cholinesterase 24 ChEMBL 10.1016/j.ejmech.2021.113783 10.7270/Q21V5JSC 34461507 Wichur, T; Pasieka, A; Godyń, J; Panek, D; Góral, I; Latacz, G; Honkisz-Orzechowska, E; Bucki, A; Siwek, A; Głuch-Lutwin, M; Knez, D; Brazzolotto, X; Gobec, S; Kołaczkowski, M; Sabate, R; Malawska, B; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50579318 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50579318&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164614987 471055441 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51433952 O=S(=O)(c1ccccc1)n1ccc2c(OCCNCCCCNc3c4CCCCc4nc4ccccc34)cccc12 InChI=1S/C33H36N4O3S/c38-41(39,25-11-2-1-3-12-25)37-23-19-28-31(37)17-10-18-32(28)40-24-22-34-20-8-9-21-35-33-26-13-4-6-15-29(26)36-30-16-7-5-14-27(30)33/h1-4,6,10-13,15,17-19,23,34H,5,7-9,14,16,20-22,24H2,(H,35,36) RGVNNAMFFGOWSE-UHFFFAOYSA-N 50579320 CHEMBL4874513 Cholinesterase 9.4 ChEMBL 10.1016/j.ejmech.2021.113783 10.7270/Q21V5JSC 34461507 Wichur, T; Pasieka, A; Godyń, J; Panek, D; Góral, I; Latacz, G; Honkisz-Orzechowska, E; Bucki, A; Siwek, A; Głuch-Lutwin, M; Knez, D; Brazzolotto, X; Gobec, S; Kołaczkowski, M; Sabate, R; Malawska, B; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50579320 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50579320&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164629021 471055443 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51433953 O=S(=O)(c1ccccc1)n1ccc2c(OCCNCCCNc3c4CCCCc4nc4ccccc34)cccc12 InChI=1S/C32H34N4O3S/c37-40(38,24-10-2-1-3-11-24)36-22-18-27-30(36)16-8-17-31(27)39-23-21-33-19-9-20-34-32-25-12-4-6-14-28(25)35-29-15-7-5-13-26(29)32/h1-4,6,8,10-12,14,16-18,22,33H,5,7,9,13,15,19-21,23H2,(H,34,35) RWNBLJVFRIOUKS-UHFFFAOYSA-N 50579319 CHEMBL4850051 Cholinesterase 19 ChEMBL 10.1016/j.ejmech.2021.113783 10.7270/Q21V5JSC 34461507 Wichur, T; Pasieka, A; Godyń, J; Panek, D; Góral, I; Latacz, G; Honkisz-Orzechowska, E; Bucki, A; Siwek, A; Głuch-Lutwin, M; Knez, D; Brazzolotto, X; Gobec, S; Kołaczkowski, M; Sabate, R; Malawska, B; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50579319 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50579319&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164612723 471055442 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51433954 O=S(=O)(c1ccccc1)n1ccc2c(OCCNCCCCCCNc3c4CCCCc4nc4ccccc34)cccc12 InChI=1S/C35H40N4O3S/c40-43(41,27-13-4-3-5-14-27)39-25-21-30-33(39)19-12-20-34(30)42-26-24-36-22-10-1-2-11-23-37-35-28-15-6-8-17-31(28)38-32-18-9-7-16-29(32)35/h3-6,8,12-15,17,19-21,25,36H,1-2,7,9-11,16,18,22-24,26H2,(H,37,38) LVNXXZKRROEUAK-UHFFFAOYSA-N 50579322 CHEMBL4877482 Cholinesterase 4.1 ChEMBL 10.1016/j.ejmech.2021.113783 10.7270/Q21V5JSC 34461507 Wichur, T; Pasieka, A; Godyń, J; Panek, D; Góral, I; Latacz, G; Honkisz-Orzechowska, E; Bucki, A; Siwek, A; Głuch-Lutwin, M; Knez, D; Brazzolotto, X; Gobec, S; Kołaczkowski, M; Sabate, R; Malawska, B; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50579322 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50579322&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164627753 471055445 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51433955 O=S(=O)(c1ccccc1)n1ccc2c(OCCNCCCCCNc3c4CCCCc4nc4ccccc34)cccc12 InChI=1S/C34H38N4O3S/c39-42(40,26-12-3-1-4-13-26)38-24-20-29-32(38)18-11-19-33(29)41-25-23-35-21-9-2-10-22-36-34-27-14-5-7-16-30(27)37-31-17-8-6-15-28(31)34/h1,3-5,7,11-14,16,18-20,24,35H,2,6,8-10,15,17,21-23,25H2,(H,36,37) KNLJKUJSHLRNIN-UHFFFAOYSA-N 50579321 CHEMBL4848231 Cholinesterase 2.2 ChEMBL 10.1016/j.ejmech.2021.113783 10.7270/Q21V5JSC 34461507 Wichur, T; Pasieka, A; Godyń, J; Panek, D; Góral, I; Latacz, G; Honkisz-Orzechowska, E; Bucki, A; Siwek, A; Głuch-Lutwin, M; Knez, D; Brazzolotto, X; Gobec, S; Kołaczkowski, M; Sabate, R; Malawska, B; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50579321 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50579321&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164616626 471055444 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51433956 O=S(=O)(c1ccccc1)n1ccc2c(OCCNCCNCc3ccccc3)cccc12 InChI=1S/C25H27N3O3S/c29-32(30,22-10-5-2-6-11-22)28-18-14-23-24(28)12-7-13-25(23)31-19-17-26-15-16-27-20-21-8-3-1-4-9-21/h1-14,18,26-27H,15-17,19-20H2 KTSMSTZRQCMLRV-UHFFFAOYSA-N 50579323 CHEMBL4878361 Cholinesterase 528 ChEMBL 10.1016/j.ejmech.2021.113783 10.7270/Q21V5JSC 34461507 Wichur, T; Pasieka, A; Godyń, J; Panek, D; Góral, I; Latacz, G; Honkisz-Orzechowska, E; Bucki, A; Siwek, A; Głuch-Lutwin, M; Knez, D; Brazzolotto, X; Gobec, S; Kołaczkowski, M; Sabate, R; Malawska, B; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50579323 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50579323&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164626889 471055446 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51433957 O=S(=O)(c1ccccc1)n1ccc2c(OCCNCCCNCc3ccccc3)cccc12 InChI=1S/C26H29N3O3S/c30-33(31,23-11-5-2-6-12-23)29-19-15-24-25(29)13-7-14-26(24)32-20-18-27-16-8-17-28-21-22-9-3-1-4-10-22/h1-7,9-15,19,27-28H,8,16-18,20-21H2 GNYWHYVCSWQFNZ-UHFFFAOYSA-N 50579324 CHEMBL4866788 Cholinesterase 701 ChEMBL 10.1016/j.ejmech.2021.113783 10.7270/Q21V5JSC 34461507 Wichur, T; Pasieka, A; Godyń, J; Panek, D; Góral, I; Latacz, G; Honkisz-Orzechowska, E; Bucki, A; Siwek, A; Głuch-Lutwin, M; Knez, D; Brazzolotto, X; Gobec, S; Kołaczkowski, M; Sabate, R; Malawska, B; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50579324 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50579324&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164621427 471055447 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51433958 O=S(=O)(c1ccccc1)n1ccc2c(OCCNCCCCNCc3ccccc3)cccc12 InChI=1S/C27H31N3O3S/c31-34(32,24-12-5-2-6-13-24)30-20-16-25-26(30)14-9-15-27(25)33-21-19-28-17-7-8-18-29-22-23-10-3-1-4-11-23/h1-6,9-16,20,28-29H,7-8,17-19,21-22H2 YWGQORRCTVXKPF-UHFFFAOYSA-N 50579325 CHEMBL4850488 Cholinesterase 887 ChEMBL 10.1016/j.ejmech.2021.113783 10.7270/Q21V5JSC 34461507 Wichur, T; Pasieka, A; Godyń, J; Panek, D; Góral, I; Latacz, G; Honkisz-Orzechowska, E; Bucki, A; Siwek, A; Głuch-Lutwin, M; Knez, D; Brazzolotto, X; Gobec, S; Kołaczkowski, M; Sabate, R; Malawska, B; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50579325 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50579325&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164612759 471055448 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51433959 O=S(=O)(c1ccccc1)n1ccc2c(OCCNCCCCCNCc3ccccc3)cccc12 InChI=1S/C28H33N3O3S/c32-35(33,25-13-6-2-7-14-25)31-21-17-26-27(31)15-10-16-28(26)34-22-20-29-18-8-3-9-19-30-23-24-11-4-1-5-12-24/h1-2,4-7,10-17,21,29-30H,3,8-9,18-20,22-23H2 QDELMTYTNUZKMD-UHFFFAOYSA-N 50579326 CHEMBL4871964 Cholinesterase 394 ChEMBL 10.1016/j.ejmech.2021.113783 10.7270/Q21V5JSC 34461507 Wichur, T; Pasieka, A; Godyń, J; Panek, D; Góral, I; Latacz, G; Honkisz-Orzechowska, E; Bucki, A; Siwek, A; Głuch-Lutwin, M; Knez, D; Brazzolotto, X; Gobec, S; Kołaczkowski, M; Sabate, R; Malawska, B; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50579326 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50579326&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164622997 471055449 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51433960 Clc1ccccc1CNCCNCCOc1cccc2n(ccc12)S(=O)(=O)c1ccccc1 InChI=1S/C25H26ClN3O3S/c26-23-10-5-4-7-20(23)19-28-15-14-27-16-18-32-25-12-6-11-24-22(25)13-17-29(24)33(30,31)21-8-2-1-3-9-21/h1-13,17,27-28H,14-16,18-19H2 ZQCBFXXNIMDVLV-UHFFFAOYSA-N 50579328 CHEMBL4878383 Cholinesterase 586 ChEMBL 10.1016/j.ejmech.2021.113783 10.7270/Q21V5JSC 34461507 Wichur, T; Pasieka, A; Godyń, J; Panek, D; Góral, I; Latacz, G; Honkisz-Orzechowska, E; Bucki, A; Siwek, A; Głuch-Lutwin, M; Knez, D; Brazzolotto, X; Gobec, S; Kołaczkowski, M; Sabate, R; Malawska, B; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50579328 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50579328&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164627505 471055451 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51433961 Clc1cccc(CNCCNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)c1 InChI=1S/C25H26ClN3O3S/c26-21-7-4-6-20(18-21)19-28-14-13-27-15-17-32-25-11-5-10-24-23(25)12-16-29(24)33(30,31)22-8-2-1-3-9-22/h1-12,16,18,27-28H,13-15,17,19H2 OQHRGQKGSVATEK-UHFFFAOYSA-N 50579327 CHEMBL4847532 Cholinesterase 1075 ChEMBL 10.1016/j.ejmech.2021.113783 10.7270/Q21V5JSC 34461507 Wichur, T; Pasieka, A; Godyń, J; Panek, D; Góral, I; Latacz, G; Honkisz-Orzechowska, E; Bucki, A; Siwek, A; Głuch-Lutwin, M; Knez, D; Brazzolotto, X; Gobec, S; Kołaczkowski, M; Sabate, R; Malawska, B; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50579327 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50579327&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164617683 471055450 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51433962 Clc1ccc(CNCCNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)cc1 InChI=1S/C25H26ClN3O3S/c26-21-11-9-20(10-12-21)19-28-15-14-27-16-18-32-25-8-4-7-24-23(25)13-17-29(24)33(30,31)22-5-2-1-3-6-22/h1-13,17,27-28H,14-16,18-19H2 VTDZXMJYBRQYER-UHFFFAOYSA-N 50579329 CHEMBL4863218 Cholinesterase 1991 ChEMBL 10.1016/j.ejmech.2021.113783 10.7270/Q21V5JSC 34461507 Wichur, T; Pasieka, A; Godyń, J; Panek, D; Góral, I; Latacz, G; Honkisz-Orzechowska, E; Bucki, A; Siwek, A; Głuch-Lutwin, M; Knez, D; Brazzolotto, X; Gobec, S; Kołaczkowski, M; Sabate, R; Malawska, B; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50579329 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50579329&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164619537 471055452 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51433963 Clc1cc(Cl)cc(CNCCNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)c1 InChI=1S/C25H25Cl2N3O3S/c26-20-15-19(16-21(27)17-20)18-29-11-10-28-12-14-33-25-8-4-7-24-23(25)9-13-30(24)34(31,32)22-5-2-1-3-6-22/h1-9,13,15-17,28-29H,10-12,14,18H2 ZJLRDXQXCGGYEO-UHFFFAOYSA-N 50579330 CHEMBL4847373 Cholinesterase 1661 ChEMBL 10.1016/j.ejmech.2021.113783 10.7270/Q21V5JSC 34461507 Wichur, T; Pasieka, A; Godyń, J; Panek, D; Góral, I; Latacz, G; Honkisz-Orzechowska, E; Bucki, A; Siwek, A; Głuch-Lutwin, M; Knez, D; Brazzolotto, X; Gobec, S; Kołaczkowski, M; Sabate, R; Malawska, B; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50579330 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50579330&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164610452 471055453 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51433964 Fc1ccc(CNCCNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)cc1 InChI=1S/C25H26FN3O3S/c26-21-11-9-20(10-12-21)19-28-15-14-27-16-18-32-25-8-4-7-24-23(25)13-17-29(24)33(30,31)22-5-2-1-3-6-22/h1-13,17,27-28H,14-16,18-19H2 PMICITQTHHHUOJ-UHFFFAOYSA-N 50579331 CHEMBL4852099 Cholinesterase 1304 ChEMBL 10.1016/j.ejmech.2021.113783 10.7270/Q21V5JSC 34461507 Wichur, T; Pasieka, A; Godyń, J; Panek, D; Góral, I; Latacz, G; Honkisz-Orzechowska, E; Bucki, A; Siwek, A; Głuch-Lutwin, M; Knez, D; Brazzolotto, X; Gobec, S; Kołaczkowski, M; Sabate, R; Malawska, B; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50579331 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50579331&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164616201 471055454 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51433965 [O-][N+](=O)c1ccc(CNCCNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)cc1 InChI=1S/C25H26N4O5S/c30-29(31)21-11-9-20(10-12-21)19-27-15-14-26-16-18-34-25-8-4-7-24-23(25)13-17-28(24)35(32,33)22-5-2-1-3-6-22/h1-13,17,26-27H,14-16,18-19H2 XANNXNUNAWHKLB-UHFFFAOYSA-N 50579332 CHEMBL4851595 Cholinesterase 4263 ChEMBL 10.1016/j.ejmech.2021.113783 10.7270/Q21V5JSC 34461507 Wichur, T; Pasieka, A; Godyń, J; Panek, D; Góral, I; Latacz, G; Honkisz-Orzechowska, E; Bucki, A; Siwek, A; Głuch-Lutwin, M; Knez, D; Brazzolotto, X; Gobec, S; Kołaczkowski, M; Sabate, R; Malawska, B; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50579332 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50579332&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164615023 471055455 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51433966 COc1ccc(CNCCNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)cc1 InChI=1S/C26H29N3O4S/c1-32-22-12-10-21(11-13-22)20-28-16-15-27-17-19-33-26-9-5-8-25-24(26)14-18-29(25)34(30,31)23-6-3-2-4-7-23/h2-14,18,27-28H,15-17,19-20H2,1H3 MFRQMIJNSWPORL-UHFFFAOYSA-N 50579333 CHEMBL4868597 Cholinesterase 2071 ChEMBL 10.1016/j.ejmech.2021.113783 10.7270/Q21V5JSC 34461507 Wichur, T; Pasieka, A; Godyń, J; Panek, D; Góral, I; Latacz, G; Honkisz-Orzechowska, E; Bucki, A; Siwek, A; Głuch-Lutwin, M; Knez, D; Brazzolotto, X; Gobec, S; Kołaczkowski, M; Sabate, R; Malawska, B; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50579333 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50579333&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164622837 471055456 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51433967 Cc1cccc(CNCCNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)c1 InChI=1S/C26H29N3O3S/c1-21-7-5-8-22(19-21)20-28-15-14-27-16-18-32-26-12-6-11-25-24(26)13-17-29(25)33(30,31)23-9-3-2-4-10-23/h2-13,17,19,27-28H,14-16,18,20H2,1H3 LGQFRQGMCBUHKU-UHFFFAOYSA-N 50579334 CHEMBL4864206 Cholinesterase 1067 ChEMBL 10.1016/j.ejmech.2021.113783 10.7270/Q21V5JSC 34461507 Wichur, T; Pasieka, A; Godyń, J; Panek, D; Góral, I; Latacz, G; Honkisz-Orzechowska, E; Bucki, A; Siwek, A; Głuch-Lutwin, M; Knez, D; Brazzolotto, X; Gobec, S; Kołaczkowski, M; Sabate, R; Malawska, B; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50579334 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50579334&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164620015 471055457 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51433968 FC(F)(F)c1cccc(CNCCNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)c1 InChI=1S/C26H26F3N3O3S/c27-26(28,29)21-7-4-6-20(18-21)19-31-14-13-30-15-17-35-25-11-5-10-24-23(25)12-16-32(24)36(33,34)22-8-2-1-3-9-22/h1-12,16,18,30-31H,13-15,17,19H2 UYCPBABJEXGVCX-UHFFFAOYSA-N 50579335 CHEMBL4854972 Cholinesterase 2118 ChEMBL 10.1016/j.ejmech.2021.113783 10.7270/Q21V5JSC 34461507 Wichur, T; Pasieka, A; Godyń, J; Panek, D; Góral, I; Latacz, G; Honkisz-Orzechowska, E; Bucki, A; Siwek, A; Głuch-Lutwin, M; Knez, D; Brazzolotto, X; Gobec, S; Kołaczkowski, M; Sabate, R; Malawska, B; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50579335 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50579335&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164613488 471055458 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51433969 CCN(C)C(=O)Oc1cccc(CNCCNCCOc2cccc3n(ccc23)S(=O)(=O)c2ccccc2)c1 InChI=1S/C29H34N4O5S/c1-3-32(2)29(34)38-24-10-7-9-23(21-24)22-31-17-16-30-18-20-37-28-14-8-13-27-26(28)15-19-33(27)39(35,36)25-11-5-4-6-12-25/h4-15,19,21,30-31H,3,16-18,20,22H2,1-2H3 ICTMWXFVTKPBCM-UHFFFAOYSA-N 50579336 CHEMBL4845823 Cholinesterase 455 ChEMBL 10.1016/j.ejmech.2021.113783 10.7270/Q21V5JSC 34461507 Wichur, T; Pasieka, A; Godyń, J; Panek, D; Góral, I; Latacz, G; Honkisz-Orzechowska, E; Bucki, A; Siwek, A; Głuch-Lutwin, M; Knez, D; Brazzolotto, X; Gobec, S; Kołaczkowski, M; Sabate, R; Malawska, B; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50579336 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50579336&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164609469 471055459 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51433970 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 1830 ChEMBL 10.1016/j.ejmech.2021.113783 10.7270/Q21V5JSC 34461507 Wichur, T; Pasieka, A; Godyń, J; Panek, D; Góral, I; Latacz, G; Honkisz-Orzechowska, E; Bucki, A; Siwek, A; Głuch-Lutwin, M; Knez, D; Brazzolotto, X; Gobec, S; Kołaczkowski, M; Sabate, R; Malawska, B; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51433971 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 15 ChEMBL 10.1016/j.ejmech.2021.113783 10.7270/Q21V5JSC 34461507 Wichur, T; Pasieka, A; Godyń, J; Panek, D; Góral, I; Latacz, G; Honkisz-Orzechowska, E; Bucki, A; Siwek, A; Głuch-Lutwin, M; Knez, D; Brazzolotto, X; Gobec, S; Kołaczkowski, M; Sabate, R; Malawska, B; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51433972 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 11682 2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::Rivastigmine.tartrate::US9586925, Rivastigmine Cholinesterase 2195 ChEMBL 10.1016/j.ejmech.2021.113783 10.7270/Q21V5JSC 34461507 Wichur, T; Pasieka, A; Godyń, J; Panek, D; Góral, I; Latacz, G; Honkisz-Orzechowska, E; Bucki, A; Siwek, A; Głuch-Lutwin, M; Knez, D; Brazzolotto, X; Gobec, S; Kołaczkowski, M; Sabate, R; Malawska, B; Więckowska, A Jagiellonian University Medical College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=11682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=11682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46512204 DB00989 C11766 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51445512 CON(C)C(=O)Oc1ccccc1C(=O)NCCc1c[nH]c2ccccc12 InChI=1S/C20H21N3O4/c1-23(26-2)20(25)27-18-10-6-4-8-16(18)19(24)21-12-11-14-13-22-17-9-5-3-7-15(14)17/h3-10,13,22H,11-12H2,1-2H3,(H,21,24) HMRQNXQTMJUDBQ-UHFFFAOYSA-N 50584018 CHEMBL5071046 Cholinesterase 892 ChEMBL 10.1016/j.ejmech.2021.114044 10.7270/Q22F7S9X 34923430 Liu, D; Zhang, H; Wang, Y; Liu, W; Yin, G; Wang, D; Li, J; Shi, T; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50584018 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50584018&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166630770 476020105 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51445513 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 2660 ChEMBL 10.1016/j.ejmech.2021.114044 10.7270/Q22F7S9X 34923430 Liu, D; Zhang, H; Wang, Y; Liu, W; Yin, G; Wang, D; Li, J; Shi, T; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51445514 Oc1ccccc1C(=O)NCCc1c[nH]c2ccccc12 InChI=1S/C17H16N2O2/c20-16-8-4-2-6-14(16)17(21)18-10-9-12-11-19-15-7-3-1-5-13(12)15/h1-8,11,19-20H,9-10H2,(H,18,21) XBPYTDZHCNJRBY-UHFFFAOYSA-N 50551616 CHEMBL1512476 Cholinesterase 15900 ChEMBL 10.1016/j.ejmech.2021.114044 10.7270/Q22F7S9X 34923430 Liu, D; Zhang, H; Wang, Y; Liu, W; Yin, G; Wang, D; Li, J; Shi, T; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50551616 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50551616&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10356316 461681956 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51445515 CN(C)C(=O)Oc1ccccc1C(=O)NCCc1c[nH]c2ccccc12 InChI=1S/C20H21N3O3/c1-23(2)20(25)26-18-10-6-4-8-16(18)19(24)21-12-11-14-13-22-17-9-5-3-7-15(14)17/h3-10,13,22H,11-12H2,1-2H3,(H,21,24) CYASXNGSXHIQKJ-UHFFFAOYSA-N 50584019 CHEMBL5092611 Cholinesterase 3950 ChEMBL 10.1016/j.ejmech.2021.114044 10.7270/Q22F7S9X 34923430 Liu, D; Zhang, H; Wang, Y; Liu, W; Yin, G; Wang, D; Li, J; Shi, T; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50584019 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50584019&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166636147 476020106 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51445516 CCN(CC)C(=O)Oc1ccccc1C(=O)NCCc1c[nH]c2ccccc12 InChI=1S/C22H25N3O3/c1-3-25(4-2)22(27)28-20-12-8-6-10-18(20)21(26)23-14-13-16-15-24-19-11-7-5-9-17(16)19/h5-12,15,24H,3-4,13-14H2,1-2H3,(H,23,26) NHJZBOKOZOHETK-UHFFFAOYSA-N 50584020 CHEMBL5090009 Cholinesterase 14010 ChEMBL 10.1016/j.ejmech.2021.114044 10.7270/Q22F7S9X 34923430 Liu, D; Zhang, H; Wang, Y; Liu, W; Yin, G; Wang, D; Li, J; Shi, T; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50584020 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50584020&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166632361 476020107 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51445517 CCCN(CCC)C(=O)Oc1ccccc1C(=O)NCCc1c[nH]c2ccccc12 InChI=1S/C24H29N3O3/c1-3-15-27(16-4-2)24(29)30-22-12-8-6-10-20(22)23(28)25-14-13-18-17-26-21-11-7-5-9-19(18)21/h5-12,17,26H,3-4,13-16H2,1-2H3,(H,25,28) HJDYSQRUMRMPQC-UHFFFAOYSA-N 50584021 CHEMBL5081564 Cholinesterase 35770 ChEMBL 10.1016/j.ejmech.2021.114044 10.7270/Q22F7S9X 34923430 Liu, D; Zhang, H; Wang, Y; Liu, W; Yin, G; Wang, D; Li, J; Shi, T; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50584021 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50584021&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166627615 476020108 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51445518 CCCCN(CCCC)C(=O)Oc1ccccc1C(=O)NCCc1c[nH]c2ccccc12 InChI=1S/C26H33N3O3/c1-3-5-17-29(18-6-4-2)26(31)32-24-14-10-8-12-22(24)25(30)27-16-15-20-19-28-23-13-9-7-11-21(20)23/h7-14,19,28H,3-6,15-18H2,1-2H3,(H,27,30) XJTWDQILVMXKED-UHFFFAOYSA-N 50584022 CHEMBL5090361 Cholinesterase 8010 ChEMBL 10.1016/j.ejmech.2021.114044 10.7270/Q22F7S9X 34923430 Liu, D; Zhang, H; Wang, Y; Liu, W; Yin, G; Wang, D; Li, J; Shi, T; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50584022 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50584022&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166634024 476020109 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51445519 O=C(Oc1ccccc1C(=O)NCCc1c[nH]c2ccccc12)N(c1ccccc1)c1ccccc1 InChI=1S/C30H25N3O3/c34-29(31-20-19-22-21-32-27-17-9-7-15-25(22)27)26-16-8-10-18-28(26)36-30(35)33(23-11-3-1-4-12-23)24-13-5-2-6-14-24/h1-18,21,32H,19-20H2,(H,31,34) KPJWNNCZUKQAOA-UHFFFAOYSA-N 50584023 CHEMBL5082316 Cholinesterase 4730 ChEMBL 10.1016/j.ejmech.2021.114044 10.7270/Q22F7S9X 34923430 Liu, D; Zhang, H; Wang, Y; Liu, W; Yin, G; Wang, D; Li, J; Shi, T; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50584023 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50584023&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166628394 476020110 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51445520 O=C(Oc1ccccc1C(=O)NCCc1c[nH]c2ccccc12)N(Cc1ccccc1)Cc1ccccc1 InChI=1S/C32H29N3O3/c36-31(33-20-19-26-21-34-29-17-9-7-15-27(26)29)28-16-8-10-18-30(28)38-32(37)35(22-24-11-3-1-4-12-24)23-25-13-5-2-6-14-25/h1-18,21,34H,19-20,22-23H2,(H,33,36) AWXNIPCCRHONEN-UHFFFAOYSA-N 50584024 CHEMBL5076596 Cholinesterase 15430 ChEMBL 10.1016/j.ejmech.2021.114044 10.7270/Q22F7S9X 34923430 Liu, D; Zhang, H; Wang, Y; Liu, W; Yin, G; Wang, D; Li, J; Shi, T; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50584024 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50584024&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166625862 476020111 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51445521 CON(C)C(=O)Oc1ccccc1C(=O)NCCc1c[nH]c2ccccc12 InChI=1S/C20H21N3O4/c1-23(26-2)20(25)27-18-10-6-4-8-16(18)19(24)21-12-11-14-13-22-17-9-5-3-7-15(14)17/h3-10,13,22H,11-12H2,1-2H3,(H,21,24) HMRQNXQTMJUDBQ-UHFFFAOYSA-N 50584018 CHEMBL5071046 Cholinesterase 1840 ChEMBL 10.1016/j.ejmech.2021.114044 10.7270/Q22F7S9X 34923430 Liu, D; Zhang, H; Wang, Y; Liu, W; Yin, G; Wang, D; Li, J; Shi, T; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50584018 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50584018&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166630770 476020105 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51445522 CN(C(=O)Oc1ccccc1C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1 InChI=1S/C25H23N3O3/c1-28(19-9-3-2-4-10-19)25(30)31-23-14-8-6-12-21(23)24(29)26-16-15-18-17-27-22-13-7-5-11-20(18)22/h2-14,17,27H,15-16H2,1H3,(H,26,29) AYUYMKYBDBAIQA-UHFFFAOYSA-N 50584025 CHEMBL5089968 Cholinesterase 29700 ChEMBL 10.1016/j.ejmech.2021.114044 10.7270/Q22F7S9X 34923430 Liu, D; Zhang, H; Wang, Y; Liu, W; Yin, G; Wang, D; Li, J; Shi, T; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50584025 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50584025&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166636423 476020112 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51445523 O=C(Oc1ccccc1C(=O)NCCc1c[nH]c2ccccc12)N1CCC1 InChI=1S/C21H21N3O3/c25-20(22-11-10-15-14-23-18-8-3-1-6-16(15)18)17-7-2-4-9-19(17)27-21(26)24-12-5-13-24/h1-4,6-9,14,23H,5,10-13H2,(H,22,25) XXLDSCWRJNBDQK-UHFFFAOYSA-N 50584026 CHEMBL5085850 Cholinesterase 17040 ChEMBL 10.1016/j.ejmech.2021.114044 10.7270/Q22F7S9X 34923430 Liu, D; Zhang, H; Wang, Y; Liu, W; Yin, G; Wang, D; Li, J; Shi, T; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50584026 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50584026&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166633892 476020113 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51445524 O=C(Oc1ccccc1C(=O)NCCc1c[nH]c2ccccc12)N1CCCC1 InChI=1S/C22H23N3O3/c26-21(23-12-11-16-15-24-19-9-3-1-7-17(16)19)18-8-2-4-10-20(18)28-22(27)25-13-5-6-14-25/h1-4,7-10,15,24H,5-6,11-14H2,(H,23,26) VFWODWHGHVWSIC-UHFFFAOYSA-N 50584027 CHEMBL5070223 Cholinesterase 1200 ChEMBL 10.1016/j.ejmech.2021.114044 10.7270/Q22F7S9X 34923430 Liu, D; Zhang, H; Wang, Y; Liu, W; Yin, G; Wang, D; Li, J; Shi, T; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50584027 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50584027&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166625335 476020114 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51445525 O=C(Oc1ccccc1C(=O)NCCc1c[nH]c2ccccc12)N1CCCCC1 InChI=1S/C23H25N3O3/c27-22(24-13-12-17-16-25-20-10-4-2-8-18(17)20)19-9-3-5-11-21(19)29-23(28)26-14-6-1-7-15-26/h2-5,8-11,16,25H,1,6-7,12-15H2,(H,24,27) JJYVKUAWFGGMDT-UHFFFAOYSA-N 50584028 CHEMBL5087024 Cholinesterase >100000 ChEMBL 10.1016/j.ejmech.2021.114044 10.7270/Q22F7S9X 34923430 Liu, D; Zhang, H; Wang, Y; Liu, W; Yin, G; Wang, D; Li, J; Shi, T; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50584028 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50584028&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166635301 476020115 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436089 Oc1ccc(cc1)[C@@H]1CC(=O)c2ccc(O)cc2O1 InChI=1S/C15H12O4/c16-10-3-1-9(2-4-10)14-8-13(18)12-6-5-11(17)7-15(12)19-14/h1-7,14,16-17H,8H2/t14-/m0/s1 FURUXTVZLHCCNA-AWEZNQCLSA-N 50241408 (2S)-liquiritigenin::7-HYDROXY-2-(4-HYDROXY-PHENYL)-CHROMAN-4-ONE::CHEMBL252642::LIQUIRTIGENIN::Liquiritigenin Cholinesterase 14040 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50241408 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50241408&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search DFV 1FM7,1JX1,1JX0 114829 104098758 28777 CHEMBL252642 DB03601 C09762 ZINC00985403 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436090 CC(C)=CCOc1ccc2C(=O)CC(Oc2c1)c1ccccc1 InChI=1S/C20H20O3/c1-14(2)10-11-22-16-8-9-17-18(21)13-19(23-20(17)12-16)15-6-4-3-5-7-15/h3-10,12,19H,11,13H2,1-2H3 GIXIYAFVCREOAY-UHFFFAOYSA-N 50580123 CHEMBL5081362 Cholinesterase 9540 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580123 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580123&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12310896 476025128 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436091 CC(C)=CCOc1ccc2C(=O)CC(Oc2c1)c1ccccc1F InChI=1S/C20H19FO3/c1-13(2)9-10-23-14-7-8-16-18(22)12-20(24-19(16)11-14)15-5-3-4-6-17(15)21/h3-9,11,20H,10,12H2,1-2H3 BREBBHBAULZBKV-UHFFFAOYSA-N 50580124 CHEMBL5083124 Cholinesterase 5470 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580124 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580124&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166629635 476025129 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436092 CC(C)=CCOc1ccc2C(=O)CC(Oc2c1)c1cccc(F)c1 InChI=1S/C20H19FO3/c1-13(2)8-9-23-16-6-7-17-18(22)12-19(24-20(17)11-16)14-4-3-5-15(21)10-14/h3-8,10-11,19H,9,12H2,1-2H3 XTXCAEHXXGPLNS-UHFFFAOYSA-N 50580125 CHEMBL5087641 Cholinesterase 4020 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580125 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580125&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166632605 476025130 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436093 CC(C)=CCOc1ccc2C(=O)CC(Oc2c1)c1ccc(F)cc1 InChI=1S/C20H19FO3/c1-13(2)9-10-23-16-7-8-17-18(22)12-19(24-20(17)11-16)14-3-5-15(21)6-4-14/h3-9,11,19H,10,12H2,1-2H3 BPBCGCUGPGYHII-UHFFFAOYSA-N 50580126 CHEMBL5081762 Cholinesterase 2580 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580126 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580126&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166630472 476025131 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436094 CC(C)=CCOc1ccc2C(=O)CC(Oc2c1)c1ccccc1Cl InChI=1S/C20H19ClO3/c1-13(2)9-10-23-14-7-8-16-18(22)12-20(24-19(16)11-14)15-5-3-4-6-17(15)21/h3-9,11,20H,10,12H2,1-2H3 PQZYHNXFAFNVTF-UHFFFAOYSA-N 50580127 CHEMBL5085264 Cholinesterase 5370 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580127 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580127&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166636270 476025132 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436095 CC(C)=CCOc1ccc2C(=O)CC(Oc2c1)c1cccc(Cl)c1 InChI=1S/C20H19ClO3/c1-13(2)8-9-23-16-6-7-17-18(22)12-19(24-20(17)11-16)14-4-3-5-15(21)10-14/h3-8,10-11,19H,9,12H2,1-2H3 RRKBRDBYCHKQPE-UHFFFAOYSA-N 50580128 CHEMBL5075963 Cholinesterase 3590 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580128 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580128&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166626440 476025133 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436096 CC(C)=CCOc1ccc2C(=O)CC(Oc2c1)c1ccc(Cl)cc1 InChI=1S/C20H19ClO3/c1-13(2)9-10-23-16-7-8-17-18(22)12-19(24-20(17)11-16)14-3-5-15(21)6-4-14/h3-9,11,19H,10,12H2,1-2H3 WXGALQLWURYLIW-UHFFFAOYSA-N 50580129 CHEMBL5077897 Cholinesterase 4220 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580129 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580129&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166628671 476025134 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436097 CC(C)=CCOc1ccc2C(=O)CC(Oc2c1)c1ccc(Cl)cc1Cl InChI=1S/C20H18Cl2O3/c1-12(2)7-8-24-14-4-6-16-18(23)11-20(25-19(16)10-14)15-5-3-13(21)9-17(15)22/h3-7,9-10,20H,8,11H2,1-2H3 XTHVNZRSOYFOIJ-UHFFFAOYSA-N 50580130 CHEMBL5080963 Cholinesterase 3470 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580130 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580130&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166630004 476025135 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436098 CC(C)=CCOc1ccc2C(=O)CC(Oc2c1)c1ccccc1Br InChI=1S/C20H19BrO3/c1-13(2)9-10-23-14-7-8-16-18(22)12-20(24-19(16)11-14)15-5-3-4-6-17(15)21/h3-9,11,20H,10,12H2,1-2H3 GMRRQJXDWSZDQO-UHFFFAOYSA-N 50580131 CHEMBL5080653 Cholinesterase 5020 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580131 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580131&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166629479 476025136 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436099 CC(C)=CCOc1ccc2C(=O)CC(Oc2c1)c1cccc(Br)c1 InChI=1S/C20H19BrO3/c1-13(2)8-9-23-16-6-7-17-18(22)12-19(24-20(17)11-16)14-4-3-5-15(21)10-14/h3-8,10-11,19H,9,12H2,1-2H3 WWSDWKVZMTWOND-UHFFFAOYSA-N 50580132 CHEMBL5093283 Cholinesterase 4500 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580132 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580132&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166633058 476025137 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436100 CC(C)=CCOc1ccc2C(=O)CC(Oc2c1)c1ccc(Br)cc1 InChI=1S/C20H19BrO3/c1-13(2)9-10-23-16-7-8-17-18(22)12-19(24-20(17)11-16)14-3-5-15(21)6-4-14/h3-9,11,19H,10,12H2,1-2H3 AUEIZHQQOKHUGN-UHFFFAOYSA-N 50580133 CHEMBL5079923 Cholinesterase 3870 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580133 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580133&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166629268 476025138 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436101 CC(C)=CCOc1ccc2C(=O)CC(Oc2c1)c1ccc(C)cc1 InChI=1S/C21H22O3/c1-14(2)10-11-23-17-8-9-18-19(22)13-20(24-21(18)12-17)16-6-4-15(3)5-7-16/h4-10,12,20H,11,13H2,1-3H3 NVBCXBBCPNOBIK-UHFFFAOYSA-N 50580134 CHEMBL5089282 Cholinesterase 4090 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580134 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580134&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166635675 476025139 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436102 COc1ccc(cc1)C1CC(=O)c2ccc(OCC=C(C)C)cc2O1 InChI=1S/C21H22O4/c1-14(2)10-11-24-17-8-9-18-19(22)13-20(25-21(18)12-17)15-4-6-16(23-3)7-5-15/h4-10,12,20H,11,13H2,1-3H3 NOXCFNVAAYFKKP-UHFFFAOYSA-N 50580135 CHEMBL5076807 Cholinesterase 4540 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580135 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580135&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166627035 476025140 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436103 CC(C)=CCOc1ccc2C(=O)CC(Oc2c1)c1ccc(C)cc1C InChI=1S/C22H24O3/c1-14(2)9-10-24-17-6-8-19-20(23)13-22(25-21(19)12-17)18-7-5-15(3)11-16(18)4/h5-9,11-12,22H,10,13H2,1-4H3 PJYWGNMWEJXUKT-UHFFFAOYSA-N 50580136 CHEMBL5081943 Cholinesterase 3420 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580136 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580136&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166629542 476025141 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436104 COc1ccc(C2CC(=O)c3ccc(OCC=C(C)C)cc3O2)c(OC)c1 InChI=1S/C22H24O5/c1-14(2)9-10-26-16-6-7-17-19(23)13-22(27-21(17)12-16)18-8-5-15(24-3)11-20(18)25-4/h5-9,11-12,22H,10,13H2,1-4H3 KHVIKPIDTOJTHV-UHFFFAOYSA-N 50580137 CHEMBL5081383 Cholinesterase 5650 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580137 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580137&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166628348 476025142 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436105 CC(C)=CCOc1ccc2C(=O)CC(Oc2c1)c1ccc(O)cc1 InChI=1S/C20H20O4/c1-13(2)9-10-23-16-7-8-17-18(22)12-19(24-20(17)11-16)14-3-5-15(21)6-4-14/h3-9,11,19,21H,10,12H2,1-2H3 JUHOFPRGVXWYBM-UHFFFAOYSA-N 50580138 CHEMBL5072304 Cholinesterase 5020 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580138 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580138&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166630757 476025143 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436106 CC(C)=CCOc1cc(O)c2C(=O)CC(Oc2c1)c1ccccc1 InChI=1S/C20H20O4/c1-13(2)8-9-23-15-10-16(21)20-17(22)12-18(24-19(20)11-15)14-6-4-3-5-7-14/h3-8,10-11,18,21H,9,12H2,1-2H3 WZSJHPLGMXDPQW-UHFFFAOYSA-N 50580139 CHEMBL5088826 Cholinesterase 6540 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580139 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580139&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 21721815 476025144 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436107 CC(C)=CCOc1cc(O)c2C(=O)CC(Oc2c1)c1ccccc1F InChI=1S/C20H19FO4/c1-12(2)7-8-24-13-9-16(22)20-17(23)11-18(25-19(20)10-13)14-5-3-4-6-15(14)21/h3-7,9-10,18,22H,8,11H2,1-2H3 CRQZVNGPRPVUSD-UHFFFAOYSA-N 50580140 CHEMBL5083618 Cholinesterase 7370 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580140 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580140&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166629877 476025145 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51445526 O=C(Oc1ccccc1C(=O)NCCc1c[nH]c2ccccc12)N1CCCCCC1 InChI=1S/C24H27N3O3/c28-23(25-14-13-18-17-26-21-11-5-3-9-19(18)21)20-10-4-6-12-22(20)30-24(29)27-15-7-1-2-8-16-27/h3-6,9-12,17,26H,1-2,7-8,13-16H2,(H,25,28) BQQSYVUWOFDHIV-UHFFFAOYSA-N 50584029 CHEMBL5090134 Cholinesterase 24060 ChEMBL 10.1016/j.ejmech.2021.114044 10.7270/Q22F7S9X 34923430 Liu, D; Zhang, H; Wang, Y; Liu, W; Yin, G; Wang, D; Li, J; Shi, T; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50584029 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50584029&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166634671 476020116 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51445527 O=C(Oc1ccccc1C(=O)NCCc1c[nH]c2ccccc12)N1CCOCC1 InChI=1S/C22H23N3O4/c26-21(23-10-9-16-15-24-19-7-3-1-5-17(16)19)18-6-2-4-8-20(18)29-22(27)25-11-13-28-14-12-25/h1-8,15,24H,9-14H2,(H,23,26) KBJGXDJYDRIGGR-UHFFFAOYSA-N 50584030 CHEMBL5071335 Cholinesterase 10010 ChEMBL 10.1016/j.ejmech.2021.114044 10.7270/Q22F7S9X 34923430 Liu, D; Zhang, H; Wang, Y; Liu, W; Yin, G; Wang, D; Li, J; Shi, T; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50584030 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50584030&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166630795 476020117 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51445528 O=C(Oc1ccccc1C(=O)NCCc1c[nH]c2ccccc12)N1CCSCC1 InChI=1S/C22H23N3O3S/c26-21(23-10-9-16-15-24-19-7-3-1-5-17(16)19)18-6-2-4-8-20(18)28-22(27)25-11-13-29-14-12-25/h1-8,15,24H,9-14H2,(H,23,26) HAIHLJAYGYHXQB-UHFFFAOYSA-N 50584031 CHEMBL5092680 Cholinesterase 1440 ChEMBL 10.1016/j.ejmech.2021.114044 10.7270/Q22F7S9X 34923430 Liu, D; Zhang, H; Wang, Y; Liu, W; Yin, G; Wang, D; Li, J; Shi, T; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50584031 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50584031&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166631515 476020118 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51445529 CN1CCN(CC1)C(=O)Oc1ccccc1C(=O)NCCc1c[nH]c2ccccc12 InChI=1S/C23H26N4O3/c1-26-12-14-27(15-13-26)23(29)30-21-9-5-3-7-19(21)22(28)24-11-10-17-16-25-20-8-4-2-6-18(17)20/h2-9,16,25H,10-15H2,1H3,(H,24,28) IMEFTODUZOAEDS-UHFFFAOYSA-N 50584032 CHEMBL5080659 Cholinesterase 5140 ChEMBL 10.1016/j.ejmech.2021.114044 10.7270/Q22F7S9X 34923430 Liu, D; Zhang, H; Wang, Y; Liu, W; Yin, G; Wang, D; Li, J; Shi, T; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50584032 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50584032&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166629485 476020119 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51445530 O=C(Oc1ccccc1C(=O)NCCc1c[nH]c2ccccc12)N1CCc2ccccc12 InChI=1S/C26H23N3O3/c30-25(27-15-13-19-17-28-22-10-4-2-8-20(19)22)21-9-3-6-12-24(21)32-26(31)29-16-14-18-7-1-5-11-23(18)29/h1-12,17,28H,13-16H2,(H,27,30) HYJUNWNPIDRMNQ-UHFFFAOYSA-N 50584033 CHEMBL5087791 Cholinesterase 29990 ChEMBL 10.1016/j.ejmech.2021.114044 10.7270/Q22F7S9X 34923430 Liu, D; Zhang, H; Wang, Y; Liu, W; Yin, G; Wang, D; Li, J; Shi, T; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50584033 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50584033&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166635996 476020120 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51445531 CON(C)C(=O)Oc1cccc(c1)C(=O)NCCc1c[nH]c2ccccc12 InChI=1S/C20H21N3O4/c1-23(26-2)20(25)27-16-7-5-6-14(12-16)19(24)21-11-10-15-13-22-18-9-4-3-8-17(15)18/h3-9,12-13,22H,10-11H2,1-2H3,(H,21,24) MTHRJZCNFZAWJL-UHFFFAOYSA-N 50584034 CHEMBL5086020 Cholinesterase 1270 ChEMBL 10.1016/j.ejmech.2021.114044 10.7270/Q22F7S9X 34923430 Liu, D; Zhang, H; Wang, Y; Liu, W; Yin, G; Wang, D; Li, J; Shi, T; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50584034 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50584034&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166632871 476020121 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51445532 CON(C)C(=O)Oc1ccc(cc1)C(=O)NCCc1c[nH]c2ccccc12 InChI=1S/C20H21N3O4/c1-23(26-2)20(25)27-16-9-7-14(8-10-16)19(24)21-12-11-15-13-22-18-6-4-3-5-17(15)18/h3-10,13,22H,11-12H2,1-2H3,(H,21,24) GPCNEUGIQMAJPI-UHFFFAOYSA-N 50584035 CHEMBL5088255 Cholinesterase 6610 ChEMBL 10.1016/j.ejmech.2021.114044 10.7270/Q22F7S9X 34923430 Liu, D; Zhang, H; Wang, Y; Liu, W; Yin, G; Wang, D; Li, J; Shi, T; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50584035 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50584035&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166633596 476020122 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436108 CC(C)=CCOc1cc(O)c2C(=O)CC(Oc2c1)c1cccc(F)c1 InChI=1S/C20H19FO4/c1-12(2)6-7-24-15-9-16(22)20-17(23)11-18(25-19(20)10-15)13-4-3-5-14(21)8-13/h3-6,8-10,18,22H,7,11H2,1-2H3 WREOHUPBIMSFBR-UHFFFAOYSA-N 50580141 CHEMBL5081143 Cholinesterase 5090 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580141 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580141&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166629782 476025146 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436109 CC(C)=CCOc1cc(O)c2C(=O)CC(Oc2c1)c1ccc(F)cc1 InChI=1S/C20H19FO4/c1-12(2)7-8-24-15-9-16(22)20-17(23)11-18(25-19(20)10-15)13-3-5-14(21)6-4-13/h3-7,9-10,18,22H,8,11H2,1-2H3 BGLITWBMRNHLTA-UHFFFAOYSA-N 50580142 CHEMBL5087317 Cholinesterase 6840 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580142 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580142&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166635620 476025147 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436110 CC(C)=CCOc1cc(O)c2C(=O)CC(Oc2c1)c1ccccc1Cl InChI=1S/C20H19ClO4/c1-12(2)7-8-24-13-9-16(22)20-17(23)11-18(25-19(20)10-13)14-5-3-4-6-15(14)21/h3-7,9-10,18,22H,8,11H2,1-2H3 MASJCWLYMVIRBN-UHFFFAOYSA-N 50580143 CHEMBL5084218 Cholinesterase 7540 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580143 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580143&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166627985 476025148 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436111 CC(C)=CCOc1cc(O)c2C(=O)CC(Oc2c1)c1cccc(Cl)c1 InChI=1S/C20H19ClO4/c1-12(2)6-7-24-15-9-16(22)20-17(23)11-18(25-19(20)10-15)13-4-3-5-14(21)8-13/h3-6,8-10,18,22H,7,11H2,1-2H3 SEJREJMGTQTIQK-UHFFFAOYSA-N 50580144 CHEMBL5088203 Cholinesterase 6820 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580144 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580144&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166632925 476025149 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436112 CC(C)=CCOc1cc(O)c2C(=O)CC(Oc2c1)c1ccc(Cl)cc1 InChI=1S/C20H19ClO4/c1-12(2)7-8-24-15-9-16(22)20-17(23)11-18(25-19(20)10-15)13-3-5-14(21)6-4-13/h3-7,9-10,18,22H,8,11H2,1-2H3 WETLIVSWXVAAME-UHFFFAOYSA-N 50580145 CHEMBL5074820 Cholinesterase 7070 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580145 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580145&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166636497 476025150 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436113 CC(C)=CCOc1cc(O)c2C(=O)CC(Oc2c1)c1ccc(Cl)cc1Cl InChI=1S/C20H18Cl2O4/c1-11(2)5-6-25-13-8-16(23)20-17(24)10-18(26-19(20)9-13)14-4-3-12(21)7-15(14)22/h3-5,7-9,18,23H,6,10H2,1-2H3 CWZJXJCLRSCYGV-UHFFFAOYSA-N 50580146 CHEMBL5078942 Cholinesterase 6940 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580146 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580146&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166629224 476025151 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436114 CC(C)=CCOc1cc(O)c2C(=O)CC(Oc2c1)c1ccccc1Br InChI=1S/C20H19BrO4/c1-12(2)7-8-24-13-9-16(22)20-17(23)11-18(25-19(20)10-13)14-5-3-4-6-15(14)21/h3-7,9-10,18,22H,8,11H2,1-2H3 ZMXAXMGHFZOVAU-UHFFFAOYSA-N 50580147 CHEMBL5091149 Cholinesterase 3870 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580147 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580147&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166634054 476025152 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436115 CC(C)=CCOc1cc(O)c2C(=O)CC(Oc2c1)c1cccc(Br)c1 InChI=1S/C20H19BrO4/c1-12(2)6-7-24-15-9-16(22)20-17(23)11-18(25-19(20)10-15)13-4-3-5-14(21)8-13/h3-6,8-10,18,22H,7,11H2,1-2H3 NQBOGMLMFJVRAV-UHFFFAOYSA-N 50580148 CHEMBL5090337 Cholinesterase 5220 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580148 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580148&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166633692 476025153 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436116 CC(C)=CCOc1cc(O)c2C(=O)CC(Oc2c1)c1ccc(Br)cc1 InChI=1S/C20H19BrO4/c1-12(2)7-8-24-15-9-16(22)20-17(23)11-18(25-19(20)10-15)13-3-5-14(21)6-4-13/h3-7,9-10,18,22H,8,11H2,1-2H3 SVKRJGCOAZMTFG-UHFFFAOYSA-N 50580149 CHEMBL5082961 Cholinesterase 6040 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580149 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580149&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166629606 476025154 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436117 CC(C)=CCOc1cc(O)c2C(=O)CC(Oc2c1)c1ccc(C)cc1 InChI=1S/C21H22O4/c1-13(2)8-9-24-16-10-17(22)21-18(23)12-19(25-20(21)11-16)15-6-4-14(3)5-7-15/h4-8,10-11,19,22H,9,12H2,1-3H3 WFLMIFYGFWTMSX-UHFFFAOYSA-N 50580150 CHEMBL5079083 Cholinesterase 6540 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580150 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580150&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166629699 476025155 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436118 COc1ccc(cc1)C1CC(=O)c2c(O)cc(OCC=C(C)C)cc2O1 InChI=1S/C21H22O5/c1-13(2)8-9-25-16-10-17(22)21-18(23)12-19(26-20(21)11-16)14-4-6-15(24-3)7-5-14/h4-8,10-11,19,22H,9,12H2,1-3H3 OEOPBOGVRHQHSH-UHFFFAOYSA-N 50580151 CHEMBL5081935 Cholinesterase 5770 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580151 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580151&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166629539 476025156 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436119 CC(C)=CCOc1cc(O)c2C(=O)CC(Oc2c1)c1ccc(C)cc1C InChI=1S/C22H24O4/c1-13(2)7-8-25-16-10-18(23)22-19(24)12-20(26-21(22)11-16)17-6-5-14(3)9-15(17)4/h5-7,9-11,20,23H,8,12H2,1-4H3 UOVKTLZRFAVJNT-UHFFFAOYSA-N 50580152 CHEMBL5077537 Cholinesterase 3920 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580152 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580152&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166625898 476025157 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436120 COc1ccc(C2CC(=O)c3c(O)cc(OCC=C(C)C)cc3O2)c(OC)c1 InChI=1S/C22H24O6/c1-13(2)7-8-27-15-9-17(23)22-18(24)12-20(28-21(22)11-15)16-6-5-14(25-3)10-19(16)26-4/h5-7,9-11,20,23H,8,12H2,1-4H3 JIRZEQRNUROEHX-UHFFFAOYSA-N 50580153 CHEMBL5092811 Cholinesterase 5460 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580153 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580153&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166634444 476025158 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436121 CC(C)=CCOc1cc(O)c2C(=O)CC(Oc2c1)c1ccc(O)cc1 InChI=1S/C20H20O5/c1-12(2)7-8-24-15-9-16(22)20-17(23)11-18(25-19(20)10-15)13-3-5-14(21)6-4-13/h3-7,9-10,18,21-22H,8,11H2,1-2H3 HXGGEGJYNMWHAD-UHFFFAOYSA-N 50580154 CHEMBL5080631 Cholinesterase 5380 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50580154 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50580154&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 12110170 476025159 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51436122 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 10600 ChEMBL 10.1016/j.bmcl.2021.128306 10.7270/Q26D5XVW 34371131 Guan, L; Peng, D; Zhang, L; Jia, J; Jiang, H Zhejiang Ocean University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441878 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1ccc(Br)c2ccccc12 InChI=1S/C21H15BrN6O2/c22-14-9-10-15(13-6-2-1-5-12(13)14)24-18(29)11-28-17-8-4-3-7-16(17)25-21(28)19-20(23)27-30-26-19/h1-10H,11H2,(H2,23,27)(H,24,29) YRSTYYUBSVOIMN-UHFFFAOYSA-N 50582485 CHEMBL5086584 Cholinesterase 6.0 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582485 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582485&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 153560295 476027490 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441879 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1ccccc1 InChI=1S/C17H14N6O2/c18-16-15(21-25-22-16)17-20-12-8-4-5-9-13(12)23(17)10-14(24)19-11-6-2-1-3-7-11/h1-9H,10H2,(H2,18,22)(H,19,24) WFIOMLJAUUEHIM-UHFFFAOYSA-N 50582486 CHEMBL1602435 Cholinesterase 2960 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582486 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582486&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1082916 476027491 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441880 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1ccccc1F InChI=1S/C17H13FN6O2/c18-10-5-1-2-6-11(10)20-14(25)9-24-13-8-4-3-7-12(13)21-17(24)15-16(19)23-26-22-15/h1-8H,9H2,(H2,19,23)(H,20,25) CMDJAJYFXCBMBU-UHFFFAOYSA-N 50582487 CHEMBL5076648 Cholinesterase 124 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582487 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582487&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1130351 476027492 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441881 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1cccc(F)c1 InChI=1S/C17H13FN6O2/c18-10-4-3-5-11(8-10)20-14(25)9-24-13-7-2-1-6-12(13)21-17(24)15-16(19)23-26-22-15/h1-8H,9H2,(H2,19,23)(H,20,25) IBQVTCXZQBZBDN-UHFFFAOYSA-N 50582488 CHEMBL5084769 Cholinesterase 1043 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582488 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582488&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1146955 476027493 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441882 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1cccc(F)c1F InChI=1S/C17H12F2N6O2/c18-9-4-3-6-11(14(9)19)21-13(26)8-25-12-7-2-1-5-10(12)22-17(25)15-16(20)24-27-23-15/h1-7H,8H2,(H2,20,24)(H,21,26) UTXJRNYFFLUPMC-UHFFFAOYSA-N 50582489 CHEMBL5085129 Cholinesterase 270 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582489 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582489&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 153560293 476027494 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441883 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1ccccc1Cl InChI=1S/C17H13ClN6O2/c18-10-5-1-2-6-11(10)20-14(25)9-24-13-8-4-3-7-12(13)21-17(24)15-16(19)23-26-22-15/h1-8H,9H2,(H2,19,23)(H,20,25) WFXICEVOMNRSBI-UHFFFAOYSA-N 50081637 CHEMBL3422177 Cholinesterase 2732 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50081637 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50081637&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1006981 313074378 CHEMBL3422177 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441884 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1cccc(Cl)c1 InChI=1S/C17H13ClN6O2/c18-10-4-3-5-11(8-10)20-14(25)9-24-13-7-2-1-6-12(13)21-17(24)15-16(19)23-26-22-15/h1-8H,9H2,(H2,19,23)(H,20,25) DXPZZYLMEJOKPW-UHFFFAOYSA-N 50582490 CHEMBL5091918 Cholinesterase 33 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582490 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582490&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 153560294 476027495 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441885 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1cccc(Br)c1 InChI=1S/C17H13BrN6O2/c18-10-4-3-5-11(8-10)20-14(25)9-24-13-7-2-1-6-12(13)21-17(24)15-16(19)23-26-22-15/h1-8H,9H2,(H2,19,23)(H,20,25) FWDMEDDTTOUNCW-UHFFFAOYSA-N 50582491 CHEMBL5086764 Cholinesterase 83 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582491 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582491&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1330012 476027496 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441886 Cc1cccc(NC(=O)Cn2c(nc3ccccc23)-c2nonc2N)c1 InChI=1S/C18H16N6O2/c1-11-5-4-6-12(9-11)20-15(25)10-24-14-8-3-2-7-13(14)21-18(24)16-17(19)23-26-22-16/h2-9H,10H2,1H3,(H2,19,23)(H,20,25) DUZAPGJNANFHTF-UHFFFAOYSA-N 50582492 CHEMBL5092585 Cholinesterase 236 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582492 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582492&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 141740363 476027497 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441887 Cc1ccc(NC(=O)Cn2c(nc3ccccc23)-c2nonc2N)cc1 InChI=1S/C18H16N6O2/c1-11-6-8-12(9-7-11)20-15(25)10-24-14-5-3-2-4-13(14)21-18(24)16-17(19)23-26-22-16/h2-9H,10H2,1H3,(H2,19,23)(H,20,25) JHBWIGBOHHTWQK-UHFFFAOYSA-N 50582493 CHEMBL5094260 Cholinesterase 10290 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582493 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582493&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 141740377 476027498 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441888 Cc1cccc(NC(=O)Cn2c(nc3ccccc23)-c2nonc2N)c1C InChI=1S/C19H18N6O2/c1-11-6-5-8-13(12(11)2)21-16(26)10-25-15-9-4-3-7-14(15)22-19(25)17-18(20)24-27-23-17/h3-9H,10H2,1-2H3,(H2,20,24)(H,21,26) PJCAYLFFJXFHGQ-UHFFFAOYSA-N 50582494 CHEMBL5073660 Cholinesterase 326 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582494 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582494&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 141740362 476027499 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441889 COc1cccc(NC(=O)Cn2c(nc3ccccc23)-c2nonc2N)c1 InChI=1S/C18H16N6O3/c1-26-12-6-4-5-11(9-12)20-15(25)10-24-14-8-3-2-7-13(14)21-18(24)16-17(19)23-27-22-16/h2-9H,10H2,1H3,(H2,19,23)(H,20,25) KTOFHGMVWAJYMB-UHFFFAOYSA-N 50582495 CHEMBL1557165 Cholinesterase 1711 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582495 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582495&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1077056 476027500 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441890 COc1cc(NC(=O)Cn2c(nc3ccccc23)-c2nonc2N)cc(OC)c1OC InChI=1S/C20H20N6O5/c1-28-14-8-11(9-15(29-2)18(14)30-3)22-16(27)10-26-13-7-5-4-6-12(13)23-20(26)17-19(21)25-31-24-17/h4-9H,10H2,1-3H3,(H2,21,25)(H,22,27) ILVNNMOVPPCHLU-UHFFFAOYSA-N 50582496 CHEMBL3422165 Cholinesterase 6643 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582496 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582496&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1259819 476027501 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441891 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1cccc(c1)[N+]([O-])=O InChI=1S/C17H13N7O4/c18-16-15(21-28-22-16)17-20-12-6-1-2-7-13(12)23(17)9-14(25)19-10-4-3-5-11(8-10)24(26)27/h1-8H,9H2,(H2,18,22)(H,19,25) NGOMNLMIXONWQJ-UHFFFAOYSA-N 50582497 CHEMBL5091958 Cholinesterase 31 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582497 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582497&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 153560292 476027502 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441892 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1ccc(cc1)[N+]([O-])=O InChI=1S/C17H13N7O4/c18-16-15(21-28-22-16)17-20-12-3-1-2-4-13(12)23(17)9-14(25)19-10-5-7-11(8-6-10)24(26)27/h1-8H,9H2,(H2,18,22)(H,19,25) WAUUCBKSBSQKCF-UHFFFAOYSA-N 50582498 CHEMBL5071095 Cholinesterase 30 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582498 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582498&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 141740371 476027503 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441893 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1cccc(c1)C#N InChI=1S/C18H13N7O2/c19-9-11-4-3-5-12(8-11)21-15(26)10-25-14-7-2-1-6-13(14)22-18(25)16-17(20)24-27-23-16/h1-8H,10H2,(H2,20,24)(H,21,26) VIRXJIPZZFSDOC-UHFFFAOYSA-N 50582499 CHEMBL5077099 Cholinesterase 51 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582499 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582499&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 153560290 476027504 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441894 CC(=O)c1cccc(NC(=O)Cn2c(nc3ccccc23)-c2nonc2N)c1 InChI=1S/C19H16N6O3/c1-11(26)12-5-4-6-13(9-12)21-16(27)10-25-15-8-3-2-7-14(15)22-19(25)17-18(20)24-28-23-17/h2-9H,10H2,1H3,(H2,20,24)(H,21,27) GAJUQJLKLWPSNR-UHFFFAOYSA-N 50582500 CHEMBL5076563 Cholinesterase 191 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582500 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582500&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1016406 476027505 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441895 CC(=O)c1ccc(NC(=O)Cn2c(nc3ccccc23)-c2nonc2N)cc1 InChI=1S/C19H16N6O3/c1-11(26)12-6-8-13(9-7-12)21-16(27)10-25-15-5-3-2-4-14(15)22-19(25)17-18(20)24-28-23-17/h2-9H,10H2,1H3,(H2,20,24)(H,21,27) KYZLBFNIQZNZKF-UHFFFAOYSA-N 50582501 CHEMBL5073103 Cholinesterase 2267 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582501 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582501&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1016403 476027506 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441896 COC(=O)c1cccc(NC(=O)Cn2c(nc3ccccc23)-c2nonc2N)c1 InChI=1S/C19H16N6O4/c1-28-19(27)11-5-4-6-12(9-11)21-15(26)10-25-14-8-3-2-7-13(14)22-18(25)16-17(20)24-29-23-16/h2-9H,10H2,1H3,(H2,20,24)(H,21,26) XNOITEBPBCINOM-UHFFFAOYSA-N 50582502 CHEMBL5075797 Cholinesterase 27 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582502 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582502&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 153560289 476027507 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441897 COC(=O)c1ccc(NC(=O)Cn2c(nc3ccccc23)-c2nonc2N)cc1 InChI=1S/C19H16N6O4/c1-28-19(27)11-6-8-12(9-7-11)21-15(26)10-25-14-5-3-2-4-13(14)22-18(25)16-17(20)24-29-23-16/h2-9H,10H2,1H3,(H2,20,24)(H,21,26) POKBUIFCHQMMQY-UHFFFAOYSA-N 50582503 CHEMBL1333087 Cholinesterase 5376 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582503 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582503&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1017540 476027508 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441898 CC(=O)Nc1cccc(NC(=O)Cn2c(nc3ccccc23)-c2nonc2N)c1 InChI=1S/C19H17N7O3/c1-11(27)21-12-5-4-6-13(9-12)22-16(28)10-26-15-8-3-2-7-14(15)23-19(26)17-18(20)25-29-24-17/h2-9H,10H2,1H3,(H2,20,25)(H,21,27)(H,22,28) XHBKZVWDISGMJO-UHFFFAOYSA-N 50582504 CHEMBL5078904 Cholinesterase 1125 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582504 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582504&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 153560291 476027509 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441899 CC(=O)Nc1ccc(NC(=O)Cn2c(nc3ccccc23)-c2nonc2N)cc1 InChI=1S/C19H17N7O3/c1-11(27)21-12-6-8-13(9-7-12)22-16(28)10-26-15-5-3-2-4-14(15)23-19(26)17-18(20)25-29-24-17/h2-9H,10H2,1H3,(H2,20,25)(H,21,27)(H,22,28) UXANZPZEDKFQMN-UHFFFAOYSA-N 50582505 CHEMBL5079223 Cholinesterase 6538 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582505 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582505&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 141740379 476027510 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441900 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1ccc2OCOc2c1 InChI=1S/C18H14N6O4/c19-17-16(22-28-23-17)18-21-11-3-1-2-4-12(11)24(18)8-15(25)20-10-5-6-13-14(7-10)27-9-26-13/h1-7H,8-9H2,(H2,19,23)(H,20,25) GBKXNFRPLXFBBH-UHFFFAOYSA-N 50582506 CHEMBL5087886 Cholinesterase 2206 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582506 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582506&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 17583018 476027511 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441901 Cc1cc2nc(-c3nonc3N)n(CC(=O)Nc3ccc4ncccc4c3)c2cc1C InChI=1S/C22H19N7O2/c1-12-8-17-18(9-13(12)2)29(22(26-17)20-21(23)28-31-27-20)11-19(30)25-15-5-6-16-14(10-15)4-3-7-24-16/h3-10H,11H2,1-2H3,(H2,23,28)(H,25,30) XJEHJIGKNTYEBZ-UHFFFAOYSA-N 50582507 CHEMBL5090747 Cholinesterase 11250 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582507 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582507&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166635412 476027512 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441902 Cc1cc2nc(-c3nonc3N)n(CC(=O)Nc3cnc4ccccc4c3)c2cc1C InChI=1S/C22H19N7O2/c1-12-7-17-18(8-13(12)2)29(22(26-17)20-21(23)28-31-27-20)11-19(30)25-15-9-14-5-3-4-6-16(14)24-10-15/h3-10H,11H2,1-2H3,(H2,23,28)(H,25,30) TVLUVLUXVCBMKW-UHFFFAOYSA-N 50582508 CHEMBL5077673 Cholinesterase 28530 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582508 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582508&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166626478 476027513 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441903 Cc1cc2nc(-c3nonc3N)n(CC(=O)Nc3cccc4ccccc34)c2cc1C InChI=1S/C23H20N6O2/c1-13-10-18-19(11-14(13)2)29(23(26-18)21-22(24)28-31-27-21)12-20(30)25-17-9-5-7-15-6-3-4-8-16(15)17/h3-11H,12H2,1-2H3,(H2,24,28)(H,25,30) UQSIBXDEXJAPIZ-UHFFFAOYSA-N 50582509 CHEMBL5081114 Cholinesterase 108 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582509 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582509&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166629284 476027514 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441904 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 5.0 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441869 Cc1ccc2cc(NC(=O)Cn3c(nc4ccccc34)-c3nonc3N)ccc2n1 InChI=1S/C21H17N7O2/c1-12-6-7-13-10-14(8-9-15(13)23-12)24-18(29)11-28-17-5-3-2-4-16(17)25-21(28)19-20(22)27-30-26-19/h2-10H,11H2,1H3,(H2,22,27)(H,24,29) LESZNGMDDFKRPH-UHFFFAOYSA-N 50544536 CHEMBL4638758 Cholinesterase 177 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50544536 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50544536&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1259483 442146099 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441870 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1ccc2ncccc2c1 InChI=1S/C20H15N7O2/c21-19-18(25-29-26-19)20-24-15-5-1-2-6-16(15)27(20)11-17(28)23-13-7-8-14-12(10-13)4-3-9-22-14/h1-10H,11H2,(H2,21,26)(H,23,28) OQIIIICIPTXOQC-UHFFFAOYSA-N 50582477 CHEMBL5077448 Cholinesterase 705 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582477 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582477&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 141740360 476027482 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441871 Nc1nonc1-c1nc2ccccc2n1CCC(=O)Nc1ccc2ncccc2c1 InChI=1S/C21H17N7O2/c22-20-19(26-30-27-20)21-25-16-5-1-2-6-17(16)28(21)11-9-18(29)24-14-7-8-15-13(12-14)4-3-10-23-15/h1-8,10,12H,9,11H2,(H2,22,27)(H,24,29) WIOWHYHQVBQBBU-UHFFFAOYSA-N 50582478 CHEMBL5083667 Cholinesterase 253 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582478 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582478&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 141740375 476027483 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441872 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1cccc2ncccc12 InChI=1S/C20H15N7O2/c21-19-18(25-29-26-19)20-24-15-6-1-2-9-16(15)27(20)11-17(28)23-14-8-3-7-13-12(14)5-4-10-22-13/h1-10H,11H2,(H2,21,26)(H,23,28) MPFQMDJRJAPSSH-UHFFFAOYSA-N 50582479 CHEMBL5076905 Cholinesterase 920 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582479 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582479&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 141740376 476027484 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441873 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1ccnc2ccccc12 InChI=1S/C20H15N7O2/c21-19-18(25-29-26-19)20-24-15-7-3-4-8-16(15)27(20)11-17(28)23-14-9-10-22-13-6-2-1-5-12(13)14/h1-10H,11H2,(H2,21,26)(H,22,23,28) CTPAZDOHWRHEMS-UHFFFAOYSA-N 50582480 CHEMBL5083855 Cholinesterase 51 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582480 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582480&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 141740364 476027485 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441874 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1cnc2ccccc2c1 InChI=1S/C20H15N7O2/c21-19-18(25-29-26-19)20-24-15-7-3-4-8-16(15)27(20)11-17(28)23-13-9-12-5-1-2-6-14(12)22-10-13/h1-10H,11H2,(H2,21,26)(H,23,28) FPAMWJFOROLHQH-UHFFFAOYSA-N 50582481 CHEMBL5093535 Cholinesterase 20 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582481 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582481&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 141740365 476027486 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441875 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1ccc2ccccc2n1 InChI=1S/C20H15N7O2/c21-19-18(25-29-26-19)20-23-14-7-3-4-8-15(14)27(20)11-17(28)24-16-10-9-12-5-1-2-6-13(12)22-16/h1-10H,11H2,(H2,21,26)(H,22,24,28) HPLYGXMZPPJTII-UHFFFAOYSA-N 50582482 CHEMBL5082684 Cholinesterase 507 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582482 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582482&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 153560296 476027487 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441876 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1ccc2ccccc2c1 InChI=1S/C21H16N6O2/c22-20-19(25-29-26-20)21-24-16-7-3-4-8-17(16)27(21)12-18(28)23-15-10-9-13-5-1-2-6-14(13)11-15/h1-11H,12H2,(H2,22,26)(H,23,28) YOURXAPHGWOWFT-UHFFFAOYSA-N 50582483 CHEMBL5093490 Cholinesterase 352000 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582483 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582483&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 141740372 476027488 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441877 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1cccc2ccccc12 InChI=1S/C21H16N6O2/c22-20-19(25-29-26-20)21-24-16-9-3-4-11-17(16)27(21)12-18(28)23-15-10-5-7-13-6-1-2-8-14(13)15/h1-11H,12H2,(H2,22,26)(H,23,28) OMUDLIQJKZUZCU-UHFFFAOYSA-N 50582484 CHEMBL5083469 Cholinesterase 44 ChEMBL 10.1021/acs.jmedchem.1c00167 10.7270/Q29C729Q 33973470 Li, Q; Chen, Y; Xing, S; Liao, Q; Xiong, B; Wang, Y; Lu, W; He, S; Feng, F; Liu, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582484 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582484&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 141740374 476027489 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441250 CN(C)C(=O)Oc1cccc(c1)[N+](C)(C)C InChI=1S/C12H19N2O2/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5/h6-9H,1-5H3/q+1 ALWKGYPQUAPLQC-UHFFFAOYSA-N 50022775 (m-Hydroxyphenyl)trimethylammonium dimethylcarbamate::3-Trimethylammoniumphenyl N,N-dimethylcarbamate::3-[(dimethylcarbamoyl)oxy]-N,N,N-trimethylanilinium::CHEMBL211471::CHEMBL278020::Eustigmin::Eustigmine::NEOSTIGMINE::Neostigmine (2)::Prostigmine::Vagostigmine::m-Trimethylammoniumphenyldimethylcarbamate Cholinesterase 92700 ChEMBL 10.1021/acs.jnatprod.1c00980 10.7270/Q2125XJV 34910498 Safa, N; Trobec, T; Holland, DC; Slazak, B; Jacobsson, E; Hawkes, JA; Frangež, R; Sepčić, K; Göransson, U; Moodie, LWK; Robertson, LP Uppsala University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50022775 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50022775&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 4456 103933337 7514 CHEMBL278020CHEMBL211471 DB01400 C08200 ZINC00001792 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441251 COC1=C[C@]23CCN(C)[C@H](Cc4ccc(OC)c(O)c24)C3=CC1=O InChI=1S/C19H21NO4/c1-20-7-6-19-10-16(24-3)14(21)9-12(19)13(20)8-11-4-5-15(23-2)18(22)17(11)19/h4-5,9-10,13,22H,6-8H2,1-3H3/t13-,19+/m1/s1 GVTRUVGBZQJVTF-YJYMSZOUSA-N 50378615 SALUTARIDINE Cholinesterase 335000 ChEMBL 10.1021/acs.jnatprod.1c00980 10.7270/Q2125XJV 34910498 Safa, N; Trobec, T; Holland, DC; Slazak, B; Jacobsson, E; Hawkes, JA; Frangež, R; Sepčić, K; Göransson, U; Moodie, LWK; Robertson, LP Uppsala University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50378615 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50378615&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5408233 160857698 17225 C05179 ZINC28539108 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441252 COc1cc2CC[N+](C)(C)[C@H]3Cc4cccc(OC)c4-c(c1O)c23 InChI=1S/C20H23NO3/c1-21(2)9-8-13-11-16(24-4)20(22)19-17(13)14(21)10-12-6-5-7-15(23-3)18(12)19/h5-7,11,14H,8-10H2,1-4H3/p+1/t14-/m0/s1 LIWPWIJZEAZVBL-AWEZNQCLSA-O 50582211 CHEMBL4922390 Cholinesterase 2200 ChEMBL 10.1021/acs.jnatprod.1c00980 10.7270/Q2125XJV 34910498 Safa, N; Trobec, T; Holland, DC; Slazak, B; Jacobsson, E; Hawkes, JA; Frangež, R; Sepčić, K; Göransson, U; Moodie, LWK; Robertson, LP Uppsala University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582211 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582211&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 739274 476027216 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441253 COc1cc2CC[N+](C)(C)[C@H]3Cc4cccc(OC)c4-c(c1O)c23 InChI=1S/C20H23NO3/c1-21(2)9-8-13-11-16(24-4)20(22)19-17(13)14(21)10-12-6-5-7-15(23-3)18(12)19/h5-7,11,14H,8-10H2,1-4H3/p+1/t14-/m0/s1 LIWPWIJZEAZVBL-AWEZNQCLSA-O 50582211 CHEMBL4922390 Cholinesterase 7100 ChEMBL 10.1021/acs.jnatprod.1c00980 10.7270/Q2125XJV 34910498 Safa, N; Trobec, T; Holland, DC; Slazak, B; Jacobsson, E; Hawkes, JA; Frangež, R; Sepčić, K; Göransson, U; Moodie, LWK; Robertson, LP Uppsala University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582211 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582211&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 739274 476027216 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441254 COc1cc2CCN(C)[C@H]3Cc4cccc(OC)c4-c(c1O)c23 InChI=1S/C19H21NO3/c1-20-8-7-12-10-15(23-3)19(21)18-16(12)13(20)9-11-5-4-6-14(22-2)17(11)18/h4-6,10,13,21H,7-9H2,1-3H3/t13-/m0/s1 RQCOQZNIQLKGTN-ZDUSSCGKSA-N 50582206 CHEMBL5091026 Cholinesterase 600 ChEMBL 10.1021/acs.jnatprod.1c00980 10.7270/Q2125XJV 34910498 Safa, N; Trobec, T; Holland, DC; Slazak, B; Jacobsson, E; Hawkes, JA; Frangež, R; Sepčić, K; Göransson, U; Moodie, LWK; Robertson, LP Uppsala University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582206 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582206&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11281 476027211 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441255 COc1cc2CCN(C)[C@H]3Cc4cccc(OC)c4-c(c1O)c23 InChI=1S/C19H21NO3/c1-20-8-7-12-10-15(23-3)19(21)18-16(12)13(20)9-11-5-4-6-14(22-2)17(11)18/h4-6,10,13,21H,7-9H2,1-3H3/t13-/m0/s1 RQCOQZNIQLKGTN-ZDUSSCGKSA-N 50582206 CHEMBL5091026 Cholinesterase 2800 ChEMBL 10.1021/acs.jnatprod.1c00980 10.7270/Q2125XJV 34910498 Safa, N; Trobec, T; Holland, DC; Slazak, B; Jacobsson, E; Hawkes, JA; Frangež, R; Sepčić, K; Göransson, U; Moodie, LWK; Robertson, LP Uppsala University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582206 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582206&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11281 476027211 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441256 COc1cc2CN3CCc4cc5OCOc5c(OC)c4[C@@H]3Cc2c2COCOc12 InChI=1S/C22H23NO6/c1-24-17-6-13-8-23-4-3-12-5-18-21(29-11-27-18)22(25-2)19(12)16(23)7-14(13)15-9-26-10-28-20(15)17/h5-6,16H,3-4,7-11H2,1-2H3/t16-/m0/s1 QJZHAQOTBKWPGS-INIZCTEOSA-N 50582207 CHEMBL5085317 Cholinesterase 35500 ChEMBL 10.1021/acs.jnatprod.1c00980 10.7270/Q2125XJV 34910498 Safa, N; Trobec, T; Holland, DC; Slazak, B; Jacobsson, E; Hawkes, JA; Frangež, R; Sepčić, K; Göransson, U; Moodie, LWK; Robertson, LP Uppsala University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582207 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582207&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 185550 476027212 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441257 COc1cc2CN3CCc4cc5OCOc5c(OC)c4[C@@H]3Cc2c2COCOc12 InChI=1S/C22H23NO6/c1-24-17-6-13-8-23-4-3-12-5-18-21(29-11-27-18)22(25-2)19(12)16(23)7-14(13)15-9-26-10-28-20(15)17/h5-6,16H,3-4,7-11H2,1-2H3/t16-/m0/s1 QJZHAQOTBKWPGS-INIZCTEOSA-N 50582207 CHEMBL5085317 Cholinesterase 104000 ChEMBL 10.1021/acs.jnatprod.1c00980 10.7270/Q2125XJV 34910498 Safa, N; Trobec, T; Holland, DC; Slazak, B; Jacobsson, E; Hawkes, JA; Frangež, R; Sepčić, K; Göransson, U; Moodie, LWK; Robertson, LP Uppsala University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582207 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582207&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 185550 476027212 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441258 [O-]C(=O)C(F)(F)F.COc1cc2C=[N+]3CCc4cc5OCOc5c(OC)c4[C@@H]3Cc2c(CO)c1OC InChI=1S/C22H24NO6.C2HF3O2/c1-25-17-7-13-9-23-5-4-12-6-18-21(29-11-28-18)22(27-3)19(12)16(23)8-14(13)15(10-24)20(17)26-2;3-2(4,5)1(6)7/h6-7,9,16,24H,4-5,8,10-11H2,1-3H3;(H,6,7)/q+1;/p-1/t16-;/m0./s1 LAUUZZSJCGXKPG-NTISSMGPSA-M 50582210 CHEMBL5089821 Cholinesterase 100000 ChEMBL 10.1021/acs.jnatprod.1c00980 10.7270/Q2125XJV 34910498 Safa, N; Trobec, T; Holland, DC; Slazak, B; Jacobsson, E; Hawkes, JA; Frangež, R; Sepčić, K; Göransson, U; Moodie, LWK; Robertson, LP Uppsala University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582210 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582210&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166632701 476027215 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441259 [O-]C(=O)C(F)(F)F.COc1cc2C=[N+]3CCc4cc5OCOc5c(OC)c4[C@@H]3Cc2c(CO)c1OC InChI=1S/C22H24NO6.C2HF3O2/c1-25-17-7-13-9-23-5-4-12-6-18-21(29-11-28-18)22(27-3)19(12)16(23)8-14(13)15(10-24)20(17)26-2;3-2(4,5)1(6)7/h6-7,9,16,24H,4-5,8,10-11H2,1-3H3;(H,6,7)/q+1;/p-1/t16-;/m0./s1 LAUUZZSJCGXKPG-NTISSMGPSA-M 50582210 CHEMBL5089821 Cholinesterase 58500 ChEMBL 10.1021/acs.jnatprod.1c00980 10.7270/Q2125XJV 34910498 Safa, N; Trobec, T; Holland, DC; Slazak, B; Jacobsson, E; Hawkes, JA; Frangež, R; Sepčić, K; Göransson, U; Moodie, LWK; Robertson, LP Uppsala University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582210 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582210&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166632701 476027215 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441260 [O-]C(=O)C(F)(F)F.COc1cc2C=[N+]3CCc4cc5OCOc5c(OC)c4[C@@H]3Cc2c2COCOc12 InChI=1S/C22H22NO6.C2HF3O2/c1-24-17-6-13-8-23-4-3-12-5-18-21(29-11-27-18)22(25-2)19(12)16(23)7-14(13)15-9-26-10-28-20(15)17;3-2(4,5)1(6)7/h5-6,8,16H,3-4,7,9-11H2,1-2H3;(H,6,7)/q+1;/p-1/t16-;/m0./s1 WOKLQUJIDOKIQH-NTISSMGPSA-M 50582209 CHEMBL5076804 Cholinesterase 98500 ChEMBL 10.1021/acs.jnatprod.1c00980 10.7270/Q2125XJV 34910498 Safa, N; Trobec, T; Holland, DC; Slazak, B; Jacobsson, E; Hawkes, JA; Frangež, R; Sepčić, K; Göransson, U; Moodie, LWK; Robertson, LP Uppsala University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582209 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582209&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166627033 476027214 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441261 [O-]C(=O)C(F)(F)F.COc1cc2C=[N+]3CCc4cc5OCOc5c(OC)c4[C@@H]3Cc2c2COCOc12 InChI=1S/C22H22NO6.C2HF3O2/c1-24-17-6-13-8-23-4-3-12-5-18-21(29-11-27-18)22(25-2)19(12)16(23)7-14(13)15-9-26-10-28-20(15)17;3-2(4,5)1(6)7/h5-6,8,16H,3-4,7,9-11H2,1-2H3;(H,6,7)/q+1;/p-1/t16-;/m0./s1 WOKLQUJIDOKIQH-NTISSMGPSA-M 50582209 CHEMBL5076804 Cholinesterase 47000 ChEMBL 10.1021/acs.jnatprod.1c00980 10.7270/Q2125XJV 34910498 Safa, N; Trobec, T; Holland, DC; Slazak, B; Jacobsson, E; Hawkes, JA; Frangež, R; Sepčić, K; Göransson, U; Moodie, LWK; Robertson, LP Uppsala University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582209 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582209&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166627033 476027214 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441262 COc1cc2c[n+]3CCc4cc5OCOc5c(OC)c4-c3cc2c(CO)c1OC InChI=1S/C22H22NO6/c1-25-17-7-13-9-23-5-4-12-6-18-21(29-11-28-18)22(27-3)19(12)16(23)8-14(13)15(10-24)20(17)26-2/h6-9,24H,4-5,10-11H2,1-3H3/q+1 YBDPGYNCDXZFOS-UHFFFAOYSA-N 50582208 CHEMBL5080190 Cholinesterase 63100 ChEMBL 10.1021/acs.jnatprod.1c00980 10.7270/Q2125XJV 34910498 Safa, N; Trobec, T; Holland, DC; Slazak, B; Jacobsson, E; Hawkes, JA; Frangež, R; Sepčić, K; Göransson, U; Moodie, LWK; Robertson, LP Uppsala University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582208 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582208&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 101285910 476027213 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441263 COc1cc2c[n+]3CCc4cc5OCOc5c(OC)c4-c3cc2c(CO)c1OC InChI=1S/C22H22NO6/c1-25-17-7-13-9-23-5-4-12-6-18-21(29-11-28-18)22(27-3)19(12)16(23)8-14(13)15(10-24)20(17)26-2/h6-9,24H,4-5,10-11H2,1-3H3/q+1 YBDPGYNCDXZFOS-UHFFFAOYSA-N 50582208 CHEMBL5080190 Cholinesterase 43700 ChEMBL 10.1021/acs.jnatprod.1c00980 10.7270/Q2125XJV 34910498 Safa, N; Trobec, T; Holland, DC; Slazak, B; Jacobsson, E; Hawkes, JA; Frangež, R; Sepčić, K; Göransson, U; Moodie, LWK; Robertson, LP Uppsala University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582208 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582208&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 101285910 476027213 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441264 COc1ccc(C[C@H]2c3cc(O)c(OC)cc3CC[N+]2(C)C)cc1OC InChI=1S/C21H27NO4/c1-22(2)9-8-15-12-20(25-4)18(23)13-16(15)17(22)10-14-6-7-19(24-3)21(11-14)26-5/h6-7,11-13,17H,8-10H2,1-5H3/p+1/t17-/m0/s1 PPVUSMLJRNSLLF-KRWDZBQOSA-O 50582212 CHEMBL5087459 Cholinesterase 221000 ChEMBL 10.1021/acs.jnatprod.1c00980 10.7270/Q2125XJV 34910498 Safa, N; Trobec, T; Holland, DC; Slazak, B; Jacobsson, E; Hawkes, JA; Frangež, R; Sepčić, K; Göransson, U; Moodie, LWK; Robertson, LP Uppsala University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582212 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582212&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166634273 476027217 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51441265 COc1cc(C[C@H]2c3cc(O)c(OC)cc3CC[N+]2(C)C)ccc1O InChI=1S/C20H25NO4/c1-21(2)8-7-14-11-20(25-4)18(23)12-15(14)16(21)9-13-5-6-17(22)19(10-13)24-3/h5-6,10-12,16H,7-9H2,1-4H3,(H-,22,23)/p+1/t16-/m0/s1 QUNPSXVJJSLAKJ-INIZCTEOSA-O 50582213 CHEMBL5077034 Cholinesterase 342000 ChEMBL 10.1021/acs.jnatprod.1c00980 10.7270/Q2125XJV 34910498 Safa, N; Trobec, T; Holland, DC; Slazak, B; Jacobsson, E; Hawkes, JA; Frangež, R; Sepčić, K; Göransson, U; Moodie, LWK; Robertson, LP Uppsala University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582213 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582213&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166626175 476027218 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51451291 Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4cccc(F)c4)C3)ccc12 InChI=1S/C24H26FNO3/c1-16-17(2)24(27)29-23-12-21(8-9-22(16)23)28-15-19-6-4-10-26(14-19)13-18-5-3-7-20(25)11-18/h3,5,7-9,11-12,19H,4,6,10,13-15H2,1-2H3 RWXZXJNJQZFMAE-UHFFFAOYSA-N 50585923 CHEMBL5083014 Cholinesterase 2000 ChEMBL 10.1021/acs.jmedchem.1c01784 10.7270/Q2BG2SWG 35195417 Rullo, M; Cipolloni, M; Catto, M; Colliva, C; Miniero, DV; Latronico, T; de Candia, M; Benicchi, T; Linusson, A; Giacchè, N; Altomare, CD; Pisani, L University of Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50585923 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50585923&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166629824 476022010 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51451292 Cc1c(C)c(=O)oc2cc(OCC3CCN(Cc4cccc(F)c4)CC3)ccc12 InChI=1S/C24H26FNO3/c1-16-17(2)24(27)29-23-13-21(6-7-22(16)23)28-15-18-8-10-26(11-9-18)14-19-4-3-5-20(25)12-19/h3-7,12-13,18H,8-11,14-15H2,1-2H3 RYVDJROSDCHIPC-UHFFFAOYSA-N 50585925 CHEMBL5090504 Cholinesterase 2900 ChEMBL 10.1021/acs.jmedchem.1c01784 10.7270/Q2BG2SWG 35195417 Rullo, M; Cipolloni, M; Catto, M; Colliva, C; Miniero, DV; Latronico, T; de Candia, M; Benicchi, T; Linusson, A; Giacchè, N; Altomare, CD; Pisani, L University of Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50585925 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50585925&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166631454 476022012 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51451293 CCN(CCCOc1ccc2c(C)c(C)c(=O)oc2c1)Cc1cccc(F)c1 InChI=1S/C23H26FNO3/c1-4-25(15-18-7-5-8-19(24)13-18)11-6-12-27-20-9-10-21-16(2)17(3)23(26)28-22(21)14-20/h5,7-10,13-14H,4,6,11-12,15H2,1-3H3 LMSJPMKZTVCUMM-UHFFFAOYSA-N 50585927 CHEMBL5081663 Cholinesterase 4300 ChEMBL 10.1021/acs.jmedchem.1c01784 10.7270/Q2BG2SWG 35195417 Rullo, M; Cipolloni, M; Catto, M; Colliva, C; Miniero, DV; Latronico, T; de Candia, M; Benicchi, T; Linusson, A; Giacchè, N; Altomare, CD; Pisani, L University of Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50585927 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50585927&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166630468 476022014 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51451294 CN(CCCC(F)F)Cc1cccc(COc2ccc3c(C)c(C)c(=O)oc3c2)c1 InChI=1S/C24H27F2NO3/c1-16-17(2)24(28)30-22-13-20(9-10-21(16)22)29-15-19-7-4-6-18(12-19)14-27(3)11-5-8-23(25)26/h4,6-7,9-10,12-13,23H,5,8,11,14-15H2,1-3H3 JFBYGVYECDFTLS-UHFFFAOYSA-N 50585929 CHEMBL5083737 Cholinesterase 1600 ChEMBL 10.1021/acs.jmedchem.1c01784 10.7270/Q2BG2SWG 35195417 Rullo, M; Cipolloni, M; Catto, M; Colliva, C; Miniero, DV; Latronico, T; de Candia, M; Benicchi, T; Linusson, A; Giacchè, N; Altomare, CD; Pisani, L University of Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50585929 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50585929&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166630295 476022016 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51451295 CN(CCCC(F)F)Cc1ccc(COc2ccc3c(C)c(C)c(=O)oc3c2)cc1 InChI=1S/C24H27F2NO3/c1-16-17(2)24(28)30-22-13-20(10-11-21(16)22)29-15-19-8-6-18(7-9-19)14-27(3)12-4-5-23(25)26/h6-11,13,23H,4-5,12,14-15H2,1-3H3 UXFJYPQDRBVIIL-UHFFFAOYSA-N 50585933 CHEMBL5078658 Cholinesterase 4100 ChEMBL 10.1021/acs.jmedchem.1c01784 10.7270/Q2BG2SWG 35195417 Rullo, M; Cipolloni, M; Catto, M; Colliva, C; Miniero, DV; Latronico, T; de Candia, M; Benicchi, T; Linusson, A; Giacchè, N; Altomare, CD; Pisani, L University of Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50585933 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50585933&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166629209 476022020 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51451296 CN(Cc1ccc(COc2ccc3c(CO)cc(=O)oc3c2)cc1)Cc1cccc(F)c1 InChI=1S/C26H24FNO4/c1-28(15-20-3-2-4-22(27)11-20)14-18-5-7-19(8-6-18)17-31-23-9-10-24-21(16-29)12-26(30)32-25(24)13-23/h2-13,29H,14-17H2,1H3 QLJQCJJMXAPXRX-UHFFFAOYSA-N 50585935 CHEMBL5090153 Cholinesterase 1100 ChEMBL 10.1021/acs.jmedchem.1c01784 10.7270/Q2BG2SWG 35195417 Rullo, M; Cipolloni, M; Catto, M; Colliva, C; Miniero, DV; Latronico, T; de Candia, M; Benicchi, T; Linusson, A; Giacchè, N; Altomare, CD; Pisani, L University of Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50585935 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50585935&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166635396 476022022 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51451297 CN(Cc1ccccc1)Cc1ccc(COc2ccc3c(CO)cc(=O)oc3c2)cc1 InChI=1S/C26H25NO4/c1-27(15-19-5-3-2-4-6-19)16-20-7-9-21(10-8-20)18-30-23-11-12-24-22(17-28)13-26(29)31-25(24)14-23/h2-14,28H,15-18H2,1H3 RTJRBYKZQSYWCM-UHFFFAOYSA-N 50585930 CHEMBL3586771 Cholinesterase 1100 ChEMBL 10.1021/acs.jmedchem.1c01784 10.7270/Q2BG2SWG 35195417 Rullo, M; Cipolloni, M; Catto, M; Colliva, C; Miniero, DV; Latronico, T; de Candia, M; Benicchi, T; Linusson, A; Giacchè, N; Altomare, CD; Pisani, L University of Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50585930 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50585930&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5IK 7QAK,7P4F 122180463 476022017 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51451298 CN(Cc1ccccc1)Cc1ccc(COc2ccc3c(cc(=O)oc3c2)C(F)F)cc1 InChI=1S/C26H23F2NO3/c1-29(15-18-5-3-2-4-6-18)16-19-7-9-20(10-8-19)17-31-21-11-12-22-23(26(27)28)14-25(30)32-24(22)13-21/h2-14,26H,15-17H2,1H3 KUBYHRTYKKZBKV-UHFFFAOYSA-N 50585936 CHEMBL5083613 Cholinesterase 430 ChEMBL 10.1021/acs.jmedchem.1c01784 10.7270/Q2BG2SWG 35195417 Rullo, M; Cipolloni, M; Catto, M; Colliva, C; Miniero, DV; Latronico, T; de Candia, M; Benicchi, T; Linusson, A; Giacchè, N; Altomare, CD; Pisani, L University of Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50585936 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50585936&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166629874 476022023 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51451299 Cc1c(C)c(=O)oc2cc(OCC3CCCN(Cc4ccccc4)C3)ccc12 InChI=1S/C24H27NO3/c1-17-18(2)24(26)28-23-13-21(10-11-22(17)23)27-16-20-9-6-12-25(15-20)14-19-7-4-3-5-8-19/h3-5,7-8,10-11,13,20H,6,9,12,14-16H2,1-2H3 HKIDXMKKZYHFEM-UHFFFAOYSA-N 50532731 CHEMBL4571763 Cholinesterase 3400 ChEMBL 10.1021/acs.jmedchem.1c01784 10.7270/Q2BG2SWG 35195417 Rullo, M; Cipolloni, M; Catto, M; Colliva, C; Miniero, DV; Latronico, T; de Candia, M; Benicchi, T; Linusson, A; Giacchè, N; Altomare, CD; Pisani, L University of Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50532731 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50532731&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155525760 440741313 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51451300 Cc1c(C)c(=O)oc2cc(OCC3CCN(Cc4ccccc4)CC3)ccc12 InChI=1S/C24H27NO3/c1-17-18(2)24(26)28-23-14-21(8-9-22(17)23)27-16-20-10-12-25(13-11-20)15-19-6-4-3-5-7-19/h3-9,14,20H,10-13,15-16H2,1-2H3 MWFBGTXYOJLQIW-UHFFFAOYSA-N 50585931 CHEMBL4598256 Cholinesterase 4700 ChEMBL 10.1021/acs.jmedchem.1c01784 10.7270/Q2BG2SWG 35195417 Rullo, M; Cipolloni, M; Catto, M; Colliva, C; Miniero, DV; Latronico, T; de Candia, M; Benicchi, T; Linusson, A; Giacchè, N; Altomare, CD; Pisani, L University of Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50585931 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50585931&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search AJ9 7QB4 155535905 476022018 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51451301 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 2100 ChEMBL 10.1021/acs.jmedchem.1c01784 10.7270/Q2BG2SWG 35195417 Rullo, M; Cipolloni, M; Catto, M; Colliva, C; Miniero, DV; Latronico, T; de Candia, M; Benicchi, T; Linusson, A; Giacchè, N; Altomare, CD; Pisani, L University of Bari "Aldo Moro" http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487662 FC(F)(F)Oc1ccc(Nc2cc(ccn2)-c2noc(n2)-c2ccc(NC(=O)CNc3ccc(Br)cc3)cc2)cc1 InChI=1S/C28H20BrF3N6O3/c29-19-3-7-20(8-4-19)34-16-25(39)36-22-5-1-17(2-6-22)27-37-26(38-41-27)18-13-14-33-24(15-18)35-21-9-11-23(12-10-21)40-28(30,31)32/h1-15,34H,16H2,(H,33,35)(H,36,39) MOXUKECVDLFPIN-UHFFFAOYSA-N 50599522 CHEMBL5173786 Cholinesterase 10520 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599522 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599522&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168275270 482610374 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487663 Fc1ccc(NCC(=O)Nc2ccc(cc2)-c2nc(no2)-c2ccnc(Nc3ccc(OC(F)(F)F)cc3)c2)cc1F InChI=1S/C28H19F5N6O3/c29-22-10-7-20(14-23(22)30)35-15-25(40)37-19-3-1-16(2-4-19)27-38-26(39-42-27)17-11-12-34-24(13-17)36-18-5-8-21(9-6-18)41-28(31,32)33/h1-14,35H,15H2,(H,34,36)(H,37,40) FHIIREMWPSHFRW-UHFFFAOYSA-N 50599523 CHEMBL5203740 Cholinesterase 9880 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599523 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599523&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168293274 482610375 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487664 FC(F)(F)Oc1ccc(Nc2cc(ccn2)-c2noc(n2)-c2ccc(NC(=O)CNc3ccc(cc3)C(F)(F)F)cc2)cc1 InChI=1S/C29H20F6N6O3/c30-28(31,32)19-3-7-20(8-4-19)37-16-25(42)39-22-5-1-17(2-6-22)27-40-26(41-44-27)18-13-14-36-24(15-18)38-21-9-11-23(12-10-21)43-29(33,34)35/h1-15,37H,16H2,(H,36,38)(H,39,42) HVAPSGDEGXCRKI-UHFFFAOYSA-N 50599524 CHEMBL5195554 Cholinesterase 1880 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599524 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599524&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168287152 482610376 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487665 Cc1ccccc1NCC(=O)Nc1ccc(cc1)-c1nc(no1)-c1ccnc(Nc2ccc(OC(F)(F)F)cc2)c1 InChI=1S/C29H23F3N6O3/c1-18-4-2-3-5-24(18)34-17-26(39)36-22-8-6-19(7-9-22)28-37-27(38-41-28)20-14-15-33-25(16-20)35-21-10-12-23(13-11-21)40-29(30,31)32/h2-16,34H,17H2,1H3,(H,33,35)(H,36,39) YWBTYCXDYUNXIG-UHFFFAOYSA-N 50599525 CHEMBL5196096 Cholinesterase 25780 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599525 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599525&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168287184 482610377 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487666 Cc1cccc(NCC(=O)Nc2ccc(cc2)-c2nc(no2)-c2ccnc(Nc3ccc(OC(F)(F)F)cc3)c2)c1 InChI=1S/C29H23F3N6O3/c1-18-3-2-4-23(15-18)34-17-26(39)36-22-7-5-19(6-8-22)28-37-27(38-41-28)20-13-14-33-25(16-20)35-21-9-11-24(12-10-21)40-29(30,31)32/h2-16,34H,17H2,1H3,(H,33,35)(H,36,39) IAZQLEDPCKBBFF-UHFFFAOYSA-N 50599526 CHEMBL5183007 Cholinesterase 20220 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599526 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599526&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168282947 482610378 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487667 Cc1ccc(NCC(=O)Nc2ccc(cc2)-c2nc(no2)-c2ccnc(Nc3ccc(OC(F)(F)F)cc3)c2)cc1 InChI=1S/C29H23F3N6O3/c1-18-2-6-21(7-3-18)34-17-26(39)36-23-8-4-19(5-9-23)28-37-27(38-41-28)20-14-15-33-25(16-20)35-22-10-12-24(13-11-22)40-29(30,31)32/h2-16,34H,17H2,1H3,(H,33,35)(H,36,39) JKMNTQGBWHRJPC-UHFFFAOYSA-N 50599527 CHEMBL5176536 Cholinesterase 19270 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599527 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599527&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168276964 482610379 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487668 FC(F)(F)Oc1ccc(Nc2cc(ccn2)-c2noc(n2)-c2ccc(NC(=O)CNCc3ccccc3)cc2)cc1 InChI=1S/C29H23F3N6O3/c30-29(31,32)40-24-12-10-22(11-13-24)35-25-16-21(14-15-34-25)27-37-28(41-38-27)20-6-8-23(9-7-20)36-26(39)18-33-17-19-4-2-1-3-5-19/h1-16,33H,17-18H2,(H,34,35)(H,36,39) NFSPTCJOLBERPO-UHFFFAOYSA-N 50599528 CHEMBL5172792 Cholinesterase 39200 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599528 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599528&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168274387 482610380 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487669 Fc1ccc(CNCC(=O)Nc2ccc(cc2)-c2nc(no2)-c2ccnc(Nc3ccc(OC(F)(F)F)cc3)c2)cc1 InChI=1S/C29H22F4N6O3/c30-21-5-1-18(2-6-21)16-34-17-26(40)37-23-7-3-19(4-8-23)28-38-27(39-42-28)20-13-14-35-25(15-20)36-22-9-11-24(12-10-22)41-29(31,32)33/h1-15,34H,16-17H2,(H,35,36)(H,37,40) ANRMFKGRCSHRTJ-UHFFFAOYSA-N 50599529 CHEMBL5175472 Cholinesterase 37810 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599529 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599529&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168276094 482610381 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487670 FC(F)(F)Oc1ccc(Nc2cc(ccn2)-c2noc(n2)-c2ccc(NC(=O)CNCc3ccc(cc3)C(F)(F)F)cc2)cc1 InChI=1S/C30H22F6N6O3/c31-29(32,33)21-5-1-18(2-6-21)16-37-17-26(43)40-23-7-3-19(4-8-23)28-41-27(42-45-28)20-13-14-38-25(15-20)39-22-9-11-24(12-10-22)44-30(34,35)36/h1-15,37H,16-17H2,(H,38,39)(H,40,43) HFPTWFNDAAZWKO-UHFFFAOYSA-N 50599530 CHEMBL5201456 Cholinesterase 30850 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599530 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599530&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168290464 482610382 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487671 Fc1cccc(CNCC(=O)Nc2ccc(cc2)-c2nc(no2)-c2ccnc(Nc3ccc(OC(F)(F)F)cc3)c2)c1 InChI=1S/C29H22F4N6O3/c30-21-3-1-2-18(14-21)16-34-17-26(40)37-23-6-4-19(5-7-23)28-38-27(39-42-28)20-12-13-35-25(15-20)36-22-8-10-24(11-9-22)41-29(31,32)33/h1-15,34H,16-17H2,(H,35,36)(H,37,40) RUEZPWKOKPGZIV-UHFFFAOYSA-N 50599531 CHEMBL5188657 Cholinesterase 45300 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599531 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599531&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168280027 482610383 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487672 FC(F)(F)Oc1ccc(Nc2cc(ccn2)-c2noc(n2)-c2ccc(NC(=O)CNCc3cccc(Cl)c3)cc2)cc1 InChI=1S/C29H22ClF3N6O3/c30-21-3-1-2-18(14-21)16-34-17-26(40)37-23-6-4-19(5-7-23)28-38-27(39-42-28)20-12-13-35-25(15-20)36-22-8-10-24(11-9-22)41-29(31,32)33/h1-15,34H,16-17H2,(H,35,36)(H,37,40) LYNRYBQTVXOPCI-UHFFFAOYSA-N 50599532 CHEMBL5206834 Cholinesterase >50000 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599532 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599532&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168294287 482610384 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487673 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 7390 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487674 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 40 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487675 Fc1ccc(NCC(=O)Nc2ccc(cc2)-c2nc(no2)-c2ccnc(Nc3ccc(OC(F)(F)F)cc3)c2)cc1 InChI=1S/C28H20F4N6O3/c29-19-3-7-20(8-4-19)34-16-25(39)36-22-5-1-17(2-6-22)27-37-26(38-41-27)18-13-14-33-24(15-18)35-21-9-11-23(12-10-21)40-28(30,31)32/h1-15,34H,16H2,(H,33,35)(H,36,39) QVBGPENLPOKABU-UHFFFAOYSA-N 50599518 CHEMBL5179502 Cholinesterase 610 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599518 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599518&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 163322013 482610370 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467841 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 5470 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467842 CC1(C)COc2ccccc2C1O InChI=1S/C11H14O2/c1-11(2)7-13-9-6-4-3-5-8(9)10(11)12/h3-6,10,12H,7H2,1-2H3 JLEVCNALXMECJZ-UHFFFAOYSA-N 50592302 CHEMBL5176743 Cholinesterase 40000 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592302 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592302&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 67729663 482603154 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467843 COc1cccc2OCC(C)(C)C(O)c12 InChI=1S/C12H16O3/c1-12(2)7-15-9-6-4-5-8(14-3)10(9)11(12)13/h4-6,11,13H,7H2,1-3H3 MAPRDKQMMLTICI-UHFFFAOYSA-N 50592303 CHEMBL5176178 Cholinesterase >100000 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592303 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592303&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168272104 482603155 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467844 CC1(C)COc2ccc(F)cc2C1O InChI=1S/C11H13FO2/c1-11(2)6-14-9-4-3-7(12)5-8(9)10(11)13/h3-5,10,13H,6H2,1-2H3 VLGGCSRMMDVMPW-UHFFFAOYSA-N 50592304 CHEMBL5200733 Cholinesterase >100000 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592304 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592304&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168290609 482603156 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467845 CC1(C)COc2cc(F)ccc2C1O InChI=1S/C11H13FO2/c1-11(2)6-14-9-5-7(12)3-4-8(9)10(11)13/h3-5,10,13H,6H2,1-2H3 HFAUOYIPDOQJFB-UHFFFAOYSA-N 50592305 CHEMBL5182078 Cholinesterase 18000 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592305 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592305&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168273868 482603157 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467846 CC1(C)COc2cc(F)c(F)cc2C1O InChI=1S/C11H12F2O2/c1-11(2)5-15-9-4-8(13)7(12)3-6(9)10(11)14/h3-4,10,14H,5H2,1-2H3 GQRAZMSMUXWGJS-UHFFFAOYSA-N 50592306 CHEMBL5208926 Cholinesterase 28000 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592306 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592306&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168295774 482603158 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467847 CC1(C)COc2ccc(cc2C1O)C#N InChI=1S/C12H13NO2/c1-12(2)7-15-10-4-3-8(6-13)5-9(10)11(12)14/h3-5,11,14H,7H2,1-2H3 UXAGDCBXJGTFJK-UHFFFAOYSA-N 50592307 CHEMBL5198472 Cholinesterase 18000 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592307 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592307&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168289990 482603159 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467848 Cc1ccc2OCC(C)(C)C(O)c2c1 InChI=1S/C12H16O2/c1-8-4-5-10-9(6-8)11(13)12(2,3)7-14-10/h4-6,11,13H,7H2,1-3H3 DIYWBHDUHWPISH-UHFFFAOYSA-N 50592308 CHEMBL5194107 Cholinesterase >100000 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592308 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592308&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168288371 482603160 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467849 CCOc1cc(cc2C(O)C(C)(C)COc12)C#N InChI=1S/C14H17NO3/c1-4-17-11-6-9(7-15)5-10-12(11)18-8-14(2,3)13(10)16/h5-6,13,16H,4,8H2,1-3H3 HYAPQHNKJKOMKG-UHFFFAOYSA-N 50592309 CHEMBL5203011 Cholinesterase 7300 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592309 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592309&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168292823 482603161 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467850 CC1(C)COc2cc3ccccc3cc2C1O InChI=1S/C15H16O2/c1-15(2)9-17-13-8-11-6-4-3-5-10(11)7-12(13)14(15)16/h3-8,14,16H,9H2,1-2H3 QKAFEZABUWOAIC-UHFFFAOYSA-N 50592310 CHEMBL5196005 Cholinesterase 50000 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592310 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592310&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168287660 482603162 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467851 CC1(C)COc2ccc3ccccc3c2C1O InChI=1S/C15H16O2/c1-15(2)9-17-12-8-7-10-5-3-4-6-11(10)13(12)14(15)16/h3-8,14,16H,9H2,1-2H3 GQABTXZCLIPFNV-UHFFFAOYSA-N 50592311 CHEMBL5195889 Cholinesterase 33000 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592311 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592311&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145204782 482603163 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467852 CC1(C)COc2c(ccc3cccnc23)C1O InChI=1S/C14H15NO2/c1-14(2)8-17-12-10(13(14)16)6-5-9-4-3-7-15-11(9)12/h3-7,13,16H,8H2,1-2H3 DWBDEVWSMYAGST-UHFFFAOYSA-N 50592312 CHEMBL5186546 Cholinesterase 5000 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592312 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592312&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168282670 482603164 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467853 CC1(C)COc2ccccc2C1=O InChI=1S/C11H12O2/c1-11(2)7-13-9-6-4-3-5-8(9)10(11)12/h3-6H,7H2,1-2H3 XGZPZEWXJIKIIG-UHFFFAOYSA-N 50592313 CHEMBL5188449 Cholinesterase 43000 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592313 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592313&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11535657 482603165 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467854 COc1cccc2OCC(C)(C)C(=O)c12 InChI=1S/C12H14O3/c1-12(2)7-15-9-6-4-5-8(14-3)10(9)11(12)13/h4-6H,7H2,1-3H3 NFJWJAOVMUCCTF-UHFFFAOYSA-N 50592314 CHEMBL5203069 Cholinesterase 12000 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592314 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592314&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168292752 482603166 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467855 CC1(C)COc2ccc(F)cc2C1=O InChI=1S/C11H11FO2/c1-11(2)6-14-9-4-3-7(12)5-8(9)10(11)13/h3-5H,6H2,1-2H3 MHDYBKNTTRNOQO-UHFFFAOYSA-N 50592315 CHEMBL5179521 Cholinesterase 33000 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592315 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592315&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11550153 482603167 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467856 CC1(C)COc2cc(F)ccc2C1=O InChI=1S/C11H11FO2/c1-11(2)6-14-9-5-7(12)3-4-8(9)10(11)13/h3-5H,6H2,1-2H3 ZQTGKESVCYNRQW-UHFFFAOYSA-N 50592316 CHEMBL5206417 Cholinesterase >100000 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592316 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592316&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 134112000 482603168 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467857 CC1(C)COc2cc(F)c(F)cc2C1=O InChI=1S/C11H10F2O2/c1-11(2)5-15-9-4-8(13)7(12)3-6(9)10(11)14/h3-4H,5H2,1-2H3 MYHDSTKLLVXVID-UHFFFAOYSA-N 50592317 CHEMBL5173067 Cholinesterase >100000 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592317 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592317&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168272929 482603169 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467858 CCOc1cc(cc2C(=O)C(C)(C)COc12)C#N InChI=1S/C14H15NO3/c1-4-17-11-6-9(7-15)5-10-12(11)18-8-14(2,3)13(10)16/h5-6H,4,8H2,1-3H3 XZZGXNGZRSDENE-UHFFFAOYSA-N 50592318 CHEMBL5185886 Cholinesterase >100000 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592318 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592318&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168283856 482603170 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467859 CC1(C)COc2cc3ccccc3cc2C1=O InChI=1S/C15H14O2/c1-15(2)9-17-13-8-11-6-4-3-5-10(11)7-12(13)14(15)16/h3-8H,9H2,1-2H3 MYVAINWFAHSMAI-UHFFFAOYSA-N 50592319 CHEMBL5184631 Cholinesterase 3100 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592319 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592319&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168281348 482603171 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467860 CC1(C)COc2ccc3ccccc3c2C1=O InChI=1S/C15H14O2/c1-15(2)9-17-12-8-7-10-5-3-4-6-11(10)13(12)14(15)16/h3-8H,9H2,1-2H3 VGYANKWTKNHVMN-UHFFFAOYSA-N 50592320 CHEMBL5172319 Cholinesterase 2900 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592320 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592320&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168269760 482603172 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467861 CC1(C)COc2c(ccc3cccnc23)C1=O InChI=1S/C14H13NO2/c1-14(2)8-17-12-10(13(14)16)6-5-9-4-3-7-15-11(9)12/h3-7H,8H2,1-2H3 WAVAZIAKAFMICI-UHFFFAOYSA-N 50592321 CHEMBL5201709 Cholinesterase 6400 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592321 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592321&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 101521139 482603173 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467862 CC1(C)COc2ncccc2C1=O InChI=1S/C10H11NO2/c1-10(2)6-13-9-7(8(10)12)4-3-5-11-9/h3-5H,6H2,1-2H3 YKQCKQMOYBXQBB-UHFFFAOYSA-N 50592322 CHEMBL5195448 Cholinesterase >100000 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592322 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592322&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168287610 482603174 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467863 CC1(C)COc2c(OC(F)(F)F)cccc2C1=O InChI=1S/C12H11F3O3/c1-11(2)6-17-9-7(10(11)16)4-3-5-8(9)18-12(13,14)15/h3-5H,6H2,1-2H3 UUCIDPMRVCVTIH-UHFFFAOYSA-N 50592323 CHEMBL5175872 Cholinesterase 4300 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592323 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592323&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168272091 482603175 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467864 COc1cccc2C(=O)C(C)(C)COc12 InChI=1S/C12H14O3/c1-12(2)7-15-10-8(11(12)13)5-4-6-9(10)14-3/h4-6H,7H2,1-3H3 UQLDYVANFSYORZ-UHFFFAOYSA-N 50592324 CHEMBL5201347 Cholinesterase >100000 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592324 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592324&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168290447 482603176 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467865 CC1(C)COc2ccccc2C1N InChI=1S/C11H15NO/c1-11(2)7-13-9-6-4-3-5-8(9)10(11)12/h3-6,10H,7,12H2,1-2H3 MWSQQDIZPIJJJO-UHFFFAOYSA-N 50592325 CHEMBL5207496 Cholinesterase 38000 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592325 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592325&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 83906209 482603177 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467866 COc1cccc2C(N)C(C)(C)COc12 InChI=1S/C12H17NO2/c1-12(2)7-15-10-8(11(12)13)5-4-6-9(10)14-3/h4-6,11H,7,13H2,1-3H3 AZPPDSUTCQQITA-UHFFFAOYSA-N 50592326 CHEMBL5187617 Cholinesterase 7600 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592326 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592326&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168282735 482603178 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467867 Cc1ccc2OCC(C)(C)C(N)c2c1 InChI=1S/C12H17NO/c1-8-4-5-10-9(6-8)11(13)12(2,3)7-14-10/h4-6,11H,7,13H2,1-3H3 PEBQLQPWCPCWDX-UHFFFAOYSA-N 50592327 CHEMBL5193164 Cholinesterase 67000 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592327 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592327&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168285326 482603179 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467868 CC1(C)COc2cc3ccccc3cc2C1N InChI=1S/C15H17NO/c1-15(2)9-17-13-8-11-6-4-3-5-10(11)7-12(13)14(15)16/h3-8,14H,9,16H2,1-2H3 AJBONZYMOGEYNY-UHFFFAOYSA-N 50592328 CHEMBL5179978 Cholinesterase 8900 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592328 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592328&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168275104 482603180 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467869 CC1(C)COc2ccc3ccccc3c2C1N InChI=1S/C15H17NO/c1-15(2)9-17-12-8-7-10-5-3-4-6-11(10)13(12)14(15)16/h3-8,14H,9,16H2,1-2H3 AJKVLUXUJBCXHB-UHFFFAOYSA-N 50592329 CHEMBL5192237 Cholinesterase 52000 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592329 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592329&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168289879 482603181 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467870 CC1(C)COc2c(ccc3cccnc23)C1O InChI=1S/C14H15NO2/c1-14(2)8-17-12-10(13(14)16)6-5-9-4-3-7-15-11(9)12/h3-7,13,16H,8H2,1-2H3 DWBDEVWSMYAGST-UHFFFAOYSA-N 50592312 CHEMBL5186546 Cholinesterase 7200 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592312 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592312&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168282670 482603164 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467871 CC1(C)COc2ccc3ccccc3c2C1=O InChI=1S/C15H14O2/c1-15(2)9-17-12-8-7-10-5-3-4-6-11(10)13(12)14(15)16/h3-8H,9H2,1-2H3 VGYANKWTKNHVMN-UHFFFAOYSA-N 50592320 CHEMBL5172319 Cholinesterase 2000 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592320 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592320&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168269760 482603172 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467872 COc1cccc2C(N)C(C)(C)COc12 InChI=1S/C12H17NO2/c1-12(2)7-15-10-8(11(12)13)5-4-6-9(10)14-3/h4-6,11H,7,13H2,1-3H3 AZPPDSUTCQQITA-UHFFFAOYSA-N 50592326 CHEMBL5187617 Cholinesterase 9000 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592326 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592326&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168282735 482603178 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467873 CC1(C)COc2cc3ccccc3cc2C1N InChI=1S/C15H17NO/c1-15(2)9-17-13-8-11-6-4-3-5-10(11)7-12(13)14(15)16/h3-8,14H,9,16H2,1-2H3 AJBONZYMOGEYNY-UHFFFAOYSA-N 50592328 CHEMBL5179978 Cholinesterase 18000 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592328 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592328&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168275104 482603180 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467874 CC1(C)COc2c(ccc3cccnc23)C1O InChI=1S/C14H15NO2/c1-14(2)8-17-12-10(13(14)16)6-5-9-4-3-7-15-11(9)12/h3-7,13,16H,8H2,1-2H3 DWBDEVWSMYAGST-UHFFFAOYSA-N 50592312 CHEMBL5186546 Cholinesterase 13700 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592312 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592312&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168282670 482603164 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467875 CC1(C)COc2ccc3ccccc3c2C1=O InChI=1S/C15H14O2/c1-15(2)9-17-12-8-7-10-5-3-4-6-11(10)13(12)14(15)16/h3-8H,9H2,1-2H3 VGYANKWTKNHVMN-UHFFFAOYSA-N 50592320 CHEMBL5172319 Cholinesterase 6700 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592320 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592320&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168269760 482603172 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467876 COc1cccc2C(N)C(C)(C)COc12 InChI=1S/C12H17NO2/c1-12(2)7-15-10-8(11(12)13)5-4-6-9(10)14-3/h4-6,11H,7,13H2,1-3H3 AZPPDSUTCQQITA-UHFFFAOYSA-N 50592326 CHEMBL5187617 Cholinesterase 19100 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592326 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592326&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168282735 482603178 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51467877 CC1(C)COc2cc3ccccc3cc2C1N InChI=1S/C15H17NO/c1-15(2)9-17-13-8-11-6-4-3-5-10(11)7-12(13)14(15)16/h3-8,14H,9,16H2,1-2H3 AJBONZYMOGEYNY-UHFFFAOYSA-N 50592328 CHEMBL5179978 Cholinesterase 11000 ChEMBL 10.7270/Q2JD51SB 35653868 Moutayakine, A; Marques, C; López, Ó; Bagetta, D; Leitzbach, L; Hagenow, S; Carreiro, EP; Stark, H; Alcaro, S; Fernández-Bolaños, JG; Burke, AJ University of £vora http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50592328 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50592328&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168275104 482603180 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486805 CCN(CC)Cc1ccccc1CNC(=O)c1cccc(NC(=O)c2cccs2)c1 InChI=1S/C24H27N3O2S/c1-3-27(4-2)17-20-10-6-5-9-19(20)16-25-23(28)18-11-7-12-21(15-18)26-24(29)22-13-8-14-30-22/h5-15H,3-4,16-17H2,1-2H3,(H,25,28)(H,26,29) KGYMZHTZFBOJSY-UHFFFAOYSA-N 50599154 CHEMBL5185039 Cholinesterase 0.130000 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599154 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599154&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 9074003 482610006 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486806 Cc1ccccc1NC(=O)c1cccc(NC(=O)c2cccs2)c1 InChI=1S/C19H16N2O2S/c1-13-6-2-3-9-16(13)21-18(22)14-7-4-8-15(12-14)20-19(23)17-10-5-11-24-17/h2-12H,1H3,(H,20,23)(H,21,22) ZAUUCBCNLQOICJ-UHFFFAOYSA-N 50599155 CHEMBL5178677 Cholinesterase 12920 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599155 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599155&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 8249754 482610007 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486807 CN(C)Cc1ccccc1NC(=O)c1cccc(NC(=O)c2cccs2)c1 InChI=1S/C21H21N3O2S/c1-24(2)14-16-7-3-4-10-18(16)23-20(25)15-8-5-9-17(13-15)22-21(26)19-11-6-12-27-19/h3-13H,14H2,1-2H3,(H,22,26)(H,23,25) SKPUEXCQARNWGD-UHFFFAOYSA-N 50599156 CHEMBL5179673 Cholinesterase 1910 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599156 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599156&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 31968651 482610008 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486808 CCN(CC)Cc1ccccc1NC(=O)c1cccc(NC(=O)c2cccs2)c1 InChI=1S/C23H25N3O2S/c1-3-26(4-2)16-18-9-5-6-12-20(18)25-22(27)17-10-7-11-19(15-17)24-23(28)21-13-8-14-29-21/h5-15H,3-4,16H2,1-2H3,(H,24,28)(H,25,27) FRJVBTKGXGSSHD-UHFFFAOYSA-N 50599157 CHEMBL5185423 Cholinesterase 480 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599157 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599157&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 150210535 482610009 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486809 CCCN(CCC)Cc1ccccc1NC(=O)c1cccc(NC(=O)c2cccs2)c1 InChI=1S/C25H29N3O2S/c1-3-14-28(15-4-2)18-20-9-5-6-12-22(20)27-24(29)19-10-7-11-21(17-19)26-25(30)23-13-8-16-31-23/h5-13,16-17H,3-4,14-15,18H2,1-2H3,(H,26,30)(H,27,29) MKCZBZBWURZDEM-UHFFFAOYSA-N 50599158 CHEMBL5186019 Cholinesterase 120 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599158 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599158&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 151081045 482610010 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486810 O=C(Nc1cccc(c1)C(=O)NCc1ccccc1)c1cccs1 InChI=1S/C19H16N2O2S/c22-18(20-13-14-6-2-1-3-7-14)15-8-4-9-16(12-15)21-19(23)17-10-5-11-24-17/h1-12H,13H2,(H,20,22)(H,21,23) XFMCRBJMFJZSTH-UHFFFAOYSA-N 50599159 CHEMBL5200557 Cholinesterase 97270 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599159 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599159&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1246233 482610011 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486811 CN(C)Cc1ccccc1CNC(=O)c1cccc(NC(=O)c2cccs2)c1 InChI=1S/C22H23N3O2S/c1-25(2)15-18-8-4-3-7-17(18)14-23-21(26)16-9-5-10-19(13-16)24-22(27)20-11-6-12-28-20/h3-13H,14-15H2,1-2H3,(H,23,26)(H,24,27) UTNBRMLHCJBFFR-UHFFFAOYSA-N 50599160 CHEMBL5173939 Cholinesterase 0.290000 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599160 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599160&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 8197605 482610012 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486812 CCCN(CCC)Cc1ccccc1CNC(=O)c1cccc(NC(=O)c2cccs2)c1 InChI=1S/C26H31N3O2S/c1-3-14-29(15-4-2)19-22-10-6-5-9-21(22)18-27-25(30)20-11-7-12-23(17-20)28-26(31)24-13-8-16-32-24/h5-13,16-17H,3-4,14-15,18-19H2,1-2H3,(H,27,30)(H,28,31) SDSCJDCHYKVMHL-UHFFFAOYSA-N 50599161 CHEMBL5208367 Cholinesterase 0.450000 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599161 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599161&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 151826414 482610013 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486813 CCN(CC)Cc1cccc(CNC(=O)c2cccc(NC(=O)c3cccs3)c2)c1 InChI=1S/C24H27N3O2S/c1-3-27(4-2)17-19-9-5-8-18(14-19)16-25-23(28)20-10-6-11-21(15-20)26-24(29)22-12-7-13-30-22/h5-15H,3-4,16-17H2,1-2H3,(H,25,28)(H,26,29) RAYWEWGGWSDWQY-UHFFFAOYSA-N 50599162 CHEMBL5185740 Cholinesterase 54970 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599162 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599162&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 151683185 482610014 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486814 CCN(CC)Cc1ccc(CNC(=O)c2cccc(NC(=O)c3cccs3)c2)cc1 InChI=1S/C24H27N3O2S/c1-3-27(4-2)17-19-12-10-18(11-13-19)16-25-23(28)20-7-5-8-21(15-20)26-24(29)22-9-6-14-30-22/h5-15H,3-4,16-17H2,1-2H3,(H,25,28)(H,26,29) VNHUAHFVZMNTCU-UHFFFAOYSA-N 50599163 CHEMBL5196163 Cholinesterase 5950 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599163 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599163&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 8948440 482610015 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486815 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 15 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486816 CCN(CC)Cc1ccccc1CNC(=O)c1cccc(NC(=O)c2ccco2)c1 InChI=1S/C24H27N3O3/c1-3-27(4-2)17-20-10-6-5-9-19(20)16-25-23(28)18-11-7-12-21(15-18)26-24(29)22-13-8-14-30-22/h5-15H,3-4,16-17H2,1-2H3,(H,25,28)(H,26,29) XOQLEHINJSAHAP-UHFFFAOYSA-N 50599164 CHEMBL5201951 Cholinesterase 0.790000 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599164 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599164&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 152426927 482610016 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486817 CCN(CC)Cc1ccccc1CNC(=O)c1cccc(NC(=O)C2CCCCC2)c1 InChI=1S/C26H35N3O2/c1-3-29(4-2)19-23-14-9-8-13-22(23)18-27-25(30)21-15-10-16-24(17-21)28-26(31)20-11-6-5-7-12-20/h8-10,13-17,20H,3-7,11-12,18-19H2,1-2H3,(H,27,30)(H,28,31) YZQYLOVOGNHZCO-UHFFFAOYSA-N 50599165 CHEMBL5171447 Cholinesterase 7.9 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599165 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599165&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155664131 482610017 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486818 CCN(CC)Cc1ccccc1CNC(=O)c1cccc(NC(=O)c2ccccc2)c1 InChI=1S/C26H29N3O2/c1-3-29(4-2)19-23-14-9-8-13-22(23)18-27-25(30)21-15-10-16-24(17-21)28-26(31)20-11-6-5-7-12-20/h5-17H,3-4,18-19H2,1-2H3,(H,27,30)(H,28,31) GWYBHSOQKSQRCZ-UHFFFAOYSA-N 50599166 CHEMBL5195383 Cholinesterase 0.960000 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599166 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599166&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155664130 482610018 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486819 CCN(CC)Cc1ccccc1CNC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1 InChI=1S/C26H28FN3O2/c1-3-30(4-2)18-22-9-6-5-8-21(22)17-28-25(31)20-10-7-11-24(16-20)29-26(32)19-12-14-23(27)15-13-19/h5-16H,3-4,17-18H2,1-2H3,(H,28,31)(H,29,32) VINBNLJQGNXIFH-UHFFFAOYSA-N 50599167 CHEMBL5195228 Cholinesterase 0.150000 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599167 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599167&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 39994248 482610019 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486820 CCN(CC)Cc1ccccc1CNC(=O)c1cccc(NC(=O)c2cccc(F)c2)c1 InChI=1S/C26H28FN3O2/c1-3-30(4-2)18-22-10-6-5-9-21(22)17-28-25(31)20-12-8-14-24(16-20)29-26(32)19-11-7-13-23(27)15-19/h5-16H,3-4,17-18H2,1-2H3,(H,28,31)(H,29,32) AUAVVJVUZIVRMU-UHFFFAOYSA-N 50599168 CHEMBL5190745 Cholinesterase 4.6 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599168 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599168&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155664134 482610020 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486821 CCN(CC)Cc1ccccc1CNC(=O)c1cccc(NC(=O)c2ccccc2F)c1 InChI=1S/C26H28FN3O2/c1-3-30(4-2)18-21-11-6-5-10-20(21)17-28-25(31)19-12-9-13-22(16-19)29-26(32)23-14-7-8-15-24(23)27/h5-16H,3-4,17-18H2,1-2H3,(H,28,31)(H,29,32) XRRLLIQZQWJAIY-UHFFFAOYSA-N 50599169 CHEMBL5198770 Cholinesterase 6.5 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599169 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599169&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 152442074 482610021 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486822 CCN(CC)Cc1ccccc1CNC(=O)c1cccc(NC(=O)c2c(F)c(F)c(F)c(F)c2F)c1 InChI=1S/C26H24F5N3O2/c1-3-34(4-2)14-17-9-6-5-8-16(17)13-32-25(35)15-10-7-11-18(12-15)33-26(36)19-20(27)22(29)24(31)23(30)21(19)28/h5-12H,3-4,13-14H2,1-2H3,(H,32,35)(H,33,36) RZLWHPODUZRQFY-UHFFFAOYSA-N 50599170 CHEMBL5201163 Cholinesterase 0.480000 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599170 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599170&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168290241 482610022 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486823 CCN(CC)Cc1ccccc1CNC(=O)c1cccc(NC(=O)c2ccc(Cl)cc2)c1 InChI=1S/C26H28ClN3O2/c1-3-30(4-2)18-22-9-6-5-8-21(22)17-28-25(31)20-10-7-11-24(16-20)29-26(32)19-12-14-23(27)15-13-19/h5-16H,3-4,17-18H2,1-2H3,(H,28,31)(H,29,32) GBGKTJHGBHPXNO-UHFFFAOYSA-N 50599171 CHEMBL5198895 Cholinesterase 1.0 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599171 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599171&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155664124 482610023 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486824 CCN(CC)Cc1ccccc1CNC(=O)c1cccc(NC(=O)c2ccc(Br)cc2)c1 InChI=1S/C26H28BrN3O2/c1-3-30(4-2)18-22-9-6-5-8-21(22)17-28-25(31)20-10-7-11-24(16-20)29-26(32)19-12-14-23(27)15-13-19/h5-16H,3-4,17-18H2,1-2H3,(H,28,31)(H,29,32) PXKDXQYLENYGCE-UHFFFAOYSA-N 50599172 CHEMBL5181960 Cholinesterase 0.087000 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599172 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599172&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155664133 482610024 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486825 CCN(CC)Cc1ccccc1CNC(=O)c1cccc(NC(=O)c2ccc(I)cc2)c1 InChI=1S/C26H28IN3O2/c1-3-30(4-2)18-22-9-6-5-8-21(22)17-28-25(31)20-10-7-11-24(16-20)29-26(32)19-12-14-23(27)15-13-19/h5-16H,3-4,17-18H2,1-2H3,(H,28,31)(H,29,32) WVCVMKBNQDIONB-UHFFFAOYSA-N 50599173 CHEMBL5200785 Cholinesterase 0.340000 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599173 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599173&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155664128 482610025 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486826 CCN(CC)Cc1ccccc1CNC(=O)c1cccc(NC(=O)c2ccc(C)cc2)c1 InChI=1S/C27H31N3O2/c1-4-30(5-2)19-24-10-7-6-9-23(24)18-28-26(31)22-11-8-12-25(17-22)29-27(32)21-15-13-20(3)14-16-21/h6-17H,4-5,18-19H2,1-3H3,(H,28,31)(H,29,32) JOKCRKMFYMCFKV-UHFFFAOYSA-N 50599174 CHEMBL5195425 Cholinesterase 77 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599174 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599174&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155664125 482610026 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486827 CCN(CC)Cc1ccccc1CNC(=O)c1cccc(NC(=O)c2ccc(OC)cc2)c1 InChI=1S/C27H31N3O3/c1-4-30(5-2)19-23-10-7-6-9-22(23)18-28-26(31)21-11-8-12-24(17-21)29-27(32)20-13-15-25(33-3)16-14-20/h6-17H,4-5,18-19H2,1-3H3,(H,28,31)(H,29,32) PJKZQEQYLPNJGF-UHFFFAOYSA-N 50599175 CHEMBL5188290 Cholinesterase 0.550000 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599175 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599175&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156145621 482610027 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486828 CCN(CC)Cc1ccccc1CNC(=O)c1cccc(OC(=O)c2cccs2)c1 InChI=1S/C24H26N2O3S/c1-3-26(4-2)17-20-10-6-5-9-19(20)16-25-23(27)18-11-7-12-21(15-18)29-24(28)22-13-8-14-30-22/h5-15H,3-4,16-17H2,1-2H3,(H,25,27) MEAPGUVEUAEOFJ-UHFFFAOYSA-N 50599176 CHEMBL5178120 Cholinesterase 158 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599176 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599176&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168271218 482610028 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486829 CCN(CC)Cc1ccccc1CNC(=O)c1cccc(NS(=O)(=O)c2cccs2)c1 InChI=1S/C23H27N3O3S2/c1-3-26(4-2)17-20-10-6-5-9-19(20)16-24-23(27)18-11-7-12-21(15-18)25-31(28,29)22-13-8-14-30-22/h5-15,25H,3-4,16-17H2,1-2H3,(H,24,27) TWQMYDGVEKAUFK-UHFFFAOYSA-N 50599177 CHEMBL5188959 Cholinesterase 350 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599177 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599177&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 55788881 482610029 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486830 CCN(CC)Cc1ccccc1CNC(=O)c1cccc(c1)C(=O)Nc1cccs1 InChI=1S/C24H27N3O2S/c1-3-27(4-2)17-21-10-6-5-9-20(21)16-25-23(28)18-11-7-12-19(15-18)24(29)26-22-13-8-14-30-22/h5-15H,3-4,16-17H2,1-2H3,(H,25,28)(H,26,29) FGRISWDEGDVXOW-UHFFFAOYSA-N 50599178 CHEMBL5190491 Cholinesterase 1.2 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599178 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599178&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168280114 482610030 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486831 CCN(CC)Cc1ccccc1CNC(=O)c1ccc(NC(=O)c2ccc(F)cc2)cc1 InChI=1S/C26H28FN3O2/c1-3-30(4-2)18-22-8-6-5-7-21(22)17-28-25(31)19-11-15-24(16-12-19)29-26(32)20-9-13-23(27)14-10-20/h5-16H,3-4,17-18H2,1-2H3,(H,28,31)(H,29,32) FRDRWYZOFZDRSA-UHFFFAOYSA-N 50599179 CHEMBL5174262 Cholinesterase 5.0 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599179 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599179&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168276474 482610031 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486832 CCN(CC)Cc1ccccc1CNC(=O)c1ccccc1NC(=O)c1ccc(F)cc1 InChI=1S/C26H28FN3O2/c1-3-30(4-2)18-21-10-6-5-9-20(21)17-28-26(32)23-11-7-8-12-24(23)29-25(31)19-13-15-22(27)16-14-19/h5-16H,3-4,17-18H2,1-2H3,(H,28,32)(H,29,31) LBBOIUKGAUMAIL-UHFFFAOYSA-N 50599180 CHEMBL5201295 Cholinesterase 187 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599180 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599180&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168290432 482610032 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486833 CCN(CC)Cc1ccccc1CNC(=O)c1ccc(Br)c(NC(=O)c2ccc(F)cc2)c1 InChI=1S/C26H27BrFN3O2/c1-3-31(4-2)17-21-8-6-5-7-20(21)16-29-25(32)19-11-14-23(27)24(15-19)30-26(33)18-9-12-22(28)13-10-18/h5-15H,3-4,16-17H2,1-2H3,(H,29,32)(H,30,33) UMKPOYZZISVJJU-UHFFFAOYSA-N 50599181 CHEMBL5169365 Cholinesterase 2.4 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599181 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599181&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168269337 482610033 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486834 CCN(CC)Cc1ccccc1CNC(=O)c1cc(Br)cc(NC(=O)c2ccc(F)cc2)c1 InChI=1S/C26H27BrFN3O2/c1-3-31(4-2)17-20-8-6-5-7-19(20)16-29-25(32)21-13-22(27)15-24(14-21)30-26(33)18-9-11-23(28)12-10-18/h5-15H,3-4,16-17H2,1-2H3,(H,29,32)(H,30,33) YQBUNHYRWANHPP-UHFFFAOYSA-N 50599182 CHEMBL5197490 Cholinesterase 0.420000 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599182 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599182&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168284447 482610034 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486835 CCN(CC)Cc1ccccc1CNC(=O)c1cc(NC(=O)c2ccc(F)cc2)ccc1Br InChI=1S/C26H27BrFN3O2/c1-3-31(4-2)17-20-8-6-5-7-19(20)16-29-26(33)23-15-22(13-14-24(23)27)30-25(32)18-9-11-21(28)12-10-18/h5-15H,3-4,16-17H2,1-2H3,(H,29,33)(H,30,32) AWNNBYDEVDUCRR-UHFFFAOYSA-N 50599183 CHEMBL5182498 Cholinesterase 3.5 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599183 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599183&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168280841 482610035 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486836 CCN(CC)Cc1ccccc1CNC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1Br InChI=1S/C26H27BrFN3O2/c1-3-31(4-2)17-20-9-6-5-8-19(20)16-29-26(33)22-10-7-11-23(24(22)27)30-25(32)18-12-14-21(28)15-13-18/h5-15H,3-4,16-17H2,1-2H3,(H,29,33)(H,30,32) DONFLBPXEFLPQL-UHFFFAOYSA-N 50599184 CHEMBL5172504 Cholinesterase 14 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599184 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599184&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168271099 482610036 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486837 CCN(CC)Cc1ccccc1CNC(=O)c1ccc(C)c(NC(=O)c2ccc(F)cc2)c1 InChI=1S/C27H30FN3O2/c1-4-31(5-2)18-23-9-7-6-8-22(23)17-29-26(32)21-11-10-19(3)25(16-21)30-27(33)20-12-14-24(28)15-13-20/h6-16H,4-5,17-18H2,1-3H3,(H,29,32)(H,30,33) QPDRTLJVRYSGHG-UHFFFAOYSA-N 50599185 CHEMBL5199323 Cholinesterase 0.380000 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599185 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599185&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168290941 482610037 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486838 CCN(CC)Cc1ccccc1CNC(=O)c1cc(C)cc(NC(=O)c2ccc(F)cc2)c1 InChI=1S/C27H30FN3O2/c1-4-31(5-2)18-22-9-7-6-8-21(22)17-29-26(32)23-14-19(3)15-25(16-23)30-27(33)20-10-12-24(28)13-11-20/h6-16H,4-5,17-18H2,1-3H3,(H,29,32)(H,30,33) PRFKZZKBOMGITD-UHFFFAOYSA-N 50599186 CHEMBL5201089 Cholinesterase 0.021000 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599186 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599186&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168290398 482610038 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486839 CCN(CC)Cc1ccccc1CNC(=O)c1cc(NC(=O)c2ccc(F)cc2)ccc1C InChI=1S/C27H30FN3O2/c1-4-31(5-2)18-22-9-7-6-8-21(22)17-29-27(33)25-16-24(15-10-19(25)3)30-26(32)20-11-13-23(28)14-12-20/h6-16H,4-5,17-18H2,1-3H3,(H,29,33)(H,30,32) WJTLXUGJQIDIJF-UHFFFAOYSA-N 50599187 CHEMBL5208374 Cholinesterase 1.4 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599187 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599187&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168296601 482610039 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486840 CCN(CC)Cc1ccccc1CNC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1C InChI=1S/C27H30FN3O2/c1-4-31(5-2)18-22-10-7-6-9-21(22)17-29-27(33)24-11-8-12-25(19(24)3)30-26(32)20-13-15-23(28)16-14-20/h6-16H,4-5,17-18H2,1-3H3,(H,29,33)(H,30,32) FRTOVWOCMZRMLU-UHFFFAOYSA-N 50599188 CHEMBL5184944 Cholinesterase 0.140000 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599188 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599188&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168283392 482610040 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486841 CCN(CC)Cc1ccccc1CNC(=O)c1cc(NC(=O)c2ccc(F)cc2)cc(OC)c1 InChI=1S/C27H30FN3O3/c1-4-31(5-2)18-21-9-7-6-8-20(21)17-29-26(32)22-14-24(16-25(15-22)34-3)30-27(33)19-10-12-23(28)13-11-19/h6-16H,4-5,17-18H2,1-3H3,(H,29,32)(H,30,33) KEBAZZYKHKZMOD-UHFFFAOYSA-N 50599189 CHEMBL5183552 Cholinesterase 0.820000 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599189 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599189&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168282503 482610041 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486842 CCN(CC)Cc1ccccc1CNC(=O)c1cc(F)cc(NC(=O)c2ccc(F)cc2)c1 InChI=1S/C26H27F2N3O2/c1-3-31(4-2)17-20-8-6-5-7-19(20)16-29-25(32)21-13-23(28)15-24(14-21)30-26(33)18-9-11-22(27)12-10-18/h5-15H,3-4,16-17H2,1-2H3,(H,29,32)(H,30,33) DXQJWRPPQGWZNM-UHFFFAOYSA-N 50599190 CHEMBL5191236 Cholinesterase 0.550000 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599190 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599190&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168287836 482610042 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486843 CCN(CC)Cc1ccccc1CNC(=O)c1cc(Cl)cc(NC(=O)c2ccc(F)cc2)c1 InChI=1S/C26H27ClFN3O2/c1-3-31(4-2)17-20-8-6-5-7-19(20)16-29-25(32)21-13-22(27)15-24(14-21)30-26(33)18-9-11-23(28)12-10-18/h5-15H,3-4,16-17H2,1-2H3,(H,29,32)(H,30,33) XBHGYVQRDLZESO-UHFFFAOYSA-N 50599191 CHEMBL5184728 Cholinesterase 0.160000 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599191 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599191&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168284215 482610043 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486844 CCN(CC)Cc1ccccc1CNC(=O)c1cc(NC(=O)c2ccc(F)cc2)cc(c1)C#N InChI=1S/C27H27FN4O2/c1-3-32(4-2)18-22-8-6-5-7-21(22)17-30-26(33)23-13-19(16-29)14-25(15-23)31-27(34)20-9-11-24(28)12-10-20/h5-15H,3-4,17-18H2,1-2H3,(H,30,33)(H,31,34) SRXAZMFXOIUPOP-UHFFFAOYSA-N 50599192 CHEMBL5186949 Cholinesterase 1.5 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599192 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599192&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168278636 482610044 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486845 CCN(CC)Cc1ccccc1CNC(=O)c1cc(NC(=O)c2ccc(F)cc2)cc(c1)[N+]([O-])=O InChI=1S/C26H27FN4O4/c1-3-30(4-2)17-20-8-6-5-7-19(20)16-28-25(32)21-13-23(15-24(14-21)31(34)35)29-26(33)18-9-11-22(27)12-10-18/h5-15H,3-4,16-17H2,1-2H3,(H,28,32)(H,29,33) GUALUQRNPAZLGV-UHFFFAOYSA-N 50599193 CHEMBL5185696 Cholinesterase 1.3 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599193 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599193&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168279597 482610045 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51486846 CCN(CC)Cc1ccccc1CNC(=O)c1cc(NC(=O)c2ccc(F)cc2)cc(c1)C(F)(F)F InChI=1S/C27H27F4N3O2/c1-3-34(4-2)17-20-8-6-5-7-19(20)16-32-25(35)21-13-22(27(29,30)31)15-24(14-21)33-26(36)18-9-11-23(28)12-10-18/h5-15H,3-4,16-17H2,1-2H3,(H,32,35)(H,33,36) ZIECMURPZWIJPK-UHFFFAOYSA-N 50599194 CHEMBL5174951 Cholinesterase 1.4 ChEMBL 10.7270/Q2HX1HP4 35969197 Du, C; Wang, L; Guan, Q; Yang, H; Chen, T; Liu, Y; Li, Q; Lyu, W; Lu, X; Chen, Y; Liu, Y; Liu, H; Feng, F; Liu, W; Liu, Z; Li, W; Chen, Y; Sun, H China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599194 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599194&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168271599 482610046 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487650 CCCNCC(=O)Nc1ccc(cc1)-c1nc(no1)-c1ccnc(Nc2ccc(OC(F)(F)F)cc2)c1 InChI=1S/C25H23F3N6O3/c1-2-12-29-15-22(35)32-19-5-3-16(4-6-19)24-33-23(34-37-24)17-11-13-30-21(14-17)31-18-7-9-20(10-8-18)36-25(26,27)28/h3-11,13-14,29H,2,12,15H2,1H3,(H,30,31)(H,32,35) NKZUCJQAXWLRQW-UHFFFAOYSA-N 50599510 CHEMBL5200976 Cholinesterase 23350 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599510 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599510&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168291384 482610362 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487651 CCCCNCC(=O)Nc1ccc(cc1)-c1nc(no1)-c1ccnc(Nc2ccc(OC(F)(F)F)cc2)c1 InChI=1S/C26H25F3N6O3/c1-2-3-13-30-16-23(36)33-20-6-4-17(5-7-20)25-34-24(35-38-25)18-12-14-31-22(15-18)32-19-8-10-21(11-9-19)37-26(27,28)29/h4-12,14-15,30H,2-3,13,16H2,1H3,(H,31,32)(H,33,36) XVCDPAYDRQBECA-UHFFFAOYSA-N 50599511 CHEMBL5194328 Cholinesterase 15730 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599511 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599511&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168290158 482610363 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487652 CC(C)CNCC(=O)Nc1ccc(cc1)-c1nc(no1)-c1ccnc(Nc2ccc(OC(F)(F)F)cc2)c1 InChI=1S/C26H25F3N6O3/c1-16(2)14-30-15-23(36)33-20-5-3-17(4-6-20)25-34-24(35-38-25)18-11-12-31-22(13-18)32-19-7-9-21(10-8-19)37-26(27,28)29/h3-13,16,30H,14-15H2,1-2H3,(H,31,32)(H,33,36) UIKHUUXDVIJVNZ-UHFFFAOYSA-N 50599512 CHEMBL5177757 Cholinesterase 29370 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599512 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599512&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168273690 482610364 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487653 FC(F)(F)Oc1ccc(Nc2cc(ccn2)-c2noc(n2)-c2ccc(NC(=O)CNC3CC3)cc2)cc1 InChI=1S/C25H21F3N6O3/c26-25(27,28)36-20-9-7-18(8-10-20)31-21-13-16(11-12-29-21)23-33-24(37-34-23)15-1-3-19(4-2-15)32-22(35)14-30-17-5-6-17/h1-4,7-13,17,30H,5-6,14H2,(H,29,31)(H,32,35) BQLYBTLOWYZEAG-UHFFFAOYSA-N 50599513 CHEMBL5199146 Cholinesterase 24270 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599513 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599513&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168290919 482610365 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487654 FC(F)(F)Oc1ccc(Nc2cc(ccn2)-c2noc(n2)-c2ccc(NC(=O)CNC3CCCC3)cc2)cc1 InChI=1S/C27H25F3N6O3/c28-27(29,30)38-22-11-9-20(10-12-22)33-23-15-18(13-14-31-23)25-35-26(39-36-25)17-5-7-21(8-6-17)34-24(37)16-32-19-3-1-2-4-19/h5-15,19,32H,1-4,16H2,(H,31,33)(H,34,37) OYHTXBMCDOARTQ-UHFFFAOYSA-N 50599514 CHEMBL5171143 Cholinesterase 16600 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599514 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599514&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168270756 482610366 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487655 FC(F)(F)Oc1ccc(Nc2cc(ccn2)-c2noc(n2)-c2ccc(NC(=O)CNc3ccccc3)cc2)cc1 InChI=1S/C28H21F3N6O3/c29-28(30,31)39-23-12-10-21(11-13-23)34-24-16-19(14-15-32-24)26-36-27(40-37-26)18-6-8-22(9-7-18)35-25(38)17-33-20-4-2-1-3-5-20/h1-16,33H,17H2,(H,32,34)(H,35,38) FBWYJLAERONWML-UHFFFAOYSA-N 50599515 CHEMBL5204549 Cholinesterase 14060 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599515 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599515&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168294812 482610367 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487656 COc1ccc(NCC(=O)Nc2ccc(cc2)-c2nc(no2)-c2ccnc(Nc3ccc(OC(F)(F)F)cc3)c2)cc1 InChI=1S/C29H23F3N6O4/c1-40-23-10-6-20(7-11-23)34-17-26(39)36-22-4-2-18(3-5-22)28-37-27(38-42-28)19-14-15-33-25(16-19)35-21-8-12-24(13-9-21)41-29(30,31)32/h2-16,34H,17H2,1H3,(H,33,35)(H,36,39) HPSCXZIDTJZKBM-UHFFFAOYSA-N 50599516 CHEMBL5194251 Cholinesterase >50000 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599516 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599516&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168287495 482610368 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487657 COc1cccc(NCC(=O)Nc2ccc(cc2)-c2nc(no2)-c2ccnc(Nc3ccc(OC(F)(F)F)cc3)c2)c1 InChI=1S/C29H23F3N6O4/c1-40-24-4-2-3-22(16-24)34-17-26(39)36-21-7-5-18(6-8-21)28-37-27(38-42-28)19-13-14-33-25(15-19)35-20-9-11-23(12-10-20)41-29(30,31)32/h2-16,34H,17H2,1H3,(H,33,35)(H,36,39) QMWFPTOYMMYDJE-UHFFFAOYSA-N 50599517 CHEMBL5187208 Cholinesterase 33510 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599517 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599517&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168281875 482610369 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487658 Fc1ccc(NCC(=O)Nc2ccc(cc2)-c2nc(no2)-c2ccnc(Nc3ccc(OC(F)(F)F)cc3)c2)cc1 InChI=1S/C28H20F4N6O3/c29-19-3-7-20(8-4-19)34-16-25(39)36-22-5-1-17(2-6-22)27-37-26(38-41-27)18-13-14-33-24(15-18)35-21-9-11-23(12-10-21)40-28(30,31)32/h1-15,34H,16H2,(H,33,35)(H,36,39) QVBGPENLPOKABU-UHFFFAOYSA-N 50599518 CHEMBL5179502 Cholinesterase 1280 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599518 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599518&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 163322013 482610370 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487659 Fc1cccc(NCC(=O)Nc2ccc(cc2)-c2nc(no2)-c2ccnc(Nc3ccc(OC(F)(F)F)cc3)c2)c1 InChI=1S/C28H20F4N6O3/c29-19-2-1-3-22(15-19)34-16-25(39)36-21-6-4-17(5-7-21)27-37-26(38-41-27)18-12-13-33-24(14-18)35-20-8-10-23(11-9-20)40-28(30,31)32/h1-15,34H,16H2,(H,33,35)(H,36,39) FJDOLTIGLRJBOP-UHFFFAOYSA-N 50599519 CHEMBL5185141 Cholinesterase 5510 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599519 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599519&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168282604 482610371 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487660 FC(F)(F)Oc1ccc(Nc2cc(ccn2)-c2noc(n2)-c2ccc(NC(=O)CNc3ccc(Cl)cc3)cc2)cc1 InChI=1S/C28H20ClF3N6O3/c29-19-3-7-20(8-4-19)34-16-25(39)36-22-5-1-17(2-6-22)27-37-26(38-41-27)18-13-14-33-24(15-18)35-21-9-11-23(12-10-21)40-28(30,31)32/h1-15,34H,16H2,(H,33,35)(H,36,39) OFCCVBPPOOJZNS-UHFFFAOYSA-N 50599520 CHEMBL5185519 Cholinesterase 7390 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599520 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599520&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168284244 482610372 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487661 FC(F)(F)Oc1ccc(Nc2cc(ccn2)-c2noc(n2)-c2ccc(NC(=O)CNc3cccc(Cl)c3)cc2)cc1 InChI=1S/C28H20ClF3N6O3/c29-19-2-1-3-22(15-19)34-16-25(39)36-21-6-4-17(5-7-21)27-37-26(38-41-27)18-12-13-33-24(14-18)35-20-8-10-23(11-9-20)40-28(30,31)32/h1-15,34H,16H2,(H,33,35)(H,36,39) BZYFQQWTSJMREK-UHFFFAOYSA-N 50599521 CHEMBL5189741 Cholinesterase 12790 ChEMBL 10.7270/Q2HQ43ZT 34752955 Liu, T; Chen, S; Du, J; Xing, S; Li, R; Li, Z Anhui Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599521 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599521&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168282876 482610373 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487184 COc1c(Br)cc(C\C(=N/O)C(=O)NCCc2nc(N)[nH]c2C(O)(Cc2cc(Br)c(OC)c(Br)c2)C(=O)NCCc2cnc(N)[nH]2)cc1Br 50599313 CHEMBL5200837 Cholinesterase 14000 ChEMBL 10.7270/Q2ZW1R0R 36095307 Hendra, R; Salib, MN; Molinski, TF University of Riau http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599313 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599313&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168290193 482610165 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487185 COC1=C(Br)[C@H](O)[C@]2(CC(=NO2)C(N)=O)C=C1Br InChI=1S/C10H10Br2N2O4/c1-17-7-4(11)2-10(8(15)6(7)12)3-5(9(13)16)14-18-10/h2,8,15H,3H2,1H3,(H2,13,16)/t8-,10+/m0/s1 KQYZOOUJAWUDAP-WCBMZHEXSA-N 50599314 CHEMBL5182821 Cholinesterase 15400 ChEMBL 10.7270/Q2ZW1R0R 36095307 Hendra, R; Salib, MN; Molinski, TF University of Riau http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599314 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599314&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10068433 482610166 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487186 COC1=C(Br)[C@H](O)[C@]2(CC(=NO2)C(=O)NCCCc2cnc[nH]2)C=C1Br 50599315 CHEMBL5180215 Cholinesterase >100000 ChEMBL 10.7270/Q2ZW1R0R 36095307 Hendra, R; Salib, MN; Molinski, TF University of Riau http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599315 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599315&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 163049905 482610167 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487187 COC1=C(Br)[C@H](O)[C@]2(CC(=NO2)C(=O)NCCCCCNC(N)=N)C=C1Br InChI=1S/C16H23Br2N5O4/c1-26-12-9(17)7-16(13(24)11(12)18)8-10(23-27-16)14(25)21-5-3-2-4-6-22-15(19)20/h7,13,24H,2-6,8H2,1H3,(H,21,25)(H4,19,20,22)/t13-,16+/m0/s1 GCYSDIFCRYTRFB-XJKSGUPXSA-N 50599316 APLYSINAMISINE II::Aplysinamisine II Cholinesterase 10300 ChEMBL 10.7270/Q2ZW1R0R 36095307 Hendra, R; Salib, MN; Molinski, TF University of Riau http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599316 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599316&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 6712295 482610168 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487188 COC1=C(Br)[C@H](O)[C@]2(CC(=NO2)C(=O)NCCc2cc(Br)c(O)c(Br)c2)C=C1Br InChI=1S/C18H16Br4N2O5/c1-28-15-11(21)6-18(16(26)13(15)22)7-12(24-29-18)17(27)23-3-2-8-4-9(19)14(25)10(20)5-8/h4-6,16,25-26H,2-3,7H2,1H3,(H,23,27)/t16-,18+/m0/s1 AEBCAZWEMFVRHE-FUHWJXTLSA-N 50599317 CHEMBL5184002 Cholinesterase 10700 ChEMBL 10.7270/Q2ZW1R0R 36095307 Hendra, R; Salib, MN; Molinski, TF University of Riau http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599317 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599317&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10372186 482610169 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487189 COC1=C(Br)[C@H](O)[C@]2(CC(=NO2)C(=O)NCCc2cc(Br)c(OCCC(C([O-])=O)[N+](C)(C)C)c(Br)c2)C=C1Br InChI=1S/C25H29Br4N3O7/c1-32(2,3)18(24(35)36)6-8-38-20-14(26)9-13(10-15(20)27)5-7-30-23(34)17-12-25(39-31-17)11-16(28)21(37-4)19(29)22(25)33/h9-11,18,22,33H,5-8,12H2,1-4H3,(H-,30,34,35,36)/t18?,22-,25+/m0/s1 ZKNRYKRVFBEUOU-CHATWSTOSA-N 50599318 CHEMBL5191097 Cholinesterase 10000 ChEMBL 10.7270/Q2ZW1R0R 36095307 Hendra, R; Salib, MN; Molinski, TF University of Riau http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599318 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599318&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168288643 482610170 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487190 COc1ccc(C\C(=N/O)C(=O)NCCc2cc(Br)c(OCCCN(C)C)c(Br)c2)cc1Br InChI=1S/C23H28Br3N3O4/c1-29(2)9-4-10-33-22-18(25)12-16(13-19(22)26)7-8-27-23(30)20(28-31)14-15-5-6-21(32-3)17(24)11-15/h5-6,11-13,31H,4,7-10,14H2,1-3H3,(H,27,30)/b28-20+ RCOAHKXJTMBQLI-VFCFBJKWSA-N 50599319 Aplysamine-2::CHEMBL2062972 Cholinesterase 1030 ChEMBL 10.7270/Q2ZW1R0R 36095307 Hendra, R; Salib, MN; Molinski, TF University of Riau http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599319 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599319&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 6399301 482610171 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487191 CNCCCOc1c(Br)cc(CCNC(=O)C(\Cc2ccc(OC)c(Br)c2)=N\O)cc1Br InChI=1S/C22H26Br3N3O4/c1-26-7-3-9-32-21-17(24)11-15(12-18(21)25)6-8-27-22(29)19(28-30)13-14-4-5-20(31-2)16(23)10-14/h4-5,10-12,26,30H,3,6-9,13H2,1-2H3,(H,27,29)/b28-19+ QNWJAZMBGXECMI-TURZUDJPSA-N 50599320 PURPUREAMINE I::Purpuramine-1::Purpureamine I Cholinesterase 2710 ChEMBL 10.7270/Q2ZW1R0R 36095307 Hendra, R; Salib, MN; Molinski, TF University of Riau http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599320 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599320&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11764681 482610172 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487192 COC1=C(Br)[C@H](O)[C@]2(CC(=NO2)C(=O)NCCCOc2c(Br)cc(C[C@H](N)C(O)=O)cc2Br)C=C1Br InChI=1S/C22H23Br4N3O7/c1-34-18-13(25)8-22(19(30)16(18)26)9-15(29-36-22)20(31)28-3-2-4-35-17-11(23)5-10(6-12(17)24)7-14(27)21(32)33/h5-6,8,14,19,30H,2-4,7,9,27H2,1H3,(H,28,31)(H,32,33)/t14-,19-,22+/m0/s1 RPGUXLHCNCEFRX-OSGPJOMKSA-N 50599321 CHEMBL5183798 Cholinesterase >100000 ChEMBL 10.7270/Q2ZW1R0R 36095307 Hendra, R; Salib, MN; Molinski, TF University of Riau http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599321 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599321&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10818923 482610173 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51487193 Br.COc1ccc2CN(C)CC[C@@]34C=C[C@@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3.BrH/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17;/h3-6,12,14,19H,7-10H2,1-2H3;1H/t12-,14+,17+;/m1./s1 QORVDGQLPPAFRS-SKUTZOOXSA-N 50599322 CHEMBL5206414 Cholinesterase 19600 ChEMBL 10.7270/Q2ZW1R0R 36095307 Hendra, R; Salib, MN; Molinski, TF University of Riau http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50599322 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50599322&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 121000435 482610174 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51463189 CCN(CCCCOc1ccc(\C=C\C(=O)N2CCc3ccccc3C2)cc1OC)Cc1ccccc1 InChI=1S/C32H38N2O3/c1-3-33(24-27-11-5-4-6-12-27)20-9-10-22-37-30-17-15-26(23-31(30)36-2)16-18-32(35)34-21-19-28-13-7-8-14-29(28)25-34/h4-8,11-18,23H,3,9-10,19-22,24-25H2,1-2H3/b18-16+ CGZGXSZYVAXOGJ-FBMGVBCBSA-N 50590392 CHEMBL5170410 Cholinesterase 8.9 ChEMBL 10.7270/Q2FB56XK 35635955 Sang, Z; Wang, K; Dong, J; Tang, L Guizhou Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50590392 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50590392&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 138454766 482601244 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51463521 OCC1CCN(Cc2ccc(cc2)C(=O)N\N=C\c2ccc(O)cc2)CC1 InChI=1S/C21H25N3O3/c25-15-18-9-11-24(12-10-18)14-17-1-5-19(6-2-17)21(27)23-22-13-16-3-7-20(26)8-4-16/h1-8,13,18,25-26H,9-12,14-15H2,(H,23,27)/b22-13+ FSKSHFLFKMUWNM-LPYMAVHISA-N 50590550 CHEMBL5182677 Cholinesterase >30000 ChEMBL 10.7270/Q2028WHT 35930852 Macedo Vaz, S; de Freitas Silva, M; Dos Reis Rosa Franco, G; Jorge R Guimarães, M; Motta R da Silva, F; Gonçalves Castro, N; Alvim Guedes, I; Dardenne, LE; Amaral Alves, M; Garrett da Costa, R; Beserra Pinheiro, G; Germino Veras, L; Renata Mortari, M; Pruccoli, L; Tarozzi, A; Viegas, C Federal University of Alfenas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50590550 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50590550&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168282065 482601402 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51463522 COc1ccc(\C=N\NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)cc1 InChI=1S/C22H27N3O3/c1-28-21-8-4-17(5-9-21)14-23-24-22(27)20-6-2-18(3-7-20)15-25-12-10-19(16-26)11-13-25/h2-9,14,19,26H,10-13,15-16H2,1H3,(H,24,27)/b23-14+ STJUOXLNLDTWBR-OEAKJJBVSA-N 50590551 CHEMBL5189995 Cholinesterase >30000 ChEMBL 10.7270/Q2028WHT 35930852 Macedo Vaz, S; de Freitas Silva, M; Dos Reis Rosa Franco, G; Jorge R Guimarães, M; Motta R da Silva, F; Gonçalves Castro, N; Alvim Guedes, I; Dardenne, LE; Amaral Alves, M; Garrett da Costa, R; Beserra Pinheiro, G; Germino Veras, L; Renata Mortari, M; Pruccoli, L; Tarozzi, A; Viegas, C Federal University of Alfenas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50590551 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50590551&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168283592 482601403 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51463523 OCC1CCN(Cc2ccc(cc2)C(=O)N\N=C\c2ccc(cc2)N2CCCCC2)CC1 InChI=1S/C26H34N4O2/c31-20-23-12-16-29(17-13-23)19-22-4-8-24(9-5-22)26(32)28-27-18-21-6-10-25(11-7-21)30-14-2-1-3-15-30/h4-11,18,23,31H,1-3,12-17,19-20H2,(H,28,32)/b27-18+ GJSXFHLPQQQFLU-OVVQPSECSA-N 50590552 CHEMBL5170874 Cholinesterase >30000 ChEMBL 10.7270/Q2028WHT 35930852 Macedo Vaz, S; de Freitas Silva, M; Dos Reis Rosa Franco, G; Jorge R Guimarães, M; Motta R da Silva, F; Gonçalves Castro, N; Alvim Guedes, I; Dardenne, LE; Amaral Alves, M; Garrett da Costa, R; Beserra Pinheiro, G; Germino Veras, L; Renata Mortari, M; Pruccoli, L; Tarozzi, A; Viegas, C Federal University of Alfenas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50590552 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50590552&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168270027 482601404 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51463524 OCC1CCN(Cc2ccc(cc2)C(=O)N\N=C\c2cccc(F)c2)CC1 InChI=1S/C21H24FN3O2/c22-20-3-1-2-18(12-20)13-23-24-21(27)19-6-4-16(5-7-19)14-25-10-8-17(15-26)9-11-25/h1-7,12-13,17,26H,8-11,14-15H2,(H,24,27)/b23-13+ GULSLKKCKIXSGB-YDZHTSKRSA-N 50590553 CHEMBL5194995 Cholinesterase >30000 ChEMBL 10.7270/Q2028WHT 35930852 Macedo Vaz, S; de Freitas Silva, M; Dos Reis Rosa Franco, G; Jorge R Guimarães, M; Motta R da Silva, F; Gonçalves Castro, N; Alvim Guedes, I; Dardenne, LE; Amaral Alves, M; Garrett da Costa, R; Beserra Pinheiro, G; Germino Veras, L; Renata Mortari, M; Pruccoli, L; Tarozzi, A; Viegas, C Federal University of Alfenas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50590553 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50590553&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168284703 482601405 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51463525 OCC1CCN(Cc2ccc(cc2)C(=O)N\N=C\c2cccc(Cl)c2)CC1 InChI=1S/C21H24ClN3O2/c22-20-3-1-2-18(12-20)13-23-24-21(27)19-6-4-16(5-7-19)14-25-10-8-17(15-26)9-11-25/h1-7,12-13,17,26H,8-11,14-15H2,(H,24,27)/b23-13+ DZEKKHIAWIWITI-YDZHTSKRSA-N 50590554 CHEMBL5183556 Cholinesterase 49800 ChEMBL 10.7270/Q2028WHT 35930852 Macedo Vaz, S; de Freitas Silva, M; Dos Reis Rosa Franco, G; Jorge R Guimarães, M; Motta R da Silva, F; Gonçalves Castro, N; Alvim Guedes, I; Dardenne, LE; Amaral Alves, M; Garrett da Costa, R; Beserra Pinheiro, G; Germino Veras, L; Renata Mortari, M; Pruccoli, L; Tarozzi, A; Viegas, C Federal University of Alfenas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50590554 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50590554&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168282956 482601406 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51463526 OCC1CCN(Cc2ccc(cc2)C(=O)N\N=C\c2cccc(O)c2)CC1 InChI=1S/C21H25N3O3/c25-15-17-8-10-24(11-9-17)14-16-4-6-19(7-5-16)21(27)23-22-13-18-2-1-3-20(26)12-18/h1-7,12-13,17,25-26H,8-11,14-15H2,(H,23,27)/b22-13+ VVUCGQBSMMXJCL-LPYMAVHISA-N 50590555 CHEMBL5204223 Cholinesterase >30000 ChEMBL 10.7270/Q2028WHT 35930852 Macedo Vaz, S; de Freitas Silva, M; Dos Reis Rosa Franco, G; Jorge R Guimarães, M; Motta R da Silva, F; Gonçalves Castro, N; Alvim Guedes, I; Dardenne, LE; Amaral Alves, M; Garrett da Costa, R; Beserra Pinheiro, G; Germino Veras, L; Renata Mortari, M; Pruccoli, L; Tarozzi, A; Viegas, C Federal University of Alfenas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50590555 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50590555&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168292862 482601407 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51463527 OCC1CCN(Cc2ccc(cc2)C(=O)N\N=C\c2ccccc2F)CC1 InChI=1S/C21H24FN3O2/c22-20-4-2-1-3-19(20)13-23-24-21(27)18-7-5-16(6-8-18)14-25-11-9-17(15-26)10-12-25/h1-8,13,17,26H,9-12,14-15H2,(H,24,27)/b23-13+ KEKZATNXHOEFOZ-YDZHTSKRSA-N 50590556 CHEMBL5181853 Cholinesterase >30000 ChEMBL 10.7270/Q2028WHT 35930852 Macedo Vaz, S; de Freitas Silva, M; Dos Reis Rosa Franco, G; Jorge R Guimarães, M; Motta R da Silva, F; Gonçalves Castro, N; Alvim Guedes, I; Dardenne, LE; Amaral Alves, M; Garrett da Costa, R; Beserra Pinheiro, G; Germino Veras, L; Renata Mortari, M; Pruccoli, L; Tarozzi, A; Viegas, C Federal University of Alfenas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50590556 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50590556&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168273395 482601408 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51463528 OCC1CCN(Cc2ccc(cc2)C(=O)N\N=C\c2ccccc2Cl)CC1 InChI=1S/C21H24ClN3O2/c22-20-4-2-1-3-19(20)13-23-24-21(27)18-7-5-16(6-8-18)14-25-11-9-17(15-26)10-12-25/h1-8,13,17,26H,9-12,14-15H2,(H,24,27)/b23-13+ XPJQKBTVIBTOLP-YDZHTSKRSA-N 50590557 CHEMBL5185822 Cholinesterase 12900 ChEMBL 10.7270/Q2028WHT 35930852 Macedo Vaz, S; de Freitas Silva, M; Dos Reis Rosa Franco, G; Jorge R Guimarães, M; Motta R da Silva, F; Gonçalves Castro, N; Alvim Guedes, I; Dardenne, LE; Amaral Alves, M; Garrett da Costa, R; Beserra Pinheiro, G; Germino Veras, L; Renata Mortari, M; Pruccoli, L; Tarozzi, A; Viegas, C Federal University of Alfenas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50590557 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50590557&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168281413 482601409 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51463529 OCC1CCN(Cc2ccc(cc2)C(=O)N\N=C\c2ccccc2O)CC1 InChI=1S/C21H25N3O3/c25-15-17-9-11-24(12-10-17)14-16-5-7-18(8-6-16)21(27)23-22-13-19-3-1-2-4-20(19)26/h1-8,13,17,25-26H,9-12,14-15H2,(H,23,27)/b22-13+ DRMVBMUIVSMMSH-LPYMAVHISA-N 50590558 CHEMBL5204385 Cholinesterase >30000 ChEMBL 10.7270/Q2028WHT 35930852 Macedo Vaz, S; de Freitas Silva, M; Dos Reis Rosa Franco, G; Jorge R Guimarães, M; Motta R da Silva, F; Gonçalves Castro, N; Alvim Guedes, I; Dardenne, LE; Amaral Alves, M; Garrett da Costa, R; Beserra Pinheiro, G; Germino Veras, L; Renata Mortari, M; Pruccoli, L; Tarozzi, A; Viegas, C Federal University of Alfenas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50590558 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50590558&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168293483 482601410 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51463530 COc1ccccc1\C=N\NC(=O)c1ccc(CN2CCC(CO)CC2)cc1 InChI=1S/C22H27N3O3/c1-28-21-5-3-2-4-20(21)14-23-24-22(27)19-8-6-17(7-9-19)15-25-12-10-18(16-26)11-13-25/h2-9,14,18,26H,10-13,15-16H2,1H3,(H,24,27)/b23-14+ WQBKWYZZOSUFDL-OEAKJJBVSA-N 50590559 CHEMBL5186170 Cholinesterase 12900 ChEMBL 10.7270/Q2028WHT 35930852 Macedo Vaz, S; de Freitas Silva, M; Dos Reis Rosa Franco, G; Jorge R Guimarães, M; Motta R da Silva, F; Gonçalves Castro, N; Alvim Guedes, I; Dardenne, LE; Amaral Alves, M; Garrett da Costa, R; Beserra Pinheiro, G; Germino Veras, L; Renata Mortari, M; Pruccoli, L; Tarozzi, A; Viegas, C Federal University of Alfenas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50590559 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50590559&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168279608 482601411 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51463531 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 4700 ChEMBL 10.7270/Q2028WHT 35930852 Macedo Vaz, S; de Freitas Silva, M; Dos Reis Rosa Franco, G; Jorge R Guimarães, M; Motta R da Silva, F; Gonçalves Castro, N; Alvim Guedes, I; Dardenne, LE; Amaral Alves, M; Garrett da Costa, R; Beserra Pinheiro, G; Germino Veras, L; Renata Mortari, M; Pruccoli, L; Tarozzi, A; Viegas, C Federal University of Alfenas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51463352 C=CCn1nnc2ccc3sccc3c12 InChI=1S/C11H9N3S/c1-2-6-14-11-8-5-7-15-10(8)4-3-9(11)12-13-14/h2-5,7H,1,6H2 RHIQLDKYIXLGLF-UHFFFAOYSA-N 50590465 CHEMBL5205870 Cholinesterase 3800 ChEMBL 10.7270/Q24T6PB5 35870364 Mlakić, M; Odak, I; Faraho, I; Talić, S; Bosnar, M; Lasić, K; Barić, D; Škorić, I University of Zagreb http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50590465 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50590465&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168297171 482601317 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51463353 CCCn1cc(\C=C/c2cccs2)nn1 InChI=1S/C11H13N3S/c1-2-7-14-9-10(12-13-14)5-6-11-4-3-8-15-11/h3-6,8-9H,2,7H2,1H3/b6-5- LUCQLBIYRQJFBS-WAYWQWQTSA-N 50590466 CHEMBL5208828 Cholinesterase 95600 ChEMBL 10.7270/Q24T6PB5 35870364 Mlakić, M; Odak, I; Faraho, I; Talić, S; Bosnar, M; Lasić, K; Barić, D; Škorić, I University of Zagreb http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50590466 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50590466&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168296645 482601318 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51463354 CCCn1cc(\C=C\c2cccs2)nn1 InChI=1S/C11H13N3S/c1-2-7-14-9-10(12-13-14)5-6-11-4-3-8-15-11/h3-6,8-9H,2,7H2,1H3/b6-5+ LUCQLBIYRQJFBS-AATRIKPKSA-N 50590467 CHEMBL5173306 Cholinesterase 18700 ChEMBL 10.7270/Q24T6PB5 35870364 Mlakić, M; Odak, I; Faraho, I; Talić, S; Bosnar, M; Lasić, K; Barić, D; Škorić, I University of Zagreb http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50590467 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50590467&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168276017 482601319 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51463355 C(Cn1cc(\C=C/c2cccs2)nn1)c1cc2ccccc2[nH]1 InChI=1S/C18H16N4S/c1-2-6-18-14(4-1)12-15(19-18)9-10-22-13-16(20-21-22)7-8-17-5-3-11-23-17/h1-8,11-13,19H,9-10H2/b8-7- BZUNDWZFMWMFKI-FPLPWBNLSA-N 50590468 CHEMBL5178427 Cholinesterase 233700 ChEMBL 10.7270/Q24T6PB5 35870364 Mlakić, M; Odak, I; Faraho, I; Talić, S; Bosnar, M; Lasić, K; Barić, D; Škorić, I University of Zagreb http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50590468 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50590468&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168272228 482601320 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51463356 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase 7900 ChEMBL 10.7270/Q24T6PB5 35870364 Mlakić, M; Odak, I; Faraho, I; Talić, S; Bosnar, M; Lasić, K; Barić, D; Škorić, I University of Zagreb http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51463357 CCCn1nnc2ccc3sccc3c12 InChI=1S/C11H11N3S/c1-2-6-14-11-8-5-7-15-10(8)4-3-9(11)12-13-14/h3-5,7H,2,6H2,1H3 TWPANNQWCOLJDD-UHFFFAOYSA-N 50590469 CHEMBL5169582 Cholinesterase 48800 ChEMBL 10.7270/Q24T6PB5 35870364 Mlakić, M; Odak, I; Faraho, I; Talić, S; Bosnar, M; Lasić, K; Barić, D; Škorić, I University of Zagreb http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50590469 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50590469&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168270377 482601321 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51463358 [O-][N+](=O)c1ccc(cc1)-n1nnc2ccc3sccc3c12 InChI=1S/C14H8N4O2S/c19-18(20)10-3-1-9(2-4-10)17-14-11-7-8-21-13(11)6-5-12(14)15-16-17/h1-8H DNRYPWZSSJFUSS-UHFFFAOYSA-N 50590470 CHEMBL5176006 Cholinesterase 449400 ChEMBL 10.7270/Q24T6PB5 35870364 Mlakić, M; Odak, I; Faraho, I; Talić, S; Bosnar, M; Lasić, K; Barić, D; Škorić, I University of Zagreb http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50590470 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50590470&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168272094 482601322 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51463519 OCC1CCN(Cc2ccc(cc2)C(=O)N\N=C\c2ccc(F)cc2)CC1 InChI=1S/C21H24FN3O2/c22-20-7-3-16(4-8-20)13-23-24-21(27)19-5-1-17(2-6-19)14-25-11-9-18(15-26)10-12-25/h1-8,13,18,26H,9-12,14-15H2,(H,24,27)/b23-13+ LKLDBZGCNTWFJM-YDZHTSKRSA-N 50590548 CHEMBL5197697 Cholinesterase >30000 ChEMBL 10.7270/Q2028WHT 35930852 Macedo Vaz, S; de Freitas Silva, M; Dos Reis Rosa Franco, G; Jorge R Guimarães, M; Motta R da Silva, F; Gonçalves Castro, N; Alvim Guedes, I; Dardenne, LE; Amaral Alves, M; Garrett da Costa, R; Beserra Pinheiro, G; Germino Veras, L; Renata Mortari, M; Pruccoli, L; Tarozzi, A; Viegas, C Federal University of Alfenas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50590548 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50590548&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168288192 482601400 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51463520 OCC1CCN(Cc2ccc(cc2)C(=O)N\N=C\c2ccc(Cl)cc2)CC1 InChI=1S/C21H24ClN3O2/c22-20-7-3-16(4-8-20)13-23-24-21(27)19-5-1-17(2-6-19)14-25-11-9-18(15-26)10-12-25/h1-8,13,18,26H,9-12,14-15H2,(H,24,27)/b23-13+ GBCKWGVZGJBNEH-YDZHTSKRSA-N 50590549 CHEMBL5175519 Cholinesterase >30000 ChEMBL 10.7270/Q2028WHT 35930852 Macedo Vaz, S; de Freitas Silva, M; Dos Reis Rosa Franco, G; Jorge R Guimarães, M; Motta R da Silva, F; Gonçalves Castro, N; Alvim Guedes, I; Dardenne, LE; Amaral Alves, M; Garrett da Costa, R; Beserra Pinheiro, G; Germino Veras, L; Renata Mortari, M; Pruccoli, L; Tarozzi, A; Viegas, C Federal University of Alfenas http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50590549 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50590549&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168272517 482601401 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51485024 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 35400 ChEMBL 10.7270/Q2K0789W 35689855 Liu, J; Liu, L; Zheng, L; Feng, KW; Wang, HT; Xu, JP; Zhou, ZZ Southern Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51485025 COc1cc2CC(Cc3cccnc3)C(=O)c2cc1OCCN1CCCCC1 InChI=1S/C23H28N2O3/c1-27-21-14-18-13-19(12-17-6-5-7-24-16-17)23(26)20(18)15-22(21)28-11-10-25-8-3-2-4-9-25/h5-7,14-16,19H,2-4,8-13H2,1H3 OUWASZTUNZDMFL-UHFFFAOYSA-N 50598481 CHEMBL5193506 Cholinesterase 36900 ChEMBL 10.7270/Q2K0789W 35689855 Liu, J; Liu, L; Zheng, L; Feng, KW; Wang, HT; Xu, JP; Zhou, ZZ Southern Medical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50598481 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50598481&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164517091 482609333 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51456043 COc1cc(\C=C\C(=O)NCCC2CCN(Cc3ccccc3)CC2)ccc1O InChI=1S/C24H30N2O3/c1-29-23-17-20(7-9-22(23)27)8-10-24(28)25-14-11-19-12-15-26(16-13-19)18-21-5-3-2-4-6-21/h2-10,17,19,27H,11-16,18H2,1H3,(H,25,28)/b10-8+ MDBSJGXOQHYGEI-CSKARUKUSA-N 50195819 CHEMBL3818089 Cholinesterase 1220 ChEMBL 10.7270/Q2PR80XJ 33662757 Singh, YP; Rai, H; Singh, G; Singh, GK; Mishra, S; Kumar, S; Srikrishna, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50195819 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50195819&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127049730 375977259 CHEMBL3818089 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51456044 COc1ccc(\C=C\C(=O)NCCC2CCN(Cc3ccccc3)CC2)cc1O InChI=1S/C24H30N2O3/c1-29-23-9-7-20(17-22(23)27)8-10-24(28)25-14-11-19-12-15-26(16-13-19)18-21-5-3-2-4-6-21/h2-10,17,19,27H,11-16,18H2,1H3,(H,25,28)/b10-8+ ARNJIILWEVFCOO-CSKARUKUSA-N 50587739 CHEMBL3818086 Cholinesterase 2470 ChEMBL 10.7270/Q2PR80XJ 33662757 Singh, YP; Rai, H; Singh, G; Singh, GK; Mishra, S; Kumar, S; Srikrishna, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50587739 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50587739&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127049731 482598591 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51456045 COc1cc(\C=C\C(=O)NCCC2CCN(Cc3ccccc3)CC2)cc(OC)c1O InChI=1S/C25H32N2O4/c1-30-22-16-21(17-23(31-2)25(22)29)8-9-24(28)26-13-10-19-11-14-27(15-12-19)18-20-6-4-3-5-7-20/h3-9,16-17,19,29H,10-15,18H2,1-2H3,(H,26,28)/b9-8+ GXZHJSKUOGHRTO-CMDGGOBGSA-N 50587740 CHEMBL3819231 Cholinesterase 970 ChEMBL 10.7270/Q2PR80XJ 33662757 Singh, YP; Rai, H; Singh, G; Singh, GK; Mishra, S; Kumar, S; Srikrishna, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50587740 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50587740&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 127048749 482598592 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51456046 COc1ccc2[nH]cc(CCNC(=O)CN(CCC3CCN(Cc4ccccc4)CC3)C(=O)\C=C\c3ccc(O)c(OC)c3)c2c1 InChI=1S/C37H44N4O5/c1-45-31-10-11-33-32(23-31)30(24-39-33)14-18-38-36(43)26-41(37(44)13-9-28-8-12-34(42)35(22-28)46-2)21-17-27-15-19-40(20-16-27)25-29-6-4-3-5-7-29/h3-13,22-24,27,39,42H,14-21,25-26H2,1-2H3,(H,38,43)/b13-9+ YVKJKOIRYVRHGO-UKTHLTGXSA-N 50510839 CHEMBL4536838 Cholinesterase 10 ChEMBL 10.7270/Q2PR80XJ 33662757 Singh, YP; Rai, H; Singh, G; Singh, GK; Mishra, S; Kumar, S; Srikrishna, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50510839 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50510839&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155548207 440719421 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51456047 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 2057 ChEMBL 10.7270/Q2PR80XJ 33662757 Singh, YP; Rai, H; Singh, G; Singh, GK; Mishra, S; Kumar, S; Srikrishna, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51456059 COc1cc(\C=C\C(=O)N2CCc3ccccc3C2)ccc1OCCCCN(CNCc1ccccc1)CNCc1ccccc1 InChI=1S/C39H46N4O3/c1-45-38-26-32(19-21-39(44)43-24-22-35-16-8-9-17-36(35)29-43)18-20-37(38)46-25-11-10-23-42(30-40-27-33-12-4-2-5-13-33)31-41-28-34-14-6-3-7-15-34/h2-9,12-21,26,40-41H,10-11,22-25,27-31H2,1H3/b21-19+ SRWMCJXGMSTNHF-XUTLUUPISA-N 50587745 CHEMBL5200969 Cholinesterase 8930 ChEMBL 10.7270/Q2PR80XJ 33662757 Singh, YP; Rai, H; Singh, G; Singh, GK; Mishra, S; Kumar, S; Srikrishna, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50587745 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50587745&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168291378 482598597 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51456067 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 1980 ChEMBL 10.7270/Q2PR80XJ 33662757 Singh, YP; Rai, H; Singh, G; Singh, GK; Mishra, S; Kumar, S; Srikrishna, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51456068 CS([O-])(=O)=O.Oc1cc(\C=C\C(=O)NCCCCCC[P+](c2ccccc2)(c2ccccc2)c2ccccc2)cc(O)c1O InChI=1S/C33H34NO4P.CH4O3S/c35-30-24-26(25-31(36)33(30)38)20-21-32(37)34-22-12-1-2-13-23-39(27-14-6-3-7-15-27,28-16-8-4-9-17-28)29-18-10-5-11-19-29;1-5(2,3)4/h3-11,14-21,24-25H,1-2,12-13,22-23H2,(H3-,34,35,36,37,38);1H3,(H,2,3,4) VUGFCAQRAGTWLF-UHFFFAOYSA-N 50587750 CHEMBL4087621 Cholinesterase 110 ChEMBL 10.7270/Q2PR80XJ 33662757 Singh, YP; Rai, H; Singh, G; Singh, GK; Mishra, S; Kumar, S; Srikrishna, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50587750 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50587750&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137644852 482598602 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51456069 CS([O-])(=O)=O.Oc1ccc(\C=C\C(=O)NCCCCCC[P+](c2ccccc2)(c2ccccc2)c2ccccc2)cc1O InChI=1S/C33H34NO3P.CH4O3S/c35-31-22-20-27(26-32(31)36)21-23-33(37)34-24-12-1-2-13-25-38(28-14-6-3-7-15-28,29-16-8-4-9-17-29)30-18-10-5-11-19-30;1-5(2,3)4/h3-11,14-23,26H,1-2,12-13,24-25H2,(H2-,34,35,36,37);1H3,(H,2,3,4) GBBQRIPKVMMHGC-UHFFFAOYSA-N 50587751 CHEMBL4096250 Cholinesterase 150 ChEMBL 10.7270/Q2PR80XJ 33662757 Singh, YP; Rai, H; Singh, G; Singh, GK; Mishra, S; Kumar, S; Srikrishna, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50587751 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50587751&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137655718 482598603 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51456083 [Br-].COc1ccc(\C=C\C(=O)Nc2cc[n+](Cc3cccc(F)c3)cc2)cc1OC InChI=1S/C23H21FN2O3.BrH/c1-28-21-8-6-17(15-22(21)29-2)7-9-23(27)25-20-10-12-26(13-11-20)16-18-4-3-5-19(24)14-18;/h3-15H,16H2,1-2H3;1H/b9-7+; JYOKZRSSHWDBAN-BXTVWIJMSA-N 50587755 CHEMBL5171929 Cholinesterase 3.1 ChEMBL 10.7270/Q2PR80XJ 33662757 Singh, YP; Rai, H; Singh, G; Singh, GK; Mishra, S; Kumar, S; Srikrishna, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50587755 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50587755&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168270509 482598607 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51456084 [Br-].COc1ccc(\C=C\C(=O)Nc2cc[n+](Cc3ccc(F)cc3)cc2)cc1OC InChI=1S/C23H21FN2O3.BrH/c1-28-21-9-5-17(15-22(21)29-2)6-10-23(27)25-20-11-13-26(14-12-20)16-18-3-7-19(24)8-4-18;/h3-15H,16H2,1-2H3;1H/b10-6+; GTNZQLOSWVNPEP-AAGWESIMSA-N 50587756 CHEMBL5206601 Cholinesterase 2.6 ChEMBL 10.7270/Q2PR80XJ 33662757 Singh, YP; Rai, H; Singh, G; Singh, GK; Mishra, S; Kumar, S; Srikrishna, S; Modi, G Indian Institute of Technology (Banaras Hindu University) http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50587756 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50587756&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 155293041 482598608 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51471340 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 23 ChEMBL 10.7270/Q2C82F8H 35303485 Sun, X; Wang, Y; Lei, Z; Yue, S; Chen, L; Sun, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51471341 CC1CCCCN1CCCCOc1cc2C(=O)c3ccccc3-c3nccc(c1)c23 InChI=1S/C26H28N2O2/c1-18-8-4-5-13-28(18)14-6-7-15-30-20-16-19-11-12-27-25-21-9-2-3-10-22(21)26(29)23(17-20)24(19)25/h2-3,9-12,16-18H,4-8,13-15H2,1H3 HVLZKNWEYCJMJK-UHFFFAOYSA-N 50593613 CHEMBL5202300 Cholinesterase 4150 ChEMBL 10.7270/Q2C82F8H 35303485 Sun, X; Wang, Y; Lei, Z; Yue, S; Chen, L; Sun, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50593613 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50593613&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 163196412 482604465 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51471342 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 6410 ChEMBL 10.7270/Q2C82F8H 35303485 Sun, X; Wang, Y; Lei, Z; Yue, S; Chen, L; Sun, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51471343 O=C1c2ccccc2-c2nccc3cc(OCCN4CCCCC4)cc1c23 InChI=1S/C23H22N2O2/c26-23-19-7-3-2-6-18(19)22-21-16(8-9-24-22)14-17(15-20(21)23)27-13-12-25-10-4-1-5-11-25/h2-3,6-9,14-15H,1,4-5,10-13H2 CSMDIFSZWIBJES-UHFFFAOYSA-N 50593620 CHEMBL5207977 Cholinesterase 6708 ChEMBL 10.7270/Q2C82F8H 35303485 Sun, X; Wang, Y; Lei, Z; Yue, S; Chen, L; Sun, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50593620 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50593620&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168296573 482604472 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51471344 O=C1c2ccccc2-c2nccc3cc(OCCCCN4CCCCC4)cc1c23 InChI=1S/C25H26N2O2/c28-25-21-9-3-2-8-20(21)24-23-18(10-11-26-24)16-19(17-22(23)25)29-15-7-6-14-27-12-4-1-5-13-27/h2-3,8-11,16-17H,1,4-7,12-15H2 KNPJYIRAQOAJDZ-UHFFFAOYSA-N 50593611 CHEMBL5173554 Cholinesterase 15390 ChEMBL 10.7270/Q2C82F8H 35303485 Sun, X; Wang, Y; Lei, Z; Yue, S; Chen, L; Sun, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50593611 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50593611&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168271531 482604463 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51471345 CC1CCCCN1CCCOc1cc2C(=O)c3ccccc3-c3nccc(c1)c23 InChI=1S/C25H26N2O2/c1-17-7-4-5-12-27(17)13-6-14-29-19-15-18-10-11-26-24-20-8-2-3-9-21(20)25(28)22(16-19)23(18)24/h2-3,8-11,15-17H,4-7,12-14H2,1H3 DZAQBPFDHYWLGZ-UHFFFAOYSA-N 50593609 CHEMBL5188969 Cholinesterase 19680 ChEMBL 10.7270/Q2C82F8H 35303485 Sun, X; Wang, Y; Lei, Z; Yue, S; Chen, L; Sun, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50593609 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50593609&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168280056 482604461 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51471346 O=C1c2ccccc2-c2nccc3cc(OCCCN4CCCCC4)cc1c23 InChI=1S/C24H24N2O2/c27-24-20-8-3-2-7-19(20)23-22-17(9-10-25-23)15-18(16-21(22)24)28-14-6-13-26-11-4-1-5-12-26/h2-3,7-10,15-16H,1,4-6,11-14H2 VUWQPPDEVQRNNY-UHFFFAOYSA-N 50593610 CHEMBL5169721 Cholinesterase 35260 ChEMBL 10.7270/Q2C82F8H 35303485 Sun, X; Wang, Y; Lei, Z; Yue, S; Chen, L; Sun, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50593610 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50593610&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168269954 482604462 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51471347 O=C1c2ccccc2-c2nccc3cc(OCCN4CCOCC4)cc1c23 InChI=1S/C22H20N2O3/c25-22-18-4-2-1-3-17(18)21-20-15(5-6-23-21)13-16(14-19(20)22)27-12-9-24-7-10-26-11-8-24/h1-6,13-14H,7-12H2 PVZNAGOIKGNGJW-UHFFFAOYSA-N 50593623 CHEMBL5194349 Cholinesterase >100000 ChEMBL 10.7270/Q2C82F8H 35303485 Sun, X; Wang, Y; Lei, Z; Yue, S; Chen, L; Sun, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50593623 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50593623&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168286227 482604475 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51471348 CN1CCN(CCOc2cc3C(=O)c4ccccc4-c4nccc(c2)c34)CC1 InChI=1S/C23H23N3O2/c1-25-8-10-26(11-9-25)12-13-28-17-14-16-6-7-24-22-18-4-2-3-5-19(18)23(27)20(15-17)21(16)22/h2-7,14-15H,8-13H2,1H3 NIBUWWIMUNKMDX-UHFFFAOYSA-N 50593616 CHEMBL5196023 Cholinesterase >100000 ChEMBL 10.7270/Q2C82F8H 35303485 Sun, X; Wang, Y; Lei, Z; Yue, S; Chen, L; Sun, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50593616 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50593616&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168284745 482604468 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51471349 CC1CCCCN1CCOc1cc2C(=O)c3ccccc3-c3nccc(c1)c23 InChI=1S/C24H24N2O2/c1-16-6-4-5-11-26(16)12-13-28-18-14-17-9-10-25-23-19-7-2-3-8-20(19)24(27)21(15-18)22(17)23/h2-3,7-10,14-16H,4-6,11-13H2,1H3 PUSYJAGJTSJECQ-UHFFFAOYSA-N 50593618 CHEMBL5207896 Cholinesterase >100000 ChEMBL 10.7270/Q2C82F8H 35303485 Sun, X; Wang, Y; Lei, Z; Yue, S; Chen, L; Sun, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50593618 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50593618&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168294667 482604470 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51471350 OCCN1CCN(CCOc2cc3C(=O)c4ccccc4-c4nccc(c2)c34)CC1 InChI=1S/C24H25N3O3/c28-13-11-26-7-9-27(10-8-26)12-14-30-18-15-17-5-6-25-23-19-3-1-2-4-20(19)24(29)21(16-18)22(17)23/h1-6,15-16,28H,7-14H2 CTCXSJUUSGIYON-UHFFFAOYSA-N 50593614 CHEMBL5207960 Cholinesterase >100000 ChEMBL 10.7270/Q2C82F8H 35303485 Sun, X; Wang, Y; Lei, Z; Yue, S; Chen, L; Sun, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50593614 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50593614&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168296103 482604466 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51471351 O=C1c2ccccc2-c2nccc3cc(OCCCN4CCOCC4)cc1c23 InChI=1S/C23H22N2O3/c26-23-19-5-2-1-4-18(19)22-21-16(6-7-24-22)14-17(15-20(21)23)28-11-3-8-25-9-12-27-13-10-25/h1-2,4-7,14-15H,3,8-13H2 QUAOFNAKUHMGEN-UHFFFAOYSA-N 50593622 CHEMBL5172057 Cholinesterase >100000 ChEMBL 10.7270/Q2C82F8H 35303485 Sun, X; Wang, Y; Lei, Z; Yue, S; Chen, L; Sun, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50593622 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50593622&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168270811 482604474 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51471352 CN1CCN(CCCOc2cc3C(=O)c4ccccc4-c4nccc(c2)c34)CC1 InChI=1S/C24H25N3O2/c1-26-10-12-27(13-11-26)9-4-14-29-18-15-17-7-8-25-23-19-5-2-3-6-20(19)24(28)21(16-18)22(17)23/h2-3,5-8,15-16H,4,9-14H2,1H3 OIWWPZKJWVJFQR-UHFFFAOYSA-N 50593615 CHEMBL5208187 Cholinesterase >100000 ChEMBL 10.7270/Q2C82F8H 35303485 Sun, X; Wang, Y; Lei, Z; Yue, S; Chen, L; Sun, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50593615 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50593615&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168296312 482604467 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51471353 OCCN1CCN(CCCOc2cc3C(=O)c4ccccc4-c4nccc(c2)c34)CC1 InChI=1S/C25H27N3O3/c29-14-13-28-11-9-27(10-12-28)8-3-15-31-19-16-18-6-7-26-24-20-4-1-2-5-21(20)25(30)22(17-19)23(18)24/h1-2,4-7,16-17,29H,3,8-15H2 CSYOPCOOJYZQHT-UHFFFAOYSA-N 50593612 CHEMBL5179508 Cholinesterase >100000 ChEMBL 10.7270/Q2C82F8H 35303485 Sun, X; Wang, Y; Lei, Z; Yue, S; Chen, L; Sun, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50593612 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50593612&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168272268 482604464 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51471354 O=C1c2ccccc2-c2nccc3cc(OCCCCN4CCOCC4)cc1c23 InChI=1S/C24H24N2O3/c27-24-20-6-2-1-5-19(20)23-22-17(7-8-25-23)15-18(16-21(22)24)29-12-4-3-9-26-10-13-28-14-11-26/h1-2,5-8,15-16H,3-4,9-14H2 VKCWLVSRCZEZGF-UHFFFAOYSA-N 50593621 CHEMBL5180026 Cholinesterase >100000 ChEMBL 10.7270/Q2C82F8H 35303485 Sun, X; Wang, Y; Lei, Z; Yue, S; Chen, L; Sun, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50593621 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50593621&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168272778 482604473 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51471355 CN1CCN(CCCCOc2cc3C(=O)c4ccccc4-c4nccc(c2)c34)CC1 InChI=1S/C25H27N3O2/c1-27-11-13-28(14-12-27)10-4-5-15-30-19-16-18-8-9-26-24-20-6-2-3-7-21(20)25(29)22(17-19)23(18)24/h2-3,6-9,16-17H,4-5,10-15H2,1H3 OHDNWGYICAQWLV-UHFFFAOYSA-N 50593619 CHEMBL5183796 Cholinesterase >100000 ChEMBL 10.7270/Q2C82F8H 35303485 Sun, X; Wang, Y; Lei, Z; Yue, S; Chen, L; Sun, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50593619 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50593619&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168281306 482604471 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51471356 OCCN1CCN(CCCCOc2cc3C(=O)c4ccccc4-c4nccc(c2)c34)CC1 InChI=1S/C26H29N3O3/c30-15-14-29-12-10-28(11-13-29)9-3-4-16-32-20-17-19-7-8-27-25-21-5-1-2-6-22(21)26(31)23(18-20)24(19)25/h1-2,5-8,17-18,30H,3-4,9-16H2 GATFYHVVSKIMAF-UHFFFAOYSA-N 50593617 CHEMBL5190236 Cholinesterase >100000 ChEMBL 10.7270/Q2C82F8H 35303485 Sun, X; Wang, Y; Lei, Z; Yue, S; Chen, L; Sun, J China Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50593617 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50593617&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168284017 482604469 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51474186 CC(C)CC1(CC(C)C)NC(=O)c2ccccc2N1Cc1ccc(Cl)cc1 InChI=1S/C23H29ClN2O/c1-16(2)13-23(14-17(3)4)25-22(27)20-7-5-6-8-21(20)26(23)15-18-9-11-19(24)12-10-18/h5-12,16-17H,13-15H2,1-4H3,(H,25,27) AIWCEXVSFHVQKB-UHFFFAOYSA-N 226151 1-(4-Chloro-benzyl)-2,2-diisobutyl-2,3-dihydro-1H-quinazolin-4-one (2af) Cholinesterase 1560 ChEMBL 10.7270/Q2M90DP7 34742016 Haghighijoo, Z; Zamani, L; Moosavi, F; Emami, S University of Louisiana at Lafayette http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=226151 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=226151&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 126962549 336293299 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51474187 CC(C)CC1(CC(C)C)NC(=O)c2ccccc2N1Cc1ccccc1 InChI=1S/C23H30N2O/c1-17(2)14-23(15-18(3)4)24-22(26)20-12-8-9-13-21(20)25(23)16-19-10-6-5-7-11-19/h5-13,17-18H,14-16H2,1-4H3,(H,24,26) AQKIDJVVDJFWLH-UHFFFAOYSA-N 226149 1-Benzyl-2,2-diisobutyl-2,3-dihydro-1Hquinazolin-4-one (2ad) Cholinesterase 2480 ChEMBL 10.7270/Q2M90DP7 34742016 Haghighijoo, Z; Zamani, L; Moosavi, F; Emami, S University of Louisiana at Lafayette http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=226149 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=226149&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 126962547 336293297 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51474188 CC1(NC(=O)c2cc(Br)cc(Br)c2N1)c1ccc(Cl)cc1 InChI=1S/C15H11Br2ClN2O/c1-15(8-2-4-10(18)5-3-8)19-13-11(14(21)20-15)6-9(16)7-12(13)17/h2-7,19H,1H3,(H,20,21) VSNBBSQPTGOIQF-UHFFFAOYSA-N 50594697 CHEMBL5187741 Cholinesterase 3700 ChEMBL 10.7270/Q2M90DP7 34742016 Haghighijoo, Z; Zamani, L; Moosavi, F; Emami, S University of Louisiana at Lafayette http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50594697 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50594697&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168283139 482605549 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51474275 C(COc1ccc2N=C3N(Cc4ccccc34)Cc2c1)CN1CCCCC1 InChI=1S/C23H27N3O/c1-4-11-25(12-5-1)13-6-14-27-20-9-10-22-19(15-20)17-26-16-18-7-2-3-8-21(18)23(26)24-22/h2-3,7-10,15H,1,4-6,11-14,16-17H2 ODPBEOCHSYLAAK-UHFFFAOYSA-N 50594711 CHEMBL5208529 Cholinesterase 4140 ChEMBL 10.7270/Q2M90DP7 34742016 Haghighijoo, Z; Zamani, L; Moosavi, F; Emami, S University of Louisiana at Lafayette http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50594711 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50594711&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168297919 482605563 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51474276 C(COc1ccc2N=C3N(CCc4ccccc34)Cc2c1)CN1CCCCC1 InChI=1S/C24H29N3O/c1-4-12-26(13-5-1)14-6-16-28-21-9-10-23-20(17-21)18-27-15-11-19-7-2-3-8-22(19)24(27)25-23/h2-3,7-10,17H,1,4-6,11-16,18H2 UHOTUSHGWTWEAM-UHFFFAOYSA-N 50594712 CHEMBL5181664 Cholinesterase 955 ChEMBL 10.7270/Q2M90DP7 34742016 Haghighijoo, Z; Zamani, L; Moosavi, F; Emami, S University of Louisiana at Lafayette http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50594712 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50594712&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168277527 482605564 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51474277 C(COc1ccc2N=C3N(Cc2c1)CCCc1ccccc31)CN1CCCCC1 InChI=1S/C25H31N3O/c1-4-13-27(14-5-1)15-7-17-29-22-11-12-24-21(18-22)19-28-16-6-9-20-8-2-3-10-23(20)25(28)26-24/h2-3,8,10-12,18H,1,4-7,9,13-17,19H2 GVDQRHZTBDTQBI-UHFFFAOYSA-N 50594713 CHEMBL5186753 Cholinesterase 2670 ChEMBL 10.7270/Q2M90DP7 34742016 Haghighijoo, Z; Zamani, L; Moosavi, F; Emami, S University of Louisiana at Lafayette http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50594713 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50594713&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168282696 482605565 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51474278 C(COc1ccc2N=C3CCCN3Cc2c1)CN1CCCCC1 InChI=1S/C19H27N3O/c1-2-9-21(10-3-1)11-5-13-23-17-7-8-18-16(14-17)15-22-12-4-6-19(22)20-18/h7-8,14H,1-6,9-13,15H2 UVYNECUSQBZMSD-UHFFFAOYSA-N 50053435 CHEMBL3323035 Cholinesterase 122 ChEMBL 10.7270/Q2M90DP7 34742016 Haghighijoo, Z; Zamani, L; Moosavi, F; Emami, S University of Louisiana at Lafayette http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50053435 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50053435&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 118710487 103950116 CHEMBL3323035 ZINC03815717 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51474279 C(COc1ccc2N=C3CCCCN3Cc2c1)CN1CCCCC1 InChI=1S/C20H29N3O/c1-3-10-22(11-4-1)12-6-14-24-18-8-9-19-17(15-18)16-23-13-5-2-7-20(23)21-19/h8-9,15H,1-7,10-14,16H2 WHVZYWOSAKGOJG-UHFFFAOYSA-N 50594714 CHEMBL5208725 Cholinesterase 6.6 ChEMBL 10.7270/Q2M90DP7 34742016 Haghighijoo, Z; Zamani, L; Moosavi, F; Emami, S University of Louisiana at Lafayette http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50594714 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50594714&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168294704 482605566 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51474280 C(COc1ccc2N=C3CCCCCN3Cc2c1)CN1CCCCC1 InChI=1S/C21H31N3O/c1-3-8-21-22-20-10-9-19(16-18(20)17-24(21)14-6-1)25-15-7-13-23-11-4-2-5-12-23/h9-10,16H,1-8,11-15,17H2 XJALVWNRLTXILY-UHFFFAOYSA-N 50594715 CHEMBL5201779 Cholinesterase 13 ChEMBL 10.7270/Q2M90DP7 34742016 Haghighijoo, Z; Zamani, L; Moosavi, F; Emami, S University of Louisiana at Lafayette http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50594715 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50594715&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168292111 482605567 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51475837 COc1ccccc1\C=C\C=C(/Br)S(F)(=O)=O InChI=1S/C11H10BrFO3S/c1-16-10-7-3-2-5-9(10)6-4-8-11(12)17(13,14)15/h2-8H,1H3/b6-4+,11-8+ WTWKEUPSPLHYDX-JRRWEWNMSA-N 50595018 CHEMBL5208027 Cholinesterase 21 ChEMBL 10.7270/Q20G3Q5H 35305462 Ahmadi, R; Emami, S Mazandaran University of Medical Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50595018 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50595018&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168297043 482605870 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51475916 O=C(N\N=C\Nc1c2CCCCc2nc2ccccc12)C12CC3CC(CC(C3)C1)C2 InChI=1S/C25H30N4O/c30-24(25-12-16-9-17(13-25)11-18(10-16)14-25)29-27-15-26-23-19-5-1-3-7-21(19)28-22-8-4-2-6-20(22)23/h1,3,5,7,15-18H,2,4,6,8-14H2,(H,29,30)(H,26,27,28) FQZUQHHIRFLQES-UHFFFAOYSA-N 50595056 CHEMBL5197661 Cholinesterase 615 ChEMBL 10.7270/Q2BP06SD 35398739 Kumar, N; Kumar, V; Anand, P; Kumar, V; Ranjan Dwivedi, A; Kumar, V Central University of Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50595056 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50595056&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168287798 482605908 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51475923 CCCN1CCN(CC1)c1ncc(CCN(C)CCCc2ccccc2)s1 InChI=1S/C22H34N4S/c1-3-12-25-15-17-26(18-16-25)22-23-19-21(27-22)11-14-24(2)13-7-10-20-8-5-4-6-9-20/h4-6,8-9,19H,3,7,10-18H2,1-2H3 LHFFBQAOSCEDBC-UHFFFAOYSA-N 50413824 CHEMBL473093 Cholinesterase 14620 ChEMBL 10.7270/Q2BP06SD 35398739 Kumar, N; Kumar, V; Anand, P; Kumar, V; Ranjan Dwivedi, A; Kumar, V Central University of Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50413824 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50413824&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 42604517 163362848 CHEMBL473093 ZINC40900909 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51475926 CCN1CCN(CC1)c1ccc(cc1)-c1nc2ccccc2[nH]1 InChI=1S/C19H22N4/c1-2-22-11-13-23(14-12-22)16-9-7-15(8-10-16)19-20-17-5-3-4-6-18(17)21-19/h3-10H,2,11-14H2,1H3,(H,20,21) MJPUSTKHUHNRCG-UHFFFAOYSA-N 225274 2-[4-(4-Ethylpiperazin-1-yl)phenyl]-1H-benzo[d]imidazole (3b) Cholinesterase 34850 ChEMBL 10.7270/Q2BP06SD 35398739 Kumar, N; Kumar, V; Anand, P; Kumar, V; Ranjan Dwivedi, A; Kumar, V Central University of Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=225274 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=225274&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 126962129 336292469 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51475934 Cc1nc(C)c(nc1C)C(=O)OCCCOC(=O)c1ccccn1 InChI=1S/C17H19N3O4/c1-11-12(2)20-15(13(3)19-11)17(22)24-10-6-9-23-16(21)14-7-4-5-8-18-14/h4-5,7-8H,6,9-10H2,1-3H3 YBHRKLIWOBSYIG-UHFFFAOYSA-N 50595061 CHEMBL5209357 Cholinesterase 3300000 ChEMBL 10.7270/Q2BP06SD 35398739 Kumar, N; Kumar, V; Anand, P; Kumar, V; Ranjan Dwivedi, A; Kumar, V Central University of Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50595061 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50595061&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168296372 482605913 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51475939 [Br-].C(c1ccccc1)[n+]1ccc(cc1)-c1nc2ccccc2s1 InChI=1S/C19H15N2S.BrH/c1-2-6-15(7-3-1)14-21-12-10-16(11-13-21)19-20-17-8-4-5-9-18(17)22-19;/h1-13H,14H2;1H/q+1;/p-1 MMQOFNXZTWAIHR-UHFFFAOYSA-M 50595064 CHEMBL582490::GNF-Pf-3382 Cholinesterase 182 ChEMBL 10.7270/Q2BP06SD 35398739 Kumar, N; Kumar, V; Anand, P; Kumar, V; Ranjan Dwivedi, A; Kumar, V Central University of Punjab http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50595064 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50595064&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44660009 482605916 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50048419 Clc1ccc(Cl)c(c1)C(=O)NCC12CC3CC(CC(C3)C1)C2 InChI=1S/C18H21Cl2NO/c19-14-1-2-16(20)15(6-14)17(22)21-10-18-7-11-3-12(8-18)5-13(4-11)9-18/h1-2,6,11-13H,3-5,7-10H2,(H,21,22) MQAXGMKOSXBMHT-UHFFFAOYSA-N 50404089 CHEMBL5267972 Cholinesterase 12 ChEMBL 10.7270/Q2S46X5T 35434628 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50404089 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50404089&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 18209153 163353113 CHEMBL131162 ZINC13587522 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50052110 O=C(NCCC1CCN(Cc2ccccc2)CC1)c1coc2ccc(OCc3ccccc3)cc2c1=O InChI=1S/C31H32N2O4/c34-30-27-19-26(36-21-25-9-5-2-6-10-25)11-12-29(27)37-22-28(30)31(35)32-16-13-23-14-17-33(18-15-23)20-24-7-3-1-4-8-24/h1-12,19,22-23H,13-18,20-21H2,(H,32,35) TUTKEHICBPHHMG-UHFFFAOYSA-N 50553085 CHEMBL4762982 Cholinesterase 5240 ChEMBL 10.7270/Q2S46X5T 35434628 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50553085 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50553085&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 162660163 461691853 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50057183 COc1ccc(CN(CCN(C)CCCCNC(=O)c2ccc(c(c2)C(O)=O)-c2c3ccc(O)cc3oc3cc(=O)ccc23)c2ccccn2)cc1 InChI=1S/C41H40N4O7/c1-44(21-22-45(38-7-3-4-18-42-38)26-27-8-13-31(51-2)14-9-27)20-6-5-19-43-40(48)28-10-15-32(35(23-28)41(49)50)39-33-16-11-29(46)24-36(33)52-37-25-30(47)12-17-34(37)39/h3-4,7-18,23-25,46H,5-6,19-22,26H2,1-2H3,(H,43,48)(H,49,50) JFFGAZQGKHLJLH-UHFFFAOYSA-N 50404169 CHEMBL5284360 Cholinesterase 700 ChEMBL 10.7270/Q2S46X5T 35434628 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50404169 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50404169&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44274569 163353193 CHEMBL21525 ZINC28244159 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50057184 COc1ccc(CN(CCN(C)CCCCCCCCNC(=O)c2ccc(C(O)=O)c(c2)-c2c3ccc(O)cc3oc3cc(=O)ccc23)c2ccccn2)cc1 InChI=1S/C45H48N4O7/c1-48(25-26-49(42-11-7-9-22-46-42)30-31-12-17-35(55-2)18-13-31)24-10-6-4-3-5-8-23-47-44(52)32-14-19-36(45(53)54)39(27-32)43-37-20-15-33(50)28-40(37)56-41-29-34(51)16-21-38(41)43/h7,9,11-22,27-29,50H,3-6,8,10,23-26,30H2,1-2H3,(H,47,52)(H,53,54) UMNFRBCAPUJRHJ-UHFFFAOYSA-N 50404170 CHEMBL5288064 Cholinesterase 2000 ChEMBL 10.7270/Q2S46X5T 35434628 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50404170 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50404170&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44274583 163353194 CHEMBL277850 ZINC95608233 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497139 O=C(Nc1nccc2c3ccc(cc3[nH]c12)C(=O)NC1CCN(Cc2ccccc2)CC1)C1CC1 InChI=1S/C28H29N5O2/c34-27(19-6-7-19)32-26-25-23(10-13-29-26)22-9-8-20(16-24(22)31-25)28(35)30-21-11-14-33(15-12-21)17-18-4-2-1-3-5-18/h1-5,8-10,13,16,19,21,31H,6-7,11-12,14-15,17H2,(H,30,35)(H,29,32,34) STFZCQCCFVPNQE-UHFFFAOYSA-N 50603098 CHEMBL5193101 Cholinesterase 38780 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603098 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603098&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168288779 482613949 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497140 Cc1ccc(CN2CCC(CC2)NC(=O)c2ccc3c(c2)[nH]c2c(NC(=O)C4CC4)nccc32)cc1 InChI=1S/C29H31N5O2/c1-18-2-4-19(5-3-18)17-34-14-11-22(12-15-34)31-29(36)21-8-9-23-24-10-13-30-27(26(24)32-25(23)16-21)33-28(35)20-6-7-20/h2-5,8-10,13,16,20,22,32H,6-7,11-12,14-15,17H2,1H3,(H,31,36)(H,30,33,35) UVTDQJDUEXMZIB-UHFFFAOYSA-N 50603099 CHEMBL5195062 Cholinesterase >50000 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603099 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603099&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168287562 482613950 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497141 Fc1ccccc1CN1CCC(CC1)NC(=O)c1ccc2c(c1)[nH]c1c(NC(=O)C3CC3)nccc21 InChI=1S/C28H28FN5O2/c29-23-4-2-1-3-19(23)16-34-13-10-20(11-14-34)31-28(36)18-7-8-21-22-9-12-30-26(25(22)32-24(21)15-18)33-27(35)17-5-6-17/h1-4,7-9,12,15,17,20,32H,5-6,10-11,13-14,16H2,(H,31,36)(H,30,33,35) HRRDAKFGCDGSOC-UHFFFAOYSA-N 50603100 CHEMBL5207684 Cholinesterase >50000 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603100 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603100&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168297462 482613951 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497142 Fc1cccc(CN2CCC(CC2)NC(=O)c2ccc3c(c2)[nH]c2c(NC(=O)C4CC4)nccc32)c1 InChI=1S/C28H28FN5O2/c29-20-3-1-2-17(14-20)16-34-12-9-21(10-13-34)31-28(36)19-6-7-22-23-8-11-30-26(25(23)32-24(22)15-19)33-27(35)18-4-5-18/h1-3,6-8,11,14-15,18,21,32H,4-5,9-10,12-13,16H2,(H,31,36)(H,30,33,35) JDHVABVRILQXEP-UHFFFAOYSA-N 50603101 CHEMBL5186590 Cholinesterase >50000 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603101 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603101&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168278625 482613952 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497143 Fc1ccc(CN2CCC(CC2)NC(=O)c2ccc3c(c2)[nH]c2c(NC(=O)C4CC4)nccc32)cc1 InChI=1S/C28H28FN5O2/c29-20-6-1-17(2-7-20)16-34-13-10-21(11-14-34)31-28(36)19-5-8-22-23-9-12-30-26(25(23)32-24(22)15-19)33-27(35)18-3-4-18/h1-2,5-9,12,15,18,21,32H,3-4,10-11,13-14,16H2,(H,31,36)(H,30,33,35) CMAJFWTWVSYOSY-UHFFFAOYSA-N 50603102 CHEMBL5196524 Cholinesterase >50000 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603102 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603102&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168285161 482613953 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497144 Fc1cc(F)cc(CN2CCC(CC2)NC(=O)c2ccc3c(c2)[nH]c2c(NC(=O)C4CC4)nccc32)c1 InChI=1S/C28H27F2N5O2/c29-19-11-16(12-20(30)14-19)15-35-9-6-21(7-10-35)32-28(37)18-3-4-22-23-5-8-31-26(25(23)33-24(22)13-18)34-27(36)17-1-2-17/h3-5,8,11-14,17,21,33H,1-2,6-7,9-10,15H2,(H,32,37)(H,31,34,36) LMLGVRMIEOPIKS-UHFFFAOYSA-N 50603103 CHEMBL5182337 Cholinesterase >50000 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603103 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603103&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168277252 482613954 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497145 [O-][N+](=O)c1cccc(CN2CCC(CC2)NC(=O)c2ccc3c(c2)[nH]c2c(NC(=O)C4CC4)nccc32)c1 InChI=1S/C28H28N6O4/c35-27(18-4-5-18)32-26-25-23(8-11-29-26)22-7-6-19(15-24(22)31-25)28(36)30-20-9-12-33(13-10-20)16-17-2-1-3-21(14-17)34(37)38/h1-3,6-8,11,14-15,18,20,31H,4-5,9-10,12-13,16H2,(H,30,36)(H,29,32,35) OTYQMZBYEDHPIB-UHFFFAOYSA-N 50603104 CHEMBL5199844 Cholinesterase >50000 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603104 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603104&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168291015 482613955 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497146 FC(F)(F)c1ccc(CN2CCC(CC2)NC(=O)c2ccc3c(c2)[nH]c2c(NC(=O)C4CC4)nccc32)cc1 InChI=1S/C29H28F3N5O2/c30-29(31,32)20-6-1-17(2-7-20)16-37-13-10-21(11-14-37)34-28(39)19-5-8-22-23-9-12-33-26(25(23)35-24(22)15-19)36-27(38)18-3-4-18/h1-2,5-9,12,15,18,21,35H,3-4,10-11,13-14,16H2,(H,34,39)(H,33,36,38) QGOGFCJCLFWXST-UHFFFAOYSA-N 50603105 CHEMBL5190731 Cholinesterase >50000 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603105 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603105&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168280424 482613956 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497147 Clc1ccc(CN2CCC(CC2)NC(=O)c2ccc3c(c2)[nH]c2c(NC(=O)C4CC4)nccc32)cc1 InChI=1S/C28H28ClN5O2/c29-20-6-1-17(2-7-20)16-34-13-10-21(11-14-34)31-28(36)19-5-8-22-23-9-12-30-26(25(23)32-24(22)15-19)33-27(35)18-3-4-18/h1-2,5-9,12,15,18,21,32H,3-4,10-11,13-14,16H2,(H,31,36)(H,30,33,35) ONTXBBDJPXKKSL-UHFFFAOYSA-N 50603106 CHEMBL5204902 Cholinesterase >50000 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603106 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603106&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168294505 482613957 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497148 Clc1cccc(Cl)c1CN1CCC(CC1)NC(=O)c1ccc2c(c1)[nH]c1c(NC(=O)C3CC3)nccc21 InChI=1S/C28H27Cl2N5O2/c29-22-2-1-3-23(30)21(22)15-35-12-9-18(10-13-35)32-28(37)17-6-7-19-20-8-11-31-26(25(20)33-24(19)14-17)34-27(36)16-4-5-16/h1-3,6-8,11,14,16,18,33H,4-5,9-10,12-13,15H2,(H,32,37)(H,31,34,36) CIIAROAGWDWACP-UHFFFAOYSA-N 50603107 CHEMBL5169549 Cholinesterase >50000 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603107 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603107&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168270086 482613958 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497149 O=C(Nc1nccc2c3ccc(cc3[nH]c12)C(=O)NCC1CCN(Cc2ccccc2)CC1)C1CC1 InChI=1S/C29H31N5O2/c35-28(31-17-19-11-14-34(15-12-19)18-20-4-2-1-3-5-20)22-8-9-23-24-10-13-30-27(26(24)32-25(23)16-22)33-29(36)21-6-7-21/h1-5,8-10,13,16,19,21,32H,6-7,11-12,14-15,17-18H2,(H,31,35)(H,30,33,36) HANRHTWEKYINMG-UHFFFAOYSA-N 50603108 CHEMBL5194360 Cholinesterase >50000 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603108 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603108&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168287511 482613959 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497150 Cc1ccc(CN2CCC(CNC(=O)c3ccc4c(c3)[nH]c3c(NC(=O)C5CC5)nccc43)CC2)cc1 InChI=1S/C30H33N5O2/c1-19-2-4-21(5-3-19)18-35-14-11-20(12-15-35)17-32-29(36)23-8-9-24-25-10-13-31-28(27(25)33-26(24)16-23)34-30(37)22-6-7-22/h2-5,8-10,13,16,20,22,33H,6-7,11-12,14-15,17-18H2,1H3,(H,32,36)(H,31,34,37) WXTJUQBZJRDWMR-UHFFFAOYSA-N 50603109 CHEMBL5194292 Cholinesterase >50000 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603109 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603109&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168288824 482613960 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497151 Fc1ccccc1CN1CCC(CNC(=O)c2ccc3c(c2)[nH]c2c(NC(=O)C4CC4)nccc32)CC1 InChI=1S/C29H30FN5O2/c30-24-4-2-1-3-21(24)17-35-13-10-18(11-14-35)16-32-28(36)20-7-8-22-23-9-12-31-27(26(23)33-25(22)15-20)34-29(37)19-5-6-19/h1-4,7-9,12,15,18-19,33H,5-6,10-11,13-14,16-17H2,(H,32,36)(H,31,34,37) WCDBGBTYJSIEQO-UHFFFAOYSA-N 50603110 CHEMBL5205147 Cholinesterase 34210 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603110 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603110&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168295337 482613961 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497152 Fc1cccc(CN2CCC(CNC(=O)c3ccc4c(c3)[nH]c3c(NC(=O)C5CC5)nccc43)CC2)c1 InChI=1S/C29H30FN5O2/c30-22-3-1-2-19(14-22)17-35-12-9-18(10-13-35)16-32-28(36)21-6-7-23-24-8-11-31-27(26(24)33-25(23)15-21)34-29(37)20-4-5-20/h1-3,6-8,11,14-15,18,20,33H,4-5,9-10,12-13,16-17H2,(H,32,36)(H,31,34,37) XURPJONKVFTNBY-UHFFFAOYSA-N 50603111 CHEMBL5179210 Cholinesterase >50000 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603111 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603111&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168276697 482613962 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497153 Fc1ccc(CN2CCC(CNC(=O)c3ccc4c(c3)[nH]c3c(NC(=O)C5CC5)nccc43)CC2)cc1 InChI=1S/C29H30FN5O2/c30-22-6-1-19(2-7-22)17-35-13-10-18(11-14-35)16-32-28(36)21-5-8-23-24-9-12-31-27(26(24)33-25(23)15-21)34-29(37)20-3-4-20/h1-2,5-9,12,15,18,20,33H,3-4,10-11,13-14,16-17H2,(H,32,36)(H,31,34,37) SPVTVHLKNQDYED-UHFFFAOYSA-N 50603112 CHEMBL5182016 Cholinesterase >50000 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603112 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603112&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168277982 482613963 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497154 Fc1cc(F)cc(CN2CCC(CNC(=O)c3ccc4c(c3)[nH]c3c(NC(=O)C5CC5)nccc43)CC2)c1 InChI=1S/C29H29F2N5O2/c30-21-11-18(12-22(31)14-21)16-36-9-6-17(7-10-36)15-33-28(37)20-3-4-23-24-5-8-32-27(26(24)34-25(23)13-20)35-29(38)19-1-2-19/h3-5,8,11-14,17,19,34H,1-2,6-7,9-10,15-16H2,(H,33,37)(H,32,35,38) ORFIEOPINFOSKQ-UHFFFAOYSA-N 50603113 CHEMBL5177868 Cholinesterase >50000 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603113 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603113&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168272625 482613964 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497155 [O-][N+](=O)c1cccc(CN2CCC(CNC(=O)c3ccc4c(c3)[nH]c3c(NC(=O)C5CC5)nccc43)CC2)c1 InChI=1S/C29H30N6O4/c36-28(31-16-18-9-12-34(13-10-18)17-19-2-1-3-22(14-19)35(38)39)21-6-7-23-24-8-11-30-27(26(24)32-25(23)15-21)33-29(37)20-4-5-20/h1-3,6-8,11,14-15,18,20,32H,4-5,9-10,12-13,16-17H2,(H,31,36)(H,30,33,37) BYFMJLIEBCLUCP-UHFFFAOYSA-N 50603114 CHEMBL5205885 Cholinesterase >50000 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603114 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603114&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168297368 482613965 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497156 FC(F)(F)c1ccc(CN2CCC(CNC(=O)c3ccc4c(c3)[nH]c3c(NC(=O)C5CC5)nccc43)CC2)cc1 InChI=1S/C30H30F3N5O2/c31-30(32,33)22-6-1-19(2-7-22)17-38-13-10-18(11-14-38)16-35-28(39)21-5-8-23-24-9-12-34-27(26(24)36-25(23)15-21)37-29(40)20-3-4-20/h1-2,5-9,12,15,18,20,36H,3-4,10-11,13-14,16-17H2,(H,35,39)(H,34,37,40) UCBIZNJOYZSQTP-UHFFFAOYSA-N 50603115 CHEMBL5208017 Cholinesterase >50000 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603115 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603115&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168296848 482613966 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497157 Clc1ccc(CN2CCC(CNC(=O)c3ccc4c(c3)[nH]c3c(NC(=O)C5CC5)nccc43)CC2)cc1 InChI=1S/C29H30ClN5O2/c30-22-6-1-19(2-7-22)17-35-13-10-18(11-14-35)16-32-28(36)21-5-8-23-24-9-12-31-27(26(24)33-25(23)15-21)34-29(37)20-3-4-20/h1-2,5-9,12,15,18,20,33H,3-4,10-11,13-14,16-17H2,(H,32,36)(H,31,34,37) RDYTZJCFQCQNLJ-UHFFFAOYSA-N 50603116 CHEMBL5176350 Cholinesterase >50000 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603116 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603116&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168272112 482613967 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497158 Clc1cccc(Cl)c1CN1CCC(CNC(=O)c2ccc3c(c2)[nH]c2c(NC(=O)C4CC4)nccc32)CC1 InChI=1S/C29H29Cl2N5O2/c30-23-2-1-3-24(31)22(23)16-36-12-9-17(10-13-36)15-33-28(37)19-6-7-20-21-8-11-32-27(26(21)34-25(20)14-19)35-29(38)18-4-5-18/h1-3,6-8,11,14,17-18,34H,4-5,9-10,12-13,15-16H2,(H,33,37)(H,32,35,38) OFZHZGCHBASLLU-UHFFFAOYSA-N 50603117 CHEMBL5188962 Cholinesterase >50000 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603117 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603117&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168279744 482613968 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497159 O=C(Nc1nccc2c3ccc(cc3[nH]c12)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1 InChI=1S/C30H33N5O2/c36-29(32-14-10-20-12-16-35(17-13-20)19-21-4-2-1-3-5-21)23-8-9-24-25-11-15-31-28(27(25)33-26(24)18-23)34-30(37)22-6-7-22/h1-5,8-9,11,15,18,20,22,33H,6-7,10,12-14,16-17,19H2,(H,32,36)(H,31,34,37) ZTKAKKZKSHDLJF-UHFFFAOYSA-N 50603118 CHEMBL5176652 Cholinesterase 23550 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603118 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603118&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168275825 482613969 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497160 Cc1ccc(CN2CCC(CCNC(=O)c3ccc4c(c3)[nH]c3c(NC(=O)C5CC5)nccc43)CC2)cc1 InChI=1S/C31H35N5O2/c1-20-2-4-22(5-3-20)19-36-16-12-21(13-17-36)10-14-33-30(37)24-8-9-25-26-11-15-32-29(28(26)34-27(25)18-24)35-31(38)23-6-7-23/h2-5,8-9,11,15,18,21,23,34H,6-7,10,12-14,16-17,19H2,1H3,(H,33,37)(H,32,35,38) YIXAPQSGHLMLCC-UHFFFAOYSA-N 50603119 CHEMBL5206642 Cholinesterase >50000 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603119 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603119&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168297649 482613970 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497161 Fc1ccccc1CN1CCC(CCNC(=O)c2ccc3c(c2)[nH]c2c(NC(=O)C4CC4)nccc32)CC1 InChI=1S/C30H32FN5O2/c31-25-4-2-1-3-22(25)18-36-15-11-19(12-16-36)9-13-33-29(37)21-7-8-23-24-10-14-32-28(27(24)34-26(23)17-21)35-30(38)20-5-6-20/h1-4,7-8,10,14,17,19-20,34H,5-6,9,11-13,15-16,18H2,(H,33,37)(H,32,35,38) AMLAWNFGPZNOOW-UHFFFAOYSA-N 50603120 CHEMBL5207215 Cholinesterase 20820 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603120 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603120&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 163322222 482613971 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497162 Fc1cccc(CN2CCC(CCNC(=O)c3ccc4c(c3)[nH]c3c(NC(=O)C5CC5)nccc43)CC2)c1 InChI=1S/C30H32FN5O2/c31-23-3-1-2-20(16-23)18-36-14-10-19(11-15-36)8-12-33-29(37)22-6-7-24-25-9-13-32-28(27(25)34-26(24)17-22)35-30(38)21-4-5-21/h1-3,6-7,9,13,16-17,19,21,34H,4-5,8,10-12,14-15,18H2,(H,33,37)(H,32,35,38) TUMRRAKDBINKBA-UHFFFAOYSA-N 50603121 CHEMBL5176112 Cholinesterase 19860 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603121 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603121&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168276130 482613972 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497163 Fc1ccc(CN2CCC(CCNC(=O)c3ccc4c(c3)[nH]c3c(NC(=O)C5CC5)nccc43)CC2)cc1 InChI=1S/C30H32FN5O2/c31-23-6-1-20(2-7-23)18-36-15-11-19(12-16-36)9-13-33-29(37)22-5-8-24-25-10-14-32-28(27(25)34-26(24)17-22)35-30(38)21-3-4-21/h1-2,5-8,10,14,17,19,21,34H,3-4,9,11-13,15-16,18H2,(H,33,37)(H,32,35,38) HCJHPQSJOKTSPI-UHFFFAOYSA-N 50603122 CHEMBL5170660 Cholinesterase 20310 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603122 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603122&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168269283 482613973 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497164 Fc1cc(F)cc(CN2CCC(CCNC(=O)c3ccc4c(c3)[nH]c3c(NC(=O)C5CC5)nccc43)CC2)c1 InChI=1S/C30H31F2N5O2/c31-22-13-19(14-23(32)16-22)17-37-11-7-18(8-12-37)5-9-34-29(38)21-3-4-24-25-6-10-33-28(27(25)35-26(24)15-21)36-30(39)20-1-2-20/h3-4,6,10,13-16,18,20,35H,1-2,5,7-9,11-12,17H2,(H,34,38)(H,33,36,39) JSKZIEAWHDKUDG-UHFFFAOYSA-N 50603123 CHEMBL5189407 Cholinesterase >50000 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603123 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603123&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168281640 482613974 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497165 [O-][N+](=O)c1cccc(CN2CCC(CCNC(=O)c3ccc4c(c3)[nH]c3c(NC(=O)C5CC5)nccc43)CC2)c1 InChI=1S/C30H32N6O4/c37-29(32-12-8-19-10-14-35(15-11-19)18-20-2-1-3-23(16-20)36(39)40)22-6-7-24-25-9-13-31-28(27(25)33-26(24)17-22)34-30(38)21-4-5-21/h1-3,6-7,9,13,16-17,19,21,33H,4-5,8,10-12,14-15,18H2,(H,32,37)(H,31,34,38) SZEYJFPVSODSOC-UHFFFAOYSA-N 50603124 CHEMBL5208889 Cholinesterase >50000 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603124 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603124&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168294406 482613975 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497166 FC(F)(F)c1ccc(CN2CCC(CCNC(=O)c3ccc4c(c3)[nH]c3c(NC(=O)C5CC5)nccc43)CC2)cc1 InChI=1S/C31H32F3N5O2/c32-31(33,34)23-6-1-20(2-7-23)18-39-15-11-19(12-16-39)9-13-36-29(40)22-5-8-24-25-10-14-35-28(27(25)37-26(24)17-22)38-30(41)21-3-4-21/h1-2,5-8,10,14,17,19,21,37H,3-4,9,11-13,15-16,18H2,(H,36,40)(H,35,38,41) CRPRXONJFCMJPC-UHFFFAOYSA-N 50603125 CHEMBL5194688 Cholinesterase >50000 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603125 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603125&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168287535 482613976 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497167 Clc1ccc(CN2CCC(CCNC(=O)c3ccc4c(c3)[nH]c3c(NC(=O)C5CC5)nccc43)CC2)cc1 InChI=1S/C30H32ClN5O2/c31-23-6-1-20(2-7-23)18-36-15-11-19(12-16-36)9-13-33-29(37)22-5-8-24-25-10-14-32-28(27(25)34-26(24)17-22)35-30(38)21-3-4-21/h1-2,5-8,10,14,17,19,21,34H,3-4,9,11-13,15-16,18H2,(H,33,37)(H,32,35,38) LZRFQPCPFFBOTO-UHFFFAOYSA-N 50603126 CHEMBL5209524 Cholinesterase >50000 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603126 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603126&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168296897 482613977 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497168 Clc1cccc(Cl)c1CN1CCC(CCNC(=O)c2ccc3c(c2)[nH]c2c(NC(=O)C4CC4)nccc32)CC1 InChI=1S/C30H31Cl2N5O2/c31-24-2-1-3-25(32)23(24)17-37-14-10-18(11-15-37)8-12-34-29(38)20-6-7-21-22-9-13-33-28(27(22)35-26(21)16-20)36-30(39)19-4-5-19/h1-3,6-7,9,13,16,18-19,35H,4-5,8,10-12,14-15,17H2,(H,34,38)(H,33,36,39) VPJQBUQKSKXOTF-UHFFFAOYSA-N 50603127 CHEMBL5202565 Cholinesterase >50000 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50603127 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50603127&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168292700 482613978 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497169 COc1ccc2c(c1)[nH]c1c(C)nccc21 InChI=1S/C13H12N2O/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13/h3-7,15H,1-2H3 BXNJHAXVSOCGBA-UHFFFAOYSA-N 100152 7-methoxy-1-methyl-9H-beta-carboline;hydrochloride::7-methoxy-1-methyl-9H-pyrido[3,4-b]indole;hydrochloride::HARMINE::Harmine hydrochloride::MLS002153910::SMR001233259::cid_5359389 Cholinesterase 13600 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=100152 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=100152&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search HRM 7X9D,5Y86,2Z5X,3ANR,2Z5Y 5280953 252663240 28121 DB07919 C06538 ZINC18847046 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497170 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 3550 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51497171 COC(=O)c1ccc2c(c1)[nH]c1c(NC(=O)C3CC3)nccc21 InChI=1S/C17H15N3O3/c1-23-17(22)10-4-5-11-12-6-7-18-15(14(12)19-13(11)8-10)20-16(21)9-2-3-9/h4-9,19H,2-3H2,1H3,(H,18,20,21) ACRYPFBNYMEDTL-UHFFFAOYSA-N 50571752 CHEMBL4849247 Cholinesterase >20000 ChEMBL 10.7270/Q2ZK5MRC 34995924 Liu, W; Liu, X; Liu, W; Gao, Y; Wu, L; Huang, Y; Chen, H; Li, D; Zhou, L; Wang, N; Xu, Z; Jiang, X; Zhao, Q Shenyang Pharmaceutical University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50571752 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50571752&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 163408833 471061897 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51506729 Brc1ccc(COc2ccc3[nH]c(=O)oc(=O)c3c2)cc1 InChI=1S/C15H10BrNO4/c16-10-3-1-9(2-4-10)8-20-11-5-6-13-12(7-11)14(18)21-15(19)17-13/h1-7H,8H2,(H,17,19) NFBAAGDURJXKFO-UHFFFAOYSA-N 50607019 CHEMBL5218784 Cholinesterase 19800 ChEMBL 10.7270/Q241724G 36179486 Hitge, R; Petzer, A; Petzer, JP North-West University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50607019 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50607019&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168299242 482617870 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51506730 Cc1ccc(COc2ccc3[nH]c(=O)oc(=O)c3c2)cc1 InChI=1S/C16H13NO4/c1-10-2-4-11(5-3-10)9-20-12-6-7-14-13(8-12)15(18)21-16(19)17-14/h2-8H,9H2,1H3,(H,17,19) LSUPZGBGSLEZJD-UHFFFAOYSA-N 50607020 CHEMBL5220277 Cholinesterase 19100 ChEMBL 10.7270/Q241724G 36179486 Hitge, R; Petzer, A; Petzer, JP North-West University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50607020 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50607020&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168299067 482617871 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51506731 O=c1[nH]c2ccc(OCc3ccc4ccccc4c3)cc2c(=O)o1 InChI=1S/C19H13NO4/c21-18-16-10-15(7-8-17(16)20-19(22)24-18)23-11-12-5-6-13-3-1-2-4-14(13)9-12/h1-10H,11H2,(H,20,22) JUTIETJDHJBZJU-UHFFFAOYSA-N 50607022 CHEMBL5218762 Cholinesterase 16600 ChEMBL 10.7270/Q241724G 36179486 Hitge, R; Petzer, A; Petzer, JP North-West University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50607022 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50607022&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168299023 482617873 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51506732 CC(C)c1ccc(COc2ccc3[nH]c(=O)oc(=O)c3c2)cc1 InChI=1S/C18H17NO4/c1-11(2)13-5-3-12(4-6-13)10-22-14-7-8-16-15(9-14)17(20)23-18(21)19-16/h3-9,11H,10H2,1-2H3,(H,19,21) IPMOTHAZKSUNDL-UHFFFAOYSA-N 50607025 CHEMBL5219958 Cholinesterase 21100 ChEMBL 10.7270/Q241724G 36179486 Hitge, R; Petzer, A; Petzer, JP North-West University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50607025 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50607025&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168298233 482617876 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51506733 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 4.0 ChEMBL 10.7270/Q241724G 36179486 Hitge, R; Petzer, A; Petzer, JP North-West University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51494378 O=C1N(CCN2C(=O)C(=O)c3ccccc23)c2ccccc2C1=O InChI=1S/C18H12N2O4/c21-15-11-5-1-3-7-13(11)19(17(15)23)9-10-20-14-8-4-2-6-12(14)16(22)18(20)24/h1-8H,9-10H2 ZICIZFBOAQLOTF-UHFFFAOYSA-N 22844 1-[2-(2,3-dioxo-2,3-dihydro-1H-indol-1-yl)ethyl]-2,3-dihydro-1H-indole-2,3-dione::Isatin-based compound, 64 Cholinesterase >125000 ChEMBL 10.7270/Q2W381DJ 36307033 Reiland, KM; Eckroat, TJ The Behrend College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=22844 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=22844&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3114312 49846658 ZINC03130265 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51494379 O=C1N(CCCN2C(=O)C(=O)c3ccccc23)c2ccccc2C1=O InChI=1S/C19H14N2O4/c22-16-12-6-1-3-8-14(12)20(18(16)24)10-5-11-21-15-9-4-2-7-13(15)17(23)19(21)25/h1-4,6-9H,5,10-11H2 ROFWOPAEDYCGBZ-UHFFFAOYSA-N 50601965 CHEMBL4281415 Cholinesterase >125000 ChEMBL 10.7270/Q2W381DJ 36307033 Reiland, KM; Eckroat, TJ The Behrend College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50601965 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50601965&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3114291 482612816 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51494380 O=C1N(CCCCN2C(=O)C(=O)c3ccccc23)c2ccccc2C1=O InChI=1S/C20H16N2O4/c23-17-13-7-1-3-9-15(13)21(19(17)25)11-5-6-12-22-16-10-4-2-8-14(16)18(24)20(22)26/h1-4,7-10H,5-6,11-12H2 GTYRKBYNCPSQQT-UHFFFAOYSA-N 50601966 CHEMBL4289287 Cholinesterase 34700 ChEMBL 10.7270/Q2W381DJ 36307033 Reiland, KM; Eckroat, TJ The Behrend College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50601966 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50601966&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3114313 482612817 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51494381 O=C1N(CCCCCN2C(=O)C(=O)c3ccccc23)c2ccccc2C1=O InChI=1S/C21H18N2O4/c24-18-14-8-2-4-10-16(14)22(20(18)26)12-6-1-7-13-23-17-11-5-3-9-15(17)19(25)21(23)27/h2-5,8-11H,1,6-7,12-13H2 KGAWSUQYKWFRFK-UHFFFAOYSA-N 50601967 CHEMBL4288425 Cholinesterase 7560 ChEMBL 10.7270/Q2W381DJ 36307033 Reiland, KM; Eckroat, TJ The Behrend College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50601967 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50601967&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 139227605 482612818 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51494382 O=C1N(CCCCCCN2C(=O)C(=O)c3ccccc23)c2ccccc2C1=O InChI=1S/C22H20N2O4/c25-19-15-9-3-5-11-17(15)23(21(19)27)13-7-1-2-8-14-24-18-12-6-4-10-16(18)20(26)22(24)28/h3-6,9-12H,1-2,7-8,13-14H2 JFFIHEGMOWVDHV-UHFFFAOYSA-N 50601968 CHEMBL4280199 Cholinesterase >50000 ChEMBL 10.7270/Q2W381DJ 36307033 Reiland, KM; Eckroat, TJ The Behrend College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50601968 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50601968&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11588896 482612819 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51494383 O=C1N(CCCCCCCN2C(=O)C(=O)c3ccccc23)c2ccccc2C1=O InChI=1S/C23H22N2O4/c26-20-16-10-4-6-12-18(16)24(22(20)28)14-8-2-1-3-9-15-25-19-13-7-5-11-17(19)21(27)23(25)29/h4-7,10-13H,1-3,8-9,14-15H2 VLRVJBVOJDYBIN-UHFFFAOYSA-N 50601969 CHEMBL5199882 Cholinesterase 3200 ChEMBL 10.7270/Q2W381DJ 36307033 Reiland, KM; Eckroat, TJ The Behrend College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50601969 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50601969&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168291937 482612820 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51494384 O=C1N(CCCCCCCCN2C(=O)C(=O)c3ccccc23)c2ccccc2C1=O InChI=1S/C24H24N2O4/c27-21-17-11-5-7-13-19(17)25(23(21)29)15-9-3-1-2-4-10-16-26-20-14-8-6-12-18(20)22(28)24(26)30/h5-8,11-14H,1-4,9-10,15-16H2 XAMVOBRYUJCXJP-UHFFFAOYSA-N 50601970 CHEMBL4284919 Cholinesterase >50000 ChEMBL 10.7270/Q2W381DJ 36307033 Reiland, KM; Eckroat, TJ The Behrend College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50601970 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50601970&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 138857677 482612821 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51494385 OC1(C(=O)N(CCN2C(=O)C(O)(c3ccccc23)c2c[nH]c3ccccc23)c2ccccc12)c1c[nH]c2ccccc12 InChI=1S/C34H26N4O4/c39-31-33(41,25-19-35-27-13-5-1-9-21(25)27)23-11-3-7-15-29(23)37(31)17-18-38-30-16-8-4-12-24(30)34(42,32(38)40)26-20-36-28-14-6-2-10-22(26)28/h1-16,19-20,35-36,41-42H,17-18H2 SHOSTGAKQJDIJR-UHFFFAOYSA-N 50601971 CHEMBL5183229 Cholinesterase >50000 ChEMBL 10.7270/Q2W381DJ 36307033 Reiland, KM; Eckroat, TJ The Behrend College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50601971 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50601971&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168278803 482612822 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51494386 OC1(C(=O)N(CCCN2C(=O)C(O)(c3ccccc23)c2c[nH]c3ccccc23)c2ccccc12)c1c[nH]c2ccccc12 InChI=1S/C35H28N4O4/c40-32-34(42,26-20-36-28-14-5-1-10-22(26)28)24-12-3-7-16-30(24)38(32)18-9-19-39-31-17-8-4-13-25(31)35(43,33(39)41)27-21-37-29-15-6-2-11-23(27)29/h1-8,10-17,20-21,36-37,42-43H,9,18-19H2 GVDIYQGOTSDQGD-UHFFFAOYSA-N 50601972 CHEMBL5176734 Cholinesterase 6470 ChEMBL 10.7270/Q2W381DJ 36307033 Reiland, KM; Eckroat, TJ The Behrend College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50601972 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50601972&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168272565 482612823 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51494387 OC1(C(=O)N(CCCCN2C(=O)C(O)(c3ccccc23)c2c[nH]c3ccccc23)c2ccccc12)c1c[nH]c2ccccc12 InChI=1S/C36H30N4O4/c41-33-35(43,27-21-37-29-15-5-1-11-23(27)29)25-13-3-7-17-31(25)39(33)19-9-10-20-40-32-18-8-4-14-26(32)36(44,34(40)42)28-22-38-30-16-6-2-12-24(28)30/h1-8,11-18,21-22,37-38,43-44H,9-10,19-20H2 RDZQQYVVJJKQPW-UHFFFAOYSA-N 50601973 CHEMBL5185973 Cholinesterase 11800 ChEMBL 10.7270/Q2W381DJ 36307033 Reiland, KM; Eckroat, TJ The Behrend College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50601973 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50601973&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168281795 482612824 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51494388 OC1(C(=O)N(CCCCCN2C(=O)C(O)(c3ccccc23)c2c[nH]c3ccccc23)c2ccccc12)c1c[nH]c2ccccc12 InChI=1S/C37H32N4O4/c42-34-36(44,28-22-38-30-16-6-2-12-24(28)30)26-14-4-8-18-32(26)40(34)20-10-1-11-21-41-33-19-9-5-15-27(33)37(45,35(41)43)29-23-39-31-17-7-3-13-25(29)31/h2-9,12-19,22-23,38-39,44-45H,1,10-11,20-21H2 YMBVCRHQFUEMEM-UHFFFAOYSA-N 50601974 CHEMBL5206401 Cholinesterase 4490 ChEMBL 10.7270/Q2W381DJ 36307033 Reiland, KM; Eckroat, TJ The Behrend College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50601974 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50601974&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168296995 482612825 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51494389 OC1(C(=O)N(CCCCCCN2C(=O)C(O)(c3ccccc23)c2c[nH]c3ccccc23)c2ccccc12)c1c[nH]c2ccccc12 InChI=1S/C38H34N4O4/c43-35-37(45,29-23-39-31-17-7-3-13-25(29)31)27-15-5-9-19-33(27)41(35)21-11-1-2-12-22-42-34-20-10-6-16-28(34)38(46,36(42)44)30-24-40-32-18-8-4-14-26(30)32/h3-10,13-20,23-24,39-40,45-46H,1-2,11-12,21-22H2 AUVNNXVPUPQALO-UHFFFAOYSA-N 50601975 CHEMBL5193420 Cholinesterase 14000 ChEMBL 10.7270/Q2W381DJ 36307033 Reiland, KM; Eckroat, TJ The Behrend College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50601975 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50601975&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168289626 482612826 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51494390 OC1(C(=O)N(CCCCCCCN2C(=O)C(O)(c3ccccc23)c2c[nH]c3ccccc23)c2ccccc12)c1c[nH]c2ccccc12 InChI=1S/C39H36N4O4/c44-36-38(46,30-24-40-32-18-8-4-14-26(30)32)28-16-6-10-20-34(28)42(36)22-12-2-1-3-13-23-43-35-21-11-7-17-29(35)39(47,37(43)45)31-25-41-33-19-9-5-15-27(31)33/h4-11,14-21,24-25,40-41,46-47H,1-3,12-13,22-23H2 VAGZASTZVRJBQN-UHFFFAOYSA-N 50601976 CHEMBL5191589 Cholinesterase 13200 ChEMBL 10.7270/Q2W381DJ 36307033 Reiland, KM; Eckroat, TJ The Behrend College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50601976 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50601976&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168284861 482612827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51494391 OC1(C(=O)N(CCCCCCCCN2C(=O)C(O)(c3ccccc23)c2c[nH]c3ccccc23)c2ccccc12)c1c[nH]c2ccccc12 InChI=1S/C40H38N4O4/c45-37-39(47,31-25-41-33-19-9-5-15-27(31)33)29-17-7-11-21-35(29)43(37)23-13-3-1-2-4-14-24-44-36-22-12-8-18-30(36)40(48,38(44)46)32-26-42-34-20-10-6-16-28(32)34/h5-12,15-22,25-26,41-42,47-48H,1-4,13-14,23-24H2 YUSHSLDNCORFMM-UHFFFAOYSA-N 50601977 CHEMBL5195794 Cholinesterase >25000 ChEMBL 10.7270/Q2W381DJ 36307033 Reiland, KM; Eckroat, TJ The Behrend College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50601977 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50601977&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168287167 482612828 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51494392 OC1(C(=O)Nc2ccccc12)c1c[nH]c2ccccc12 InChI=1S/C16H12N2O2/c19-15-16(20,11-6-2-4-8-14(11)18-15)12-9-17-13-7-3-1-5-10(12)13/h1-9,17,20H,(H,18,19) LLSIEQLHMGACNA-UHFFFAOYSA-N 50601978 CHEMBL3322358 Cholinesterase 357000 ChEMBL 10.7270/Q2W381DJ 36307033 Reiland, KM; Eckroat, TJ The Behrend College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50601978 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50601978&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 613090 482612829 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51494393 O=C1Nc2ccccc2C1=O InChI=1S/C8H5NO2/c10-7-5-3-1-2-4-6(5)9-8(7)11/h1-4H,(H,9,10,11) JXDYKVIHCLTXOP-UHFFFAOYSA-N 11022 2,3-dihydro-1H-indole-2,3-dione::CHEMBL326294::Isatin::Isatin (Compound 1) Cholinesterase >1000000 ChEMBL 10.7270/Q2W381DJ 36307033 Reiland, KM; Eckroat, TJ The Behrend College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=11022 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=11022&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search ISN 1OJA,5OJI,5RTF,2XFP,2BK5,6AF9,6AF5,6AFA,6AFB,5PH6 7054 46509351 27539 CHEMBL326294 DB02095 C11129 ZINC02047514 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51494394 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 11682 2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::Rivastigmine.tartrate::US9586925, Rivastigmine Cholinesterase 1140 ChEMBL 10.7270/Q2W381DJ 36307033 Reiland, KM; Eckroat, TJ The Behrend College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=11682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=11682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46512204 DB00989 C11766 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51494395 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 13 ChEMBL 10.7270/Q2W381DJ 36307033 Reiland, KM; Eckroat, TJ The Behrend College http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51506202 [O-][N+](=O)c1cccc(NC(=O)OCCNc2c3ccccc3nc3ccccc23)c1 InChI=1S/C22H18N4O4/c27-22(24-15-6-5-7-16(14-15)26(28)29)30-13-12-23-21-17-8-1-3-10-19(17)25-20-11-4-2-9-18(20)21/h1-11,14H,12-13H2,(H,23,25)(H,24,27) WYIIOKOSMAMRRE-UHFFFAOYSA-N 50606793 CHEMBL5221034 Cholinesterase 17 ChEMBL 10.7270/Q2FJ2MW1 35858523 Zhang, H; Wang, Y; Wang, Y; Li, X; Wang, S; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50606793 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50606793&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168298760 482617644 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51506203 CCCCCCCNC(=O)OCCN1CCN(CCCCCOc2ccc3ccc(=O)[nH]c3c2)CC1 InChI=1S/C28H44N4O4/c1-2-3-4-5-7-14-29-28(34)36-22-20-32-18-16-31(17-19-32)15-8-6-9-21-35-25-12-10-24-11-13-27(33)30-26(24)23-25/h10-13,23H,2-9,14-22H2,1H3,(H,29,34)(H,30,33) CRJBXDXPYHAQQQ-UHFFFAOYSA-N 50606794 CHEMBL5219745 Cholinesterase 1800 ChEMBL 10.7270/Q2FJ2MW1 35858523 Zhang, H; Wang, Y; Wang, Y; Li, X; Wang, S; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50606794 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50606794&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168299428 482617645 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51506204 O=c1ccc2ccc(OCCCCSC(=S)N3CCCCC3)cc2[nH]1 InChI=1S/C19H24N2O2S2/c22-18-9-7-15-6-8-16(14-17(15)20-18)23-12-4-5-13-25-19(24)21-10-2-1-3-11-21/h6-9,14H,1-5,10-13H2,(H,20,22) YPSQYTBEQRIXAU-UHFFFAOYSA-N 50606795 CHEMBL5220566 Cholinesterase 160 ChEMBL 10.7270/Q2FJ2MW1 35858523 Zhang, H; Wang, Y; Wang, Y; Li, X; Wang, S; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50606795 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50606795&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 149402845 482617646 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51506205 CCCCCCCNC(=O)Oc1ccc(F)c(c1)-c1coc2c3C=CC(C)(C)Oc3ccc2c1=O InChI=1S/C28H30FNO5/c1-4-5-6-7-8-15-30-27(32)34-18-9-11-23(29)21(16-18)22-17-33-26-19-13-14-28(2,3)35-24(19)12-10-20(26)25(22)31/h9-14,16-17H,4-8,15H2,1-3H3,(H,30,32) PICOCDMPOQHBCX-UHFFFAOYSA-N 50606796 CHEMBL5220272 Cholinesterase 93 ChEMBL 10.7270/Q2FJ2MW1 35858523 Zhang, H; Wang, Y; Wang, Y; Li, X; Wang, S; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50606796 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50606796&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168298872 482617647 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51506206 CN(C)C(=O)Oc1cccc(c1)-c1coc2c3C=CC(C)(C)Oc3ccc2c1=O InChI=1S/C23H21NO5/c1-23(2)11-10-16-19(29-23)9-8-17-20(25)18(13-27-21(16)17)14-6-5-7-15(12-14)28-22(26)24(3)4/h5-13H,1-4H3 LBLIQZBXCPTOHS-UHFFFAOYSA-N 50606797 CHEMBL5218626 Cholinesterase 680 ChEMBL 10.7270/Q2FJ2MW1 35858523 Zhang, H; Wang, Y; Wang, Y; Li, X; Wang, S; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50606797 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50606797&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168298785 482617648 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51506207 CCN(C)C(=O)Oc1cccc2C(CCC(=O)OC)CNc12 InChI=1S/C16H22N2O4/c1-4-18(2)16(20)22-13-7-5-6-12-11(10-17-15(12)13)8-9-14(19)21-3/h5-7,11,17H,4,8-10H2,1-3H3 UXKSWSRHKZPWJX-UHFFFAOYSA-N 50400030 CHEMBL2177713 Cholinesterase 61600 ChEMBL 10.7270/Q2FJ2MW1 35858523 Zhang, H; Wang, Y; Wang, Y; Li, X; Wang, S; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50400030 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50400030&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 71459015 163349054 CHEMBL2177713 ZINC95564594 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51506208 CCCCCCCNC(=O)Oc1ccc2[nH]cc(CCNC(=O)c3ccccc3Nc3ccccc3)c2c1 InChI=1S/C31H36N4O3/c1-2-3-4-5-11-19-33-31(37)38-25-16-17-28-27(21-25)23(22-34-28)18-20-32-30(36)26-14-9-10-15-29(26)35-24-12-7-6-8-13-24/h6-10,12-17,21-22,34-35H,2-5,11,18-20H2,1H3,(H,32,36)(H,33,37) CCNLRHQAAYZHAN-UHFFFAOYSA-N 50606798 CHEMBL5218756 Cholinesterase 7.0 ChEMBL 10.7270/Q2FJ2MW1 35858523 Zhang, H; Wang, Y; Wang, Y; Li, X; Wang, S; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50606798 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50606798&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168298800 482617649 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51506209 CCC(C)(C)NCC(O)c1cc(OC(=O)N(C)C)cc(OC(=O)N(C)C)c1 InChI=1S/C19H31N3O5/c1-8-19(2,3)20-12-16(23)13-9-14(26-17(24)21(4)5)11-15(10-13)27-18(25)22(6)7/h9-11,16,20,23H,8,12H2,1-7H3 SYWTZCLVKUGBKA-UHFFFAOYSA-N 50606799 CHEMBL4117443 Cholinesterase 126 ChEMBL 10.7270/Q2FJ2MW1 35858523 Zhang, H; Wang, Y; Wang, Y; Li, X; Wang, S; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50606799 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50606799&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137629681 482617650 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51506210 CCN(C)C(=O)Oc1cc(OC(=O)N(C)CC)cc(c1)C(O)CNC(C)(C)CC InChI=1S/C21H35N3O5/c1-8-21(4,5)22-14-18(25)15-11-16(28-19(26)23(6)9-2)13-17(12-15)29-20(27)24(7)10-3/h11-13,18,22,25H,8-10,14H2,1-7H3 YITYTBZFPWLRCG-UHFFFAOYSA-N 50606800 CHEMBL4116693 Cholinesterase 116 ChEMBL 10.7270/Q2FJ2MW1 35858523 Zhang, H; Wang, Y; Wang, Y; Li, X; Wang, S; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50606800 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50606800&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137630541 482617651 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51506211 CCN(C)C(=O)Oc1ccc(CNc2nc3n(ncc3c(=O)[nH]2)C2CCCC2)cc1OC InChI=1S/C22H28N6O4/c1-4-27(2)22(30)32-17-10-9-14(11-18(17)31-3)12-23-21-25-19-16(20(29)26-21)13-24-28(19)15-7-5-6-8-15/h9-11,13,15H,4-8,12H2,1-3H3,(H2,23,25,26,29) NEWFCVAVIWJNER-UHFFFAOYSA-N 50606804 CHEMBL5221005 Cholinesterase 3300 ChEMBL 10.7270/Q2FJ2MW1 35858523 Zhang, H; Wang, Y; Wang, Y; Li, X; Wang, S; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50606804 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50606804&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168298170 482617655 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51506212 COc1cc(CNc2nc3n(ncc3c(=O)[nH]2)C2CCCC2)ccc1OC(=O)N(C)C InChI=1S/C21H26N6O4/c1-26(2)21(29)31-16-9-8-13(10-17(16)30-3)11-22-20-24-18-15(19(28)25-20)12-23-27(18)14-6-4-5-7-14/h8-10,12,14H,4-7,11H2,1-3H3,(H2,22,24,25,28) MQYMVWGJBVHCAR-UHFFFAOYSA-N 50606805 CHEMBL5219813 Cholinesterase 970 ChEMBL 10.7270/Q2FJ2MW1 35858523 Zhang, H; Wang, Y; Wang, Y; Li, X; Wang, S; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50606805 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50606805&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168298349 482617656 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51506213 COc1ccccc1CNS(=O)(=O)C[C@H](CC(C)C)NC(=O)OCc1ccccc1 InChI=1S/C22H30N2O5S/c1-17(2)13-20(24-22(25)29-15-18-9-5-4-6-10-18)16-30(26,27)23-14-19-11-7-8-12-21(19)28-3/h4-12,17,20,23H,13-16H2,1-3H3,(H,24,25)/t20-/m0/s1 DMOOSQKVZLZWQB-FQEVSTJZSA-N 50606801 CHEMBL5220690 Cholinesterase 4330 ChEMBL 10.7270/Q2FJ2MW1 35858523 Zhang, H; Wang, Y; Wang, Y; Li, X; Wang, S; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50606801 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50606801&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168298742 482617652 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51506214 CC(C)C[C@@H](CS(=O)(=O)NCc1ccc(Cl)cc1)NC(=O)OCc1ccccc1 InChI=1S/C21H27ClN2O4S/c1-16(2)12-20(24-21(25)28-14-18-6-4-3-5-7-18)15-29(26,27)23-13-17-8-10-19(22)11-9-17/h3-11,16,20,23H,12-15H2,1-2H3,(H,24,25)/t20-/m0/s1 RNSUWBBFTFIEPC-FQEVSTJZSA-N 50606802 CHEMBL5221092 Cholinesterase 6570 ChEMBL 10.7270/Q2FJ2MW1 35858523 Zhang, H; Wang, Y; Wang, Y; Li, X; Wang, S; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50606802 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50606802&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168299006 482617653 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51506295 CCN(CC)C(=O)Oc1ccc2[nH]ccc2c1 InChI=1S/C13H16N2O2/c1-3-15(4-2)13(16)17-11-5-6-12-10(9-11)7-8-14-12/h5-9,14H,3-4H2,1-2H3 VQGCHBPXHCXNIR-UHFFFAOYSA-N 50606828 CHEMBL4290661 Cholinesterase 2290 ChEMBL 10.7270/Q2FJ2MW1 35858523 Zhang, H; Wang, Y; Wang, Y; Li, X; Wang, S; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50606828 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50606828&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10331501 482617679 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51506296 CCN(CC)C(=O)Oc1ccc2ccn(CC#C)c2c1 InChI=1S/C16H18N2O2/c1-4-10-18-11-9-13-7-8-14(12-15(13)18)20-16(19)17(5-2)6-3/h1,7-9,11-12H,5-6,10H2,2-3H3 JRQMMDMQIHYKOY-UHFFFAOYSA-N 50606829 CHEMBL4286834 Cholinesterase 5010 ChEMBL 10.7270/Q2FJ2MW1 35858523 Zhang, H; Wang, Y; Wang, Y; Li, X; Wang, S; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50606829 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50606829&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 145991351 482617680 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51506316 O=C(Nc1ccccc1)Oc1cccc(CN2CCN(CC2)c2ccccc2)c1 InChI=1S/C24H25N3O2/c28-24(25-21-9-3-1-4-10-21)29-23-13-7-8-20(18-23)19-26-14-16-27(17-15-26)22-11-5-2-6-12-22/h1-13,18H,14-17,19H2,(H,25,28) VZMOXHDBCYXLAY-UHFFFAOYSA-N 50606837 CHEMBL5220751 Cholinesterase 2000 ChEMBL 10.7270/Q2FJ2MW1 35858523 Zhang, H; Wang, Y; Wang, Y; Li, X; Wang, S; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50606837 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50606837&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168299230 482617688 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51506339 CCCCCCCNC(=O)OCn1nc(ccc1=O)-c1ccccc1OC InChI=1S/C20H27N3O4/c1-3-4-5-6-9-14-21-20(25)27-15-23-19(24)13-12-17(22-23)16-10-7-8-11-18(16)26-2/h7-8,10-13H,3-6,9,14-15H2,1-2H3,(H,21,25) WXWOJHQORWACKU-UHFFFAOYSA-N 50606847 CHEMBL5220730 Cholinesterase 12800 ChEMBL 10.7270/Q2FJ2MW1 35858523 Zhang, H; Wang, Y; Wang, Y; Li, X; Wang, S; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50606847 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50606847&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168299094 482617698 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51506340 CCCCCCNC(=O)OCn1nc(ccc1=O)-c1ccccc1OC InChI=1S/C19H25N3O4/c1-3-4-5-8-13-20-19(24)26-14-22-18(23)12-11-16(21-22)15-9-6-7-10-17(15)25-2/h6-7,9-12H,3-5,8,13-14H2,1-2H3,(H,20,24) OAVKFSLPJQJXDB-UHFFFAOYSA-N 50606848 CHEMBL5219203 Cholinesterase 35000 ChEMBL 10.7270/Q2FJ2MW1 35858523 Zhang, H; Wang, Y; Wang, Y; Li, X; Wang, S; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50606848 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50606848&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168298692 482617699 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51506341 COc1ccccc1-c1ccc(=O)n(COC(=O)Nc2ccc(C)cc2)n1 InChI=1S/C20H19N3O4/c1-14-7-9-15(10-8-14)21-20(25)27-13-23-19(24)12-11-17(22-23)16-5-3-4-6-18(16)26-2/h3-12H,13H2,1-2H3,(H,21,25) OLSJGLKHRQTKAM-UHFFFAOYSA-N 50606849 CHEMBL5218840 Cholinesterase 34500 ChEMBL 10.7270/Q2FJ2MW1 35858523 Zhang, H; Wang, Y; Wang, Y; Li, X; Wang, S; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50606849 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50606849&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 168298081 482617700 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51506347 CCN(C)C(=O)Oc1cccc(CC(C)N(C)CC#C)c1 InChI=1S/C17H24N2O2/c1-6-11-19(5)14(3)12-15-9-8-10-16(13-15)21-17(20)18(4)7-2/h1,8-10,13-14H,7,11-12H2,2-5H3 YOOMCQRTUQTUJB-UHFFFAOYSA-N 10824 3-{2-[methyl(prop-2-yn-1-yl)amino]propyl}phenyl N-ethyl-N-methylcarbamate::Phenethylamine deriv. 53b Cholinesterase 1500 ChEMBL 10.7270/Q2FJ2MW1 35858523 Zhang, H; Wang, Y; Wang, Y; Li, X; Wang, S; Wang, Z Lanzhou University http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10824 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10824&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11120913 46511402 ZINC13492346 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51510773 OC[C@H]1O[C@@H](OCCn2cnc3ccccc23)[C@H](O)[C@@H](O)[C@@H]1O InChI=1S/C15H20N2O6/c18-7-11-12(19)13(20)14(21)15(23-11)22-6-5-17-8-16-9-3-1-2-4-10(9)17/h1-4,8,11-15,18-21H,5-7H2/t11-,12-,13+,14-,15-/m1/s1 WPFITTLTJVKKMN-UXXRCYHCSA-N 50608225 CHEMBL5282473 Cholinesterase 16000 ChEMBL 10.7270/Q2XS60M8 35028560 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50608225 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50608225&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171354664 494497973 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51510774 OC[C@H]1O[C@@H](OCCn2cnc3ccccc23)[C@H](O)[C@@H](O)[C@H]1O InChI=1S/C15H20N2O6/c18-7-11-12(19)13(20)14(21)15(23-11)22-6-5-17-8-16-9-3-1-2-4-10(9)17/h1-4,8,11-15,18-21H,5-7H2/t11-,12+,13+,14-,15-/m1/s1 WPFITTLTJVKKMN-GZBLMMOJSA-N 50608226 CHEMBL5269935 Cholinesterase 782000 ChEMBL 10.7270/Q2XS60M8 35028560 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50608226 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50608226&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171343882 494497974 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51510775 OC[C@H]1O[C@@H](OCCN2CN(Cc3ccccc3)c3ccccc23)[C@H](O)[C@@H](O)[C@H]1O InChI=1S/C22H28N2O6/c25-13-18-19(26)20(27)21(28)22(30-18)29-11-10-23-14-24(12-15-6-2-1-3-7-15)17-9-5-4-8-16(17)23/h1-9,18-22,25-28H,10-14H2/t18-,19+,20+,21-,22-/m1/s1 YRAXQDBZLUSJNH-CDJZJNNCSA-N 50608227 CHEMBL5287005 Cholinesterase 26000 ChEMBL 10.7270/Q2XS60M8 35028560 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50608227 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50608227&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171347511 494497975 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51510776 OC[C@H]1O[C@@H](OCCN2CN(Cc3ccccc3)c3ccccc23)[C@H](O)[C@@H](O)[C@@H]1O InChI=1S/C22H28N2O6/c25-13-18-19(26)20(27)21(28)22(30-18)29-11-10-23-14-24(12-15-6-2-1-3-7-15)17-9-5-4-8-16(17)23/h1-9,18-22,25-28H,10-14H2/t18-,19-,20+,21-,22-/m1/s1 YRAXQDBZLUSJNH-QMCAAQAGSA-N 50608228 CHEMBL5287059 Cholinesterase 52000 ChEMBL 10.7270/Q2XS60M8 35028560 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50608228 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50608228&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171348711 494497976 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51510788 OC[C@H]1O[C@@H](OCc2cn(CCCCCCn3c4ccccc4c(=O)c4ccccc34)nn2)[C@H](O)[C@@H](O)[C@@H]1O InChI=1S/C28H34N4O7/c33-16-23-25(35)26(36)27(37)28(39-23)38-17-18-15-31(30-29-18)13-7-1-2-8-14-32-21-11-5-3-9-19(21)24(34)20-10-4-6-12-22(20)32/h3-6,9-12,15,23,25-28,33,35-37H,1-2,7-8,13-14,16-17H2/t23-,25-,26+,27-,28-/m1/s1 RMGZJOOLYDJVIL-TWHDSSIESA-N 50608229 CHEMBL5285294 Cholinesterase 29280 ChEMBL 10.7270/Q2XS60M8 35028560 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50608229 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50608229&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171347425 494497977 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51510789 COc1ccc2n(CCCCCCn3cc(CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)nn3)c3ccccc3c(=O)c2c1 InChI=1S/C29H36N4O8/c1-39-19-10-11-23-21(14-19)25(35)20-8-4-5-9-22(20)33(23)13-7-3-2-6-12-32-15-18(30-31-32)17-40-29-28(38)27(37)26(36)24(16-34)41-29/h4-5,8-11,14-15,24,26-29,34,36-38H,2-3,6-7,12-13,16-17H2,1H3/t24-,26-,27+,28-,29-/m1/s1 DJNZZNYZBBSJAV-KRZJEZTLSA-N 50608230 CHEMBL5272180 Cholinesterase 82350 ChEMBL 10.7270/Q2XS60M8 35028560 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50608230 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50608230&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171345495 494497978 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51510790 OC[C@H]1O[C@@H](OCc2cn(CCCCCCn3c4ccccc4c(=O)c4ccccc34)nn2)[C@H](O)[C@@H](O)[C@H]1O InChI=1S/C28H34N4O7/c33-16-23-25(35)26(36)27(37)28(39-23)38-17-18-15-31(30-29-18)13-7-1-2-8-14-32-21-11-5-3-9-19(21)24(34)20-10-4-6-12-22(20)32/h3-6,9-12,15,23,25-28,33,35-37H,1-2,7-8,13-14,16-17H2/t23-,25+,26+,27-,28-/m1/s1 RMGZJOOLYDJVIL-FWZZJMFBSA-N 50608231 CHEMBL5276886 Cholinesterase 38330 ChEMBL 10.7270/Q2XS60M8 35028560 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50608231 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50608231&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171353626 494497979 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51510791 COc1ccc2n(CCCCCCn3cc(CO[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)nn3)c3ccccc3c(=O)c2c1 InChI=1S/C29H36N4O8/c1-39-19-10-11-23-21(14-19)25(35)20-8-4-5-9-22(20)33(23)13-7-3-2-6-12-32-15-18(30-31-32)17-40-29-28(38)27(37)26(36)24(16-34)41-29/h4-5,8-11,14-15,24,26-29,34,36-38H,2-3,6-7,12-13,16-17H2,1H3/t24-,26+,27+,28-,29-/m1/s1 DJNZZNYZBBSJAV-IJEKCQKQSA-N 50608232 CHEMBL5281598 Cholinesterase 65610 ChEMBL 10.7270/Q2XS60M8 35028560 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50608232 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50608232&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171355725 494497980 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51510792 OC[C@H]1O[C@@H](OCc2cn(CCCCCCn3c4ccccc4c(=O)c4ccccc34)nn2)[C@H](O)[C@@H]1O InChI=1S/C27H32N4O6/c32-16-23-25(34)26(35)27(37-23)36-17-18-15-30(29-28-18)13-7-1-2-8-14-31-21-11-5-3-9-19(21)24(33)20-10-4-6-12-22(20)31/h3-6,9-12,15,23,25-27,32,34-35H,1-2,7-8,13-14,16-17H2/t23-,25-,26-,27-/m1/s1 SNQHIOZVZHTROC-MIRJVGOZSA-N 50608233 CHEMBL5268833 Cholinesterase 6950 ChEMBL 10.7270/Q2XS60M8 35028560 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50608233 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50608233&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171344183 494497981 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51510793 COc1ccc2n(CCCCCCn3cc(CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H]4O)nn3)c3ccccc3c(=O)c2c1 InChI=1S/C28H34N4O7/c1-37-19-10-11-23-21(14-19)25(34)20-8-4-5-9-22(20)32(23)13-7-3-2-6-12-31-15-18(29-30-31)17-38-28-27(36)26(35)24(16-33)39-28/h4-5,8-11,14-15,24,26-28,33,35-36H,2-3,6-7,12-13,16-17H2,1H3/t24-,26-,27-,28-/m1/s1 YNQYDVYRQMOADR-YULOIDQLSA-N 50608234 CHEMBL5269777 Cholinesterase 35060 ChEMBL 10.7270/Q2XS60M8 35028560 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50608234 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50608234&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171343703 494497982 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51510794 OC[C@H]1O[C@H](C[C@@H]1O)OCc1cn(CCCCCCn2c3ccccc3c(=O)c3ccccc23)nn1 InChI=1S/C27H32N4O5/c32-17-25-24(33)15-26(36-25)35-18-19-16-30(29-28-19)13-7-1-2-8-14-31-22-11-5-3-9-20(22)27(34)21-10-4-6-12-23(21)31/h3-6,9-12,16,24-26,32-33H,1-2,7-8,13-15,17-18H2/t24-,25+,26+/m0/s1 QBTMWILFWIUXSG-JIMJEQGWSA-N 50608235 CHEMBL5277903 Cholinesterase 42810 ChEMBL 10.7270/Q2XS60M8 35028560 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50608235 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50608235&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171356920 494497983 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51510795 COc1ccc2n(CCCCCCn3cc(CO[C@H]4C[C@H](O)[C@@H](CO)O4)nn3)c3ccccc3c(=O)c2c1 InChI=1S/C28H34N4O6/c1-36-20-10-11-24-22(14-20)28(35)21-8-4-5-9-23(21)32(24)13-7-3-2-6-12-31-16-19(29-30-31)18-37-27-15-25(34)26(17-33)38-27/h4-5,8-11,14,16,25-27,33-34H,2-3,6-7,12-13,15,17-18H2,1H3/t25-,26+,27+/m0/s1 AFCVZSDIZYSANN-OYUWMTPXSA-N 50608236 CHEMBL5269622 Cholinesterase 35430 ChEMBL 10.7270/Q2XS60M8 35028560 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50608236 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50608236&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171343135 494497984 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51510796 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 11682 2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::Rivastigmine.tartrate::US9586925, Rivastigmine Cholinesterase 4880 ChEMBL 10.7270/Q2XS60M8 35028560 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=11682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=11682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46512204 DB00989 C11766 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51510031 CCOc1ccc(Cc2nc3cc(ccc3n2CCN2CCCCC2)C(=O)N(CC)CC)cc1 InChI=1S/C28H38N4O2/c1-4-31(5-2)28(33)23-12-15-26-25(21-23)29-27(20-22-10-13-24(14-11-22)34-6-3)32(26)19-18-30-16-8-7-9-17-30/h10-15,21H,4-9,16-20H2,1-3H3 JRJWAARCOBEVOL-UHFFFAOYSA-N 50244242 CHEMBL4082936 Cholinesterase 2300 ChEMBL 10.7270/Q2KP86C7 33094613 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50244242 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50244242&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 22181436 104100307 CHEMBL4082936 ZINC40895028 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51510032 CCOc1ccc(Nc2nc3cc(ccc3n2CCC(C)C)C(=O)N(CC)CC)cc1 InChI=1S/C25H34N4O2/c1-6-28(7-2)24(30)19-9-14-23-22(17-19)27-25(29(23)16-15-18(4)5)26-20-10-12-21(13-11-20)31-8-3/h9-14,17-18H,6-8,15-16H2,1-5H3,(H,26,27) OIFJPDXHVAIHHP-UHFFFAOYSA-N 50244285 CHEMBL4079520 Cholinesterase 700 ChEMBL 10.7270/Q2KP86C7 33094613 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50244285 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50244285&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10224082 386403110 CHEMBL4079520 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51510033 CCOc1ccc(Cc2nc3cc(ccc3n2CCC(C)C)C(=O)N(CC)CC)cc1 InChI=1S/C26H35N3O2/c1-6-28(7-2)26(30)21-11-14-24-23(18-21)27-25(29(24)16-15-19(4)5)17-20-9-12-22(13-10-20)31-8-3/h9-14,18-19H,6-8,15-17H2,1-5H3 RLLSCGRLMPJHDQ-UHFFFAOYSA-N 50244276 2-(4-ethoxybenzyl)-N,N-diethyl-1-isopentyl-1H-benzo[d]imidazole-5-carboxamide::CHEMBL471980 Cholinesterase 9700 ChEMBL 10.7270/Q2KP86C7 33094613 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50244276 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50244276&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 22181304 104100336 CHEMBL471980 ZINC40891896 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51510034 CCN(CC)C(=O)c1ccc2n(CCC(C)C)c(Nc3ccc(Oc4ccccc4)cc3)nc2c1 InChI=1S/C29H34N4O2/c1-5-32(6-2)28(34)22-12-17-27-26(20-22)31-29(33(27)19-18-21(3)4)30-23-13-15-25(16-14-23)35-24-10-8-7-9-11-24/h7-17,20-21H,5-6,18-19H2,1-4H3,(H,30,31) ILLUCZAFFISCTI-UHFFFAOYSA-N 50244286 CHEMBL4100917 Cholinesterase 3700 ChEMBL 10.7270/Q2KP86C7 33094613 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50244286 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50244286&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137658648 386403111 CHEMBL4100917 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51510841 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCCOCCc1ccc(O)c(O)c1 InChI=1S/C20H33NO7/c22-13-15-19(26)20(27)18(25)12-21(15)8-3-1-2-4-9-28-10-7-14-5-6-16(23)17(24)11-14/h5-6,11,15,18-20,22-27H,1-4,7-10,12-13H2/t15-,18+,19-,20-/m1/s1 BNODKYGSZPQCMM-XWPNQZOQSA-N 50608264 CHEMBL5278016 Cholinesterase 76000 ChEMBL 10.7270/Q2XS60M8 35028560 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50608264 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50608264&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171354051 494498012 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51510842 COc1ccc(CCOCCCCCCN2C[C@H](O)[C@@H](O)[C@H](O)[C@H]2CO)cc1OC InChI=1S/C22H37NO7/c1-28-19-8-7-16(13-20(19)29-2)9-12-30-11-6-4-3-5-10-23-14-18(25)22(27)21(26)17(23)15-24/h7-8,13,17-18,21-22,24-27H,3-6,9-12,14-15H2,1-2H3/t17-,18+,21-,22-/m1/s1 NLRSNKAPKGHQQO-GMQQQROESA-N 50608261 CHEMBL5290892 Cholinesterase 1900 ChEMBL 10.7270/Q2XS60M8 35028560 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50608261 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50608261&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171358502 494498009 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51510843 COc1cc(CCOCCCCCCN2C[C@H](O)[C@@H](O)[C@H](O)[C@H]2CO)ccc1O InChI=1S/C21H35NO7/c1-28-19-12-15(6-7-17(19)24)8-11-29-10-5-3-2-4-9-22-13-18(25)21(27)20(26)16(22)14-23/h6-7,12,16,18,20-21,23-27H,2-5,8-11,13-14H2,1H3/t16-,18+,20-,21-/m1/s1 YSSJHLHLKSOZKJ-XRULBBBTSA-N 50608262 CHEMBL5287031 Cholinesterase 1800 ChEMBL 10.7270/Q2XS60M8 35028560 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50608262 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50608262&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171347827 494498010 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51510844 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCCOCCc1ccc2OCOc2c1 InChI=1S/C21H33NO7/c23-13-16-20(25)21(26)17(24)12-22(16)8-3-1-2-4-9-27-10-7-15-5-6-18-19(11-15)29-14-28-18/h5-6,11,16-17,20-21,23-26H,1-4,7-10,12-14H2/t16-,17+,20-,21-/m1/s1 YBWJGSABCCVGGV-HRQSHJORSA-N 50608263 CHEMBL5282299 Cholinesterase 7300 ChEMBL 10.7270/Q2XS60M8 35028560 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50608263 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50608263&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171355008 494498011 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51510845 OC[C@H]1NC[C@H](O)[C@@H](O)[C@@H]1O InChI=1S/C6H13NO4/c8-2-3-5(10)6(11)4(9)1-7-3/h3-11H,1-2H2/t3-,4+,5-,6-/m1/s1 LXBIFEVIBLOUGU-JGWLITMVSA-N 18351 (2R,3R,4R,5S)-2-(Hydroxymethyl)piperidine-3,4,5-triol, 10::(2R,3R,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-triol::1-Deoxynojirimycin::1-deoxynojirimycin (DNJ)::CHEMBL307429::US20230339856, Compound DNJ::US9181184, 1::dNM Cholinesterase 10000 ChEMBL 10.7270/Q2XS60M8 35028560 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=18351 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=18351&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search DNJ 1DIE,1DOG,1I75,1OIM,2J77,2JKE,2PWD,3GBE,3GXT 29435 46518429 44369 CHEMBL307429 4642 C16843 ZINC03794714 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516179 CN1CCN(CCOc2cccc3ccccc23)CC1 InChI=1S/C17H22N2O/c1-18-9-11-19(12-10-18)13-14-20-17-8-4-6-15-5-2-3-7-16(15)17/h2-8H,9-14H2,1H3 ARHNYWFGGRZJSZ-UHFFFAOYSA-N 50610171 CHEMBL5276899 Cholinesterase 58900 ChEMBL 10.7270/Q21Z48MG 36542960 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610171 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610171&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 915667 494499919 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516180 CN1CCN(CCCOc2cccc3ccccc23)CC1 InChI=1S/C18H24N2O/c1-19-11-13-20(14-12-19)10-5-15-21-18-9-4-7-16-6-2-3-8-17(16)18/h2-4,6-9H,5,10-15H2,1H3 UMAVHQYYCPAJTL-UHFFFAOYSA-N 50610172 CHEMBL5267271 Cholinesterase 78500 ChEMBL 10.7270/Q21Z48MG 36542960 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610172 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610172&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 16282943 494499920 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516181 CN1CCN(CCCOc2ccc3ccccc3c2)CC1 InChI=1S/C18H24N2O/c1-19-10-12-20(13-11-19)9-4-14-21-18-8-7-16-5-2-3-6-17(16)15-18/h2-3,5-8,15H,4,9-14H2,1H3 QXTADKACYIMHII-UHFFFAOYSA-N 50610173 CHEMBL5280702 Cholinesterase 26300 ChEMBL 10.7270/Q21Z48MG 36542960 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610173 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610173&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 141430236 494499921 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516182 C(COc1ccc2ccccc2c1)CN1CCN(CC1)c1ccccc1 InChI=1S/C23H26N2O/c1-2-9-22(10-3-1)25-16-14-24(15-17-25)13-6-18-26-23-12-11-20-7-4-5-8-21(20)19-23/h1-5,7-12,19H,6,13-18H2 YNOWHDNGRNBDQJ-UHFFFAOYSA-N 50610174 CHEMBL4293814 Cholinesterase 53700 ChEMBL 10.7270/Q21Z48MG 36542960 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610174 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610174&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3069152 494499922 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516183 C(CN1CCN(CC1)c1ccncc1)Oc1cccc2ccccc12 InChI=1S/C21H23N3O/c1-2-6-20-18(4-1)5-3-7-21(20)25-17-16-23-12-14-24(15-13-23)19-8-10-22-11-9-19/h1-11H,12-17H2 JVLSKMYKWQOOKP-UHFFFAOYSA-N 50610168 CHEMBL5289654 Cholinesterase 40700 ChEMBL 10.7270/Q21Z48MG 36542960 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610168 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610168&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171349388 494499916 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516184 CN1CCN(CCOC(=O)c2ccc3ccccc3c2)CC1 InChI=1S/C18H22N2O2/c1-19-8-10-20(11-9-19)12-13-22-18(21)17-7-6-15-4-2-3-5-16(15)14-17/h2-7,14H,8-13H2,1H3 XANINQRTAHTGQS-UHFFFAOYSA-N 50610175 CHEMBL5283987 Cholinesterase 57500 ChEMBL 10.7270/Q21Z48MG 36542960 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610175 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610175&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171347359 494499923 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516185 CN1CCN(CCCOC(=O)c2ccc3ccccc3c2)CC1 InChI=1S/C19H24N2O2/c1-20-10-12-21(13-11-20)9-4-14-23-19(22)18-8-7-16-5-2-3-6-17(16)15-18/h2-3,5-8,15H,4,9-14H2,1H3 XGWTYMRRVDFIEO-UHFFFAOYSA-N 50610169 CHEMBL5270151 Cholinesterase 43700 ChEMBL 10.7270/Q21Z48MG 36542960 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610169 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610169&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171343774 494499917 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516186 O=C(OCCCN1CCN(CC1)c1ccncc1)c1cc2ccccc2o1 InChI=1S/C21H23N3O3/c25-21(20-16-17-4-1-2-5-19(17)27-20)26-15-3-10-23-11-13-24(14-12-23)18-6-8-22-9-7-18/h1-2,4-9,16H,3,10-15H2 LHUNAHOZEVLINA-UHFFFAOYSA-N 50610170 CHEMBL5278711 Cholinesterase 97700 ChEMBL 10.7270/Q21Z48MG 36542960 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610170 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610170&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171357818 494499918 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516187 O=C(NCCCN1CCN(CC1)c1ccncc1)c1cc2ccccc2o1 InChI=1S/C21H24N4O2/c26-21(20-16-17-4-1-2-5-19(17)27-20)23-8-3-11-24-12-14-25(15-13-24)18-6-9-22-10-7-18/h1-2,4-7,9-10,16H,3,8,11-15H2,(H,23,26) RQSAPWKYJYONRT-UHFFFAOYSA-N 50610176 CHEMBL5265920 Cholinesterase 85100 ChEMBL 10.7270/Q21Z48MG 36542960 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610176 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610176&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171349427 494499924 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516188 CN(C)C(=O)Oc1cccc(c1)[N+](C)(C)C InChI=1S/C12H19N2O2/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5/h6-9H,1-5H3/q+1 ALWKGYPQUAPLQC-UHFFFAOYSA-N 50022775 (m-Hydroxyphenyl)trimethylammonium dimethylcarbamate::3-Trimethylammoniumphenyl N,N-dimethylcarbamate::3-[(dimethylcarbamoyl)oxy]-N,N,N-trimethylanilinium::CHEMBL211471::CHEMBL278020::Eustigmin::Eustigmine::NEOSTIGMINE::Neostigmine (2)::Prostigmine::Vagostigmine::m-Trimethylammoniumphenyldimethylcarbamate Cholinesterase 160 ChEMBL 10.7270/Q21Z48MG 36542960 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50022775 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50022775&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 4456 103933337 7514 CHEMBL278020CHEMBL211471 DB01400 C08200 ZINC00001792 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516189 CC(C)N1CCN(CCCCOc2ccc3CCC(=O)Nc3c2)CC1 InChI=1S/C20H31N3O2/c1-16(2)23-12-10-22(11-13-23)9-3-4-14-25-18-7-5-17-6-8-20(24)21-19(17)15-18/h5,7,15-16H,3-4,6,8-14H2,1-2H3,(H,21,24) BCUWRSBWUJESED-UHFFFAOYSA-N 50252541 CHEMBL4069293 Cholinesterase 16700 ChEMBL 10.7270/Q21Z48MG 36542960 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50252541 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50252541&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 137634210 401957579 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521363 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCCN(Cc3ccccc3)C2)c1 InChI=1S/C27H28N4O2/c1-20-12-13-24(16-28-20)26-29-27(33-30-26)23-10-5-11-25(15-23)32-19-22-9-6-14-31(18-22)17-21-7-3-2-4-8-21/h2-5,7-8,10-13,15-16,22H,6,9,14,17-19H2,1H3 YVCBUESKYLIDNI-UHFFFAOYSA-N 50612502 CHEMBL5280515 Cholinesterase 2780 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612502 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612502&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171354146 494502250 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521364 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCCN(Cc3ccc(F)cc3)C2)c1 InChI=1S/C27H27FN4O2/c1-19-7-10-23(15-29-19)26-30-27(34-31-26)22-5-2-6-25(14-22)33-18-21-4-3-13-32(17-21)16-20-8-11-24(28)12-9-20/h2,5-12,14-15,21H,3-4,13,16-18H2,1H3 DGKHCYVXQXVNFK-UHFFFAOYSA-N 50612503 CHEMBL5277070 Cholinesterase 4280 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612503 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612503&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171354411 494502251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521365 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCCN(Cc3ccccc3F)C2)c1 InChI=1S/C27H27FN4O2/c1-19-11-12-22(15-29-19)26-30-27(34-31-26)21-8-4-9-24(14-21)33-18-20-6-5-13-32(16-20)17-23-7-2-3-10-25(23)28/h2-4,7-12,14-15,20H,5-6,13,16-18H2,1H3 LGVNBMYDEARTLD-UHFFFAOYSA-N 50612504 CHEMBL5277040 Cholinesterase 17630 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612504 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612504&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171353633 494502252 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521366 Cc1ccc(CN2CCCC(COc3cccc(c3)-c3nc(no3)-c3ccc(C)nc3)C2)cc1 InChI=1S/C28H30N4O2/c1-20-8-11-22(12-9-20)17-32-14-4-5-23(18-32)19-33-26-7-3-6-24(15-26)28-30-27(31-34-28)25-13-10-21(2)29-16-25/h3,6-13,15-16,23H,4-5,14,17-19H2,1-2H3 GOTPCGVBBMRUMR-UHFFFAOYSA-N 50612505 CHEMBL5276717 Cholinesterase >100000 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612505 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612505&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171353611 494502253 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521367 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCN(Cc3ccccc3)CC2)c1 InChI=1S/C27H28N4O2/c1-20-10-11-24(17-28-20)26-29-27(33-30-26)23-8-5-9-25(16-23)32-19-22-12-14-31(15-13-22)18-21-6-3-2-4-7-21/h2-11,16-17,22H,12-15,18-19H2,1H3 RIKQUJZHAZWONQ-UHFFFAOYSA-N 50612506 CHEMBL5278549 Cholinesterase 5050 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612506 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612506&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171353332 494502254 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521368 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCN(Cc3ccc(F)cc3)CC2)c1 InChI=1S/C27H27FN4O2/c1-19-5-8-23(16-29-19)26-30-27(34-31-26)22-3-2-4-25(15-22)33-18-21-11-13-32(14-12-21)17-20-6-9-24(28)10-7-20/h2-10,15-16,21H,11-14,17-18H2,1H3 OIQWPSGFYFVEPC-UHFFFAOYSA-N 50612507 CHEMBL5267104 Cholinesterase 1360 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612507 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612507&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171349282 494502255 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521369 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCN(Cc3ccccc3F)CC2)c1 InChI=1S/C27H27FN4O2/c1-19-9-10-22(16-29-19)26-30-27(34-31-26)21-6-4-7-24(15-21)33-18-20-11-13-32(14-12-20)17-23-5-2-3-8-25(23)28/h2-10,15-16,20H,11-14,17-18H2,1H3 DSACCWNHUDYWJF-UHFFFAOYSA-N 50612508 CHEMBL5266237 Cholinesterase 15500 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612508 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612508&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171349231 494502256 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521370 Cc1ccc(CN2CCC(COc3cccc(c3)-c3nc(no3)-c3ccc(C)nc3)CC2)cc1 InChI=1S/C28H30N4O2/c1-20-6-9-22(10-7-20)18-32-14-12-23(13-15-32)19-33-26-5-3-4-24(16-26)28-30-27(31-34-28)25-11-8-21(2)29-17-25/h3-11,16-17,23H,12-15,18-19H2,1-2H3 QWLVCNXTBRNRDJ-UHFFFAOYSA-N 50612509 CHEMBL5268419 Cholinesterase 6340 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612509 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612509&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171342631 494502257 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521371 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCCN(C2)C(=O)c2ccccc2)c1 InChI=1S/C27H26N4O3/c1-19-12-13-23(16-28-19)25-29-26(34-30-25)22-10-5-11-24(15-22)33-18-20-7-6-14-31(17-20)27(32)21-8-3-2-4-9-21/h2-5,8-13,15-16,20H,6-7,14,17-18H2,1H3 QWRMNXGOONBATM-UHFFFAOYSA-N 50612510 CHEMBL5285224 Cholinesterase 13820 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612510 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612510&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171346402 494502258 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521372 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCCN(C2)C(=O)c2ccc(F)cc2)c1 InChI=1S/C27H25FN4O3/c1-18-7-8-22(15-29-18)25-30-26(35-31-25)21-5-2-6-24(14-21)34-17-19-4-3-13-32(16-19)27(33)20-9-11-23(28)12-10-20/h2,5-12,14-15,19H,3-4,13,16-17H2,1H3 PUYUYZSBFPDXTD-UHFFFAOYSA-N 50612511 CHEMBL5272166 Cholinesterase 5780 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612511 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612511&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171342764 494502259 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521373 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCN(CC2)C(=O)c2ccccc2)c1 InChI=1S/C27H26N4O3/c1-19-10-11-23(17-28-19)25-29-26(34-30-25)22-8-5-9-24(16-22)33-18-20-12-14-31(15-13-20)27(32)21-6-3-2-4-7-21/h2-11,16-17,20H,12-15,18H2,1H3 RQSNRGUMBXCABQ-UHFFFAOYSA-N 50612512 CHEMBL5288173 Cholinesterase >100000 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612512 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612512&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171349330 494502260 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521374 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCN(CC2)C(=O)c2ccc(F)cc2)c1 InChI=1S/C27H25FN4O3/c1-18-5-6-22(16-29-18)25-30-26(35-31-25)21-3-2-4-24(15-21)34-17-19-11-13-32(14-12-19)27(33)20-7-9-23(28)10-8-20/h2-10,15-16,19H,11-14,17H2,1H3 OPPZOXFJKGKBKI-UHFFFAOYSA-N 50612513 CHEMBL5287317 Cholinesterase >100000 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612513 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612513&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171347842 494502261 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521375 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCN(Cc3ccncc3)CC2)c1 InChI=1S/C26H27N5O2/c1-19-5-6-23(16-28-19)25-29-26(33-30-25)22-3-2-4-24(15-22)32-18-21-9-13-31(14-10-21)17-20-7-11-27-12-8-20/h2-8,11-12,15-16,21H,9-10,13-14,17-18H2,1H3 YJNJRWGHRGRQMS-UHFFFAOYSA-N 50612514 CHEMBL5274660 Cholinesterase >100000 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612514 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612514&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171357590 494502262 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521376 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCN(Cc3cccnc3)CC2)c1 InChI=1S/C26H27N5O2/c1-19-7-8-23(16-28-19)25-29-26(33-30-25)22-5-2-6-24(14-22)32-18-20-9-12-31(13-10-20)17-21-4-3-11-27-15-21/h2-8,11,14-16,20H,9-10,12-13,17-18H2,1H3 XNWGYPZKFKDPQN-UHFFFAOYSA-N 50612515 CHEMBL5271902 Cholinesterase 3930 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612515 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612515&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171344486 494502263 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521377 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCN(Cc3ccccn3)CC2)c1 InChI=1S/C26H27N5O2/c1-19-8-9-22(16-28-19)25-29-26(33-30-25)21-5-4-7-24(15-21)32-18-20-10-13-31(14-11-20)17-23-6-2-3-12-27-23/h2-9,12,15-16,20H,10-11,13-14,17-18H2,1H3 XVVRRZYAUSJKMF-UHFFFAOYSA-N 50612516 CHEMBL5275023 Cholinesterase 5030 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612516 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612516&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171356496 494502264 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521378 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCN(Cc3ccco3)CC2)c1 InChI=1S/C25H26N4O3/c1-18-7-8-21(15-26-18)24-27-25(32-28-24)20-4-2-5-22(14-20)31-17-19-9-11-29(12-10-19)16-23-6-3-13-30-23/h2-8,13-15,19H,9-12,16-17H2,1H3 LDLLUDZHMHZSLM-UHFFFAOYSA-N 50612517 CHEMBL5272719 Cholinesterase >100000 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612517 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612517&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171345209 494502265 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521379 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCN(Cc3ccc(Cl)o3)CC2)c1 InChI=1S/C25H25ClN4O3/c1-17-5-6-20(14-27-17)24-28-25(33-29-24)19-3-2-4-21(13-19)31-16-18-9-11-30(12-10-18)15-22-7-8-23(26)32-22/h2-8,13-14,18H,9-12,15-16H2,1H3 ZRUKHRCMPDNXJF-UHFFFAOYSA-N 50612518 CHEMBL5284011 Cholinesterase >100000 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612518 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612518&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171347698 494502266 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521380 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCN(Cc3ccc(Br)o3)CC2)c1 InChI=1S/C25H25BrN4O3/c1-17-5-6-20(14-27-17)24-28-25(33-29-24)19-3-2-4-21(13-19)31-16-18-9-11-30(12-10-18)15-22-7-8-23(26)32-22/h2-8,13-14,18H,9-12,15-16H2,1H3 NHNZJVAEHOCOHY-UHFFFAOYSA-N 50612519 CHEMBL5268927 Cholinesterase >100000 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612519 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612519&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171343646 494502267 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521381 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCN(Cc3cccc(F)c3)CC2)c1 InChI=1S/C27H27FN4O2/c1-19-8-9-23(16-29-19)26-30-27(34-31-26)22-5-3-7-25(15-22)33-18-20-10-12-32(13-11-20)17-21-4-2-6-24(28)14-21/h2-9,14-16,20H,10-13,17-18H2,1H3 RRSJHXGJAMBCDJ-UHFFFAOYSA-N 50612520 CHEMBL5278087 Cholinesterase 8150 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612520 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612520&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 166176937 494502268 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521382 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCN(Cc3ccc(Cl)cc3)CC2)c1 InChI=1S/C27H27ClN4O2/c1-19-5-8-23(16-29-19)26-30-27(34-31-26)22-3-2-4-25(15-22)33-18-21-11-13-32(14-12-21)17-20-6-9-24(28)10-7-20/h2-10,15-16,21H,11-14,17-18H2,1H3 YBROPVSGNAMDAJ-UHFFFAOYSA-N 50612521 CHEMBL5276157 Cholinesterase >100000 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612521 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612521&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171354783 494502269 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521383 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCN(Cc3cccc(Cl)c3)CC2)c1 InChI=1S/C27H27ClN4O2/c1-19-8-9-23(16-29-19)26-30-27(34-31-26)22-5-3-7-25(15-22)33-18-20-10-12-32(13-11-20)17-21-4-2-6-24(28)14-21/h2-9,14-16,20H,10-13,17-18H2,1H3 PWCVVXOCMDDQGK-UHFFFAOYSA-N 50612522 CHEMBL5272544 Cholinesterase >100000 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612522 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612522&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171345501 494502270 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521384 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCN(Cc3ccccc3Cl)CC2)c1 InChI=1S/C27H27ClN4O2/c1-19-9-10-22(16-29-19)26-30-27(34-31-26)21-6-4-7-24(15-21)33-18-20-11-13-32(14-12-20)17-23-5-2-3-8-25(23)28/h2-10,15-16,20H,11-14,17-18H2,1H3 DOTWPYOPUGDXID-UHFFFAOYSA-N 50612523 CHEMBL5290940 Cholinesterase >100000 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612523 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612523&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171358752 494502271 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521385 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCN(Cc3ccc(Br)cc3)CC2)c1 InChI=1S/C27H27BrN4O2/c1-19-5-8-23(16-29-19)26-30-27(34-31-26)22-3-2-4-25(15-22)33-18-21-11-13-32(14-12-21)17-20-6-9-24(28)10-7-20/h2-10,15-16,21H,11-14,17-18H2,1H3 SUTNDXYGNDUVJE-UHFFFAOYSA-N 50612524 CHEMBL5274352 Cholinesterase >100000 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612524 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612524&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171352195 494502272 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521386 COc1ccc(CN2CCC(COc3cccc(c3)-c3nc(no3)-c3ccc(C)nc3)CC2)cc1 InChI=1S/C28H30N4O3/c1-20-6-9-24(17-29-20)27-30-28(35-31-27)23-4-3-5-26(16-23)34-19-22-12-14-32(15-13-22)18-21-7-10-25(33-2)11-8-21/h3-11,16-17,22H,12-15,18-19H2,1-2H3 GPEQQKCVTCOVJC-UHFFFAOYSA-N 50612525 CHEMBL5272152 Cholinesterase >100000 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612525 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612525&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171344586 494502273 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521387 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCN(Cc3ccc(cc3)C(C)(C)C)CC2)c1 InChI=1S/C31H36N4O2/c1-22-8-11-26(19-32-22)29-33-30(37-34-29)25-6-5-7-28(18-25)36-21-24-14-16-35(17-15-24)20-23-9-12-27(13-10-23)31(2,3)4/h5-13,18-19,24H,14-17,20-21H2,1-4H3 HQTQXRVUVNCUOH-UHFFFAOYSA-N 50612526 CHEMBL5291348 Cholinesterase >100000 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612526 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612526&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171351968 494502274 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521388 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCN(Cc3ccc(cc3)C#N)CC2)c1 InChI=1S/C28H27N5O2/c1-20-5-10-25(17-30-20)27-31-28(35-32-27)24-3-2-4-26(15-24)34-19-23-11-13-33(14-12-23)18-22-8-6-21(16-29)7-9-22/h2-10,15,17,23H,11-14,18-19H2,1H3 RBLQYFTYDOKZCN-UHFFFAOYSA-N 50612527 CHEMBL5280556 Cholinesterase >100000 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612527 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612527&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171355669 494502275 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521389 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCN(Cc3ccc(cc3)C(F)(F)F)CC2)c1 InChI=1S/C28H27F3N4O2/c1-19-5-8-23(16-32-19)26-33-27(37-34-26)22-3-2-4-25(15-22)36-18-21-11-13-35(14-12-21)17-20-6-9-24(10-7-20)28(29,30)31/h2-10,15-16,21H,11-14,17-18H2,1H3 IHIQYDMXXQKQSS-UHFFFAOYSA-N 50612528 CHEMBL5275542 Cholinesterase >100000 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612528 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612528&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171357642 494502276 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521390 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCN(Cc3ccc(F)c(F)c3)CC2)c1 InChI=1S/C27H26F2N4O2/c1-18-5-7-22(15-30-18)26-31-27(35-32-26)21-3-2-4-23(14-21)34-17-19-9-11-33(12-10-19)16-20-6-8-24(28)25(29)13-20/h2-8,13-15,19H,9-12,16-17H2,1H3 UVXXPAWPKIVYJB-UHFFFAOYSA-N 50612529 CHEMBL5288942 Cholinesterase 1660 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612529 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612529&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171350548 494502277 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521391 Cc1ccc(cn1)-c1noc(n1)-c1cccc(OCC2CCN(Cc3ccc(C)c(C)c3)CC2)c1 InChI=1S/C29H32N4O2/c1-20-7-9-24(15-21(20)2)18-33-13-11-23(12-14-33)19-34-27-6-4-5-25(16-27)29-31-28(32-35-29)26-10-8-22(3)30-17-26/h4-10,15-17,23H,11-14,18-19H2,1-3H3 RRHHWYNKZWHUJZ-UHFFFAOYSA-N 50612530 CHEMBL5289187 Cholinesterase >100000 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50612530 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50612530&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171350732 494502278 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51521392 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 93 ChEMBL 10.7270/Q2BP071Z 36223681 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,8T5G,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51509805 Oc1ccc(cc1O)-c1cc2ccc(O)c(O)c2oc1=O InChI=1S/C15H10O6/c16-10-3-1-7(6-12(10)18)9-5-8-2-4-11(17)13(19)14(8)21-15(9)20/h1-6,16-19H MZSZXDSVFQKLPB-UHFFFAOYSA-N 50519770 CHEMBL3939546 Cholinesterase 8370 ChEMBL 10.7270/Q2MK6J39 32942081 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50519770 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50519770&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 85706712 440728352 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51525627 CN1CCc2c(C1)c1ccccc1n2Cc1ccccc1C(=O)NCCO[N+]([O-])=O InChI=1S/C22H24N4O4/c1-24-12-10-21-19(15-24)18-8-4-5-9-20(18)25(21)14-16-6-2-3-7-17(16)22(27)23-11-13-30-26(28)29/h2-9H,10-15H2,1H3,(H,23,27) OVUITCZDHHCZJE-UHFFFAOYSA-N 50613772 CHEMBL5281699 Cholinesterase 3680 ChEMBL 10.7270/Q2B56Q0D 30103193 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50613772 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50613772&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171353458 494503520 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516392 COc1ccc2n(CCCN(C)Cc3cccc(O)c3)cc(C=O)c2c1 InChI=1S/C21H24N2O3/c1-22(13-16-5-3-6-18(25)11-16)9-4-10-23-14-17(15-24)20-12-19(26-2)7-8-21(20)23/h3,5-8,11-12,14-15,25H,4,9-10,13H2,1-2H3 UUIKIDGBOLXMJP-UHFFFAOYSA-N 50610278 CHEMBL5269371 Cholinesterase 72310 ChEMBL 10.7270/Q2HX1HVC 36580744 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610278 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610278&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171342148 494500026 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516393 COc1ccc2n(CCCCN(C)Cc3cccc(O)c3)cc(C=O)c2c1 InChI=1S/C22H26N2O3/c1-23(14-17-6-5-7-19(26)12-17)10-3-4-11-24-15-18(16-25)21-13-20(27-2)8-9-22(21)24/h5-9,12-13,15-16,26H,3-4,10-11,14H2,1-2H3 UBVBOQTYOMMSGC-UHFFFAOYSA-N 50610279 CHEMBL5271124 Cholinesterase 42050 ChEMBL 10.7270/Q2HX1HVC 36580744 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610279 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610279&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171344440 494500027 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516394 COc1ccc2n(CCCCCN(C)Cc3cccc(O)c3)cc(C=O)c2c1 InChI=1S/C23H28N2O3/c1-24(15-18-7-6-8-20(27)13-18)11-4-3-5-12-25-16-19(17-26)22-14-21(28-2)9-10-23(22)25/h6-10,13-14,16-17,27H,3-5,11-12,15H2,1-2H3 SCJPWOHLZTWEMQ-UHFFFAOYSA-N 50610256 CHEMBL5278416 Cholinesterase 45360 ChEMBL 10.7270/Q2HX1HVC 36580744 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610256 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610256&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171355251 494500004 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516395 COc1ccc2n(CCCCCCN(C)Cc3cccc(O)c3)cc(C=O)c2c1 InChI=1S/C24H30N2O3/c1-25(16-19-8-7-9-21(28)14-19)12-5-3-4-6-13-26-17-20(18-27)23-15-22(29-2)10-11-24(23)26/h7-11,14-15,17-18,28H,3-6,12-13,16H2,1-2H3 HVLDVNGIFMTEMF-UHFFFAOYSA-N 50610257 CHEMBL5285258 Cholinesterase 16210 ChEMBL 10.7270/Q2HX1HVC 36580744 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610257 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610257&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171346898 494500005 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516396 COc1ccc2n(CCCCCCCN(C)Cc3cccc(O)c3)cc(C=O)c2c1 InChI=1S/C25H32N2O3/c1-26(17-20-9-8-10-22(29)15-20)13-6-4-3-5-7-14-27-18-21(19-28)24-16-23(30-2)11-12-25(24)27/h8-12,15-16,18-19,29H,3-7,13-14,17H2,1-2H3 OHBHEABPPWROKD-UHFFFAOYSA-N 50610258 CHEMBL5272675 Cholinesterase 5470 ChEMBL 10.7270/Q2HX1HVC 36580744 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610258 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610258&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171347899 494500006 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516397 COc1ccc2n(CCCCCCCCN(C)Cc3cccc(O)c3)cc(C=O)c2c1 InChI=1S/C26H34N2O3/c1-27(18-21-10-9-11-23(30)16-21)14-7-5-3-4-6-8-15-28-19-22(20-29)25-17-24(31-2)12-13-26(25)28/h9-13,16-17,19-20,30H,3-8,14-15,18H2,1-2H3 OIIHAUYKICHNQI-UHFFFAOYSA-N 50610259 CHEMBL5271644 Cholinesterase 5260 ChEMBL 10.7270/Q2HX1HVC 36580744 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610259 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610259&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171344358 494500007 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516398 COc1ccc2n(CCCCCCCCCN(C)Cc3cccc(O)c3)cc(C=O)c2c1 InChI=1S/C27H36N2O3/c1-28(19-22-11-10-12-24(31)17-22)15-8-6-4-3-5-7-9-16-29-20-23(21-30)26-18-25(32-2)13-14-27(26)29/h10-14,17-18,20-21,31H,3-9,15-16,19H2,1-2H3 WWKQQRVQGOUIMX-UHFFFAOYSA-N 50610260 CHEMBL5284235 Cholinesterase 1630 ChEMBL 10.7270/Q2HX1HVC 36580744 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610260 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610260&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171345623 494500008 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516399 COc1ccc2n(CCCCCCCCCCN(C)Cc3cccc(O)c3)cc(C=O)c2c1 InChI=1S/C28H38N2O3/c1-29(20-23-12-11-13-25(32)18-23)16-9-7-5-3-4-6-8-10-17-30-21-24(22-31)27-19-26(33-2)14-15-28(27)30/h11-15,18-19,21-22,32H,3-10,16-17,20H2,1-2H3 QAMABQFUDMLHGO-UHFFFAOYSA-N 50610261 CHEMBL5283851 Cholinesterase 610 ChEMBL 10.7270/Q2HX1HVC 36580744 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610261 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610261&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171347947 494500009 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516400 COc1ccc2n(CCCCCCCCCCCCN(C)Cc3cccc(O)c3)cc(C=O)c2c1 InChI=1S/C30H42N2O3/c1-31(22-25-14-13-15-27(34)20-25)18-11-9-7-5-3-4-6-8-10-12-19-32-23-26(24-33)29-21-28(35-2)16-17-30(29)32/h13-17,20-21,23-24,34H,3-12,18-19,22H2,1-2H3 QMEQQKSEEYBQTB-UHFFFAOYSA-N 50610262 CHEMBL5272912 Cholinesterase 310 ChEMBL 10.7270/Q2HX1HVC 36580744 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610262 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610262&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171346541 494500010 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516401 COc1ccc2n(CCCN(C)Cc3ccc(O)cc3)cc(C=O)c2c1 InChI=1S/C21H24N2O3/c1-22(13-16-4-6-18(25)7-5-16)10-3-11-23-14-17(15-24)20-12-19(26-2)8-9-21(20)23/h4-9,12,14-15,25H,3,10-11,13H2,1-2H3 KIDBZORHLSMJNX-UHFFFAOYSA-N 50610263 CHEMBL5275374 Cholinesterase 6530 ChEMBL 10.7270/Q2HX1HVC 36580744 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610263 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610263&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171357255 494500011 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516402 COc1ccc2n(CCCCN(C)Cc3ccc(O)cc3)cc(C=O)c2c1 InChI=1S/C22H26N2O3/c1-23(14-17-5-7-19(26)8-6-17)11-3-4-12-24-15-18(16-25)21-13-20(27-2)9-10-22(21)24/h5-10,13,15-16,26H,3-4,11-12,14H2,1-2H3 XZNWUWXGFNBZLY-UHFFFAOYSA-N 50610264 CHEMBL5271051 Cholinesterase 20060 ChEMBL 10.7270/Q2HX1HVC 36580744 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610264 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610264&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171342462 494500012 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516403 COc1ccc2n(CCCCCN(C)Cc3ccc(O)cc3)cc(C=O)c2c1 InChI=1S/C23H28N2O3/c1-24(15-18-6-8-20(27)9-7-18)12-4-3-5-13-25-16-19(17-26)22-14-21(28-2)10-11-23(22)25/h6-11,14,16-17,27H,3-5,12-13,15H2,1-2H3 PMPUNYZBCHYZRZ-UHFFFAOYSA-N 50610265 CHEMBL5276803 Cholinesterase 6190 ChEMBL 10.7270/Q2HX1HVC 36580744 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610265 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610265&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171356557 494500013 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516404 COc1ccc2n(CCCCCCN(C)Cc3ccc(O)cc3)cc(C=O)c2c1 InChI=1S/C24H30N2O3/c1-25(16-19-7-9-21(28)10-8-19)13-5-3-4-6-14-26-17-20(18-27)23-15-22(29-2)11-12-24(23)26/h7-12,15,17-18,28H,3-6,13-14,16H2,1-2H3 ATEUZIGVIWVOIX-UHFFFAOYSA-N 50610266 CHEMBL5278369 Cholinesterase 7200 ChEMBL 10.7270/Q2HX1HVC 36580744 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610266 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610266&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171353315 494500014 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516405 COc1ccc2n(CCCCCCCN(C)Cc3ccc(O)cc3)cc(C=O)c2c1 InChI=1S/C25H32N2O3/c1-26(17-20-8-10-22(29)11-9-20)14-6-4-3-5-7-15-27-18-21(19-28)24-16-23(30-2)12-13-25(24)27/h8-13,16,18-19,29H,3-7,14-15,17H2,1-2H3 QKXAMYHLNVXQGM-UHFFFAOYSA-N 50610267 CHEMBL5268704 Cholinesterase 2100 ChEMBL 10.7270/Q2HX1HVC 36580744 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610267 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610267&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171342497 494500015 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516406 COc1ccc2n(CCCCCCCCN(C)Cc3ccc(O)cc3)cc(C=O)c2c1 InChI=1S/C26H34N2O3/c1-27(18-21-9-11-23(30)12-10-21)15-7-5-3-4-6-8-16-28-19-22(20-29)25-17-24(31-2)13-14-26(25)28/h9-14,17,19-20,30H,3-8,15-16,18H2,1-2H3 FMUARSILENPDKK-UHFFFAOYSA-N 50610268 CHEMBL5280435 Cholinesterase 450 ChEMBL 10.7270/Q2HX1HVC 36580744 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610268 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610268&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171352723 494500016 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516407 COc1ccc2n(CCCCCCCCCN(C)Cc3ccc(O)cc3)cc(C=O)c2c1 InChI=1S/C27H36N2O3/c1-28(19-22-10-12-24(31)13-11-22)16-8-6-4-3-5-7-9-17-29-20-23(21-30)26-18-25(32-2)14-15-27(26)29/h10-15,18,20-21,31H,3-9,16-17,19H2,1-2H3 DZRJUXUROORQOH-UHFFFAOYSA-N 50610269 CHEMBL5286006 Cholinesterase 530 ChEMBL 10.7270/Q2HX1HVC 36580744 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610269 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610269&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171347245 494500017 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516408 COc1ccc2n(CCCCCCCCCCN(C)Cc3ccc(O)cc3)cc(C=O)c2c1 InChI=1S/C28H38N2O3/c1-29(20-23-11-13-25(32)14-12-23)17-9-7-5-3-4-6-8-10-18-30-21-24(22-31)27-19-26(33-2)15-16-28(27)30/h11-16,19,21-22,32H,3-10,17-18,20H2,1-2H3 VSDNNQHHKUMUKF-UHFFFAOYSA-N 50610270 CHEMBL5278778 Cholinesterase 120 ChEMBL 10.7270/Q2HX1HVC 36580744 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610270 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610270&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171354075 494500018 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516409 COc1ccc2n(CCCCCCCCCCCCN(C)Cc3ccc(O)cc3)cc(C=O)c2c1 InChI=1S/C30H42N2O3/c1-31(22-25-13-15-27(34)16-14-25)19-11-9-7-5-3-4-6-8-10-12-20-32-23-26(24-33)29-21-28(35-2)17-18-30(29)32/h13-18,21,23-24,34H,3-12,19-20,22H2,1-2H3 UUXMKUDVTHMKFM-UHFFFAOYSA-N 50610271 CHEMBL5283238 Cholinesterase 1040 ChEMBL 10.7270/Q2HX1HVC 36580744 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610271 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610271&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171358014 494500019 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516410 COc1cccc(CN(C)CCCCCCCCCCCCn2cc(C=O)c3cc(OC)ccc23)c1 InChI=1S/C31H44N2O3/c1-32(23-26-15-14-16-28(21-26)35-2)19-12-10-8-6-4-5-7-9-11-13-20-33-24-27(25-34)30-22-29(36-3)17-18-31(30)33/h14-18,21-22,24-25H,4-13,19-20,23H2,1-3H3 SGTOHDJJUFYUAF-UHFFFAOYSA-N 50610272 CHEMBL5276191 Cholinesterase 430 ChEMBL 10.7270/Q2HX1HVC 36580744 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610272 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610272&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171355486 494500020 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516411 COc1ccc(CN(C)CCCCCCCCCCCCn2cc(C=O)c3cc(OC)ccc23)cc1 InChI=1S/C31H44N2O3/c1-32(23-26-14-16-28(35-2)17-15-26)20-12-10-8-6-4-5-7-9-11-13-21-33-24-27(25-34)30-22-29(36-3)18-19-31(30)33/h14-19,22,24-25H,4-13,20-21,23H2,1-3H3 PVQHHKRPWIYTFO-UHFFFAOYSA-N 50610273 CHEMBL5282763 Cholinesterase 5490 ChEMBL 10.7270/Q2HX1HVC 36580744 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610273 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610273&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171355396 494500021 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516412 COc1ccc2n(CCCCCCCCCCCCN(C)Cc3ccc(OC)c(OC)c3)cc(C=O)c2c1 InChI=1S/C32H46N2O4/c1-33(23-26-15-18-31(37-3)32(21-26)38-4)19-13-11-9-7-5-6-8-10-12-14-20-34-24-27(25-35)29-22-28(36-2)16-17-30(29)34/h15-18,21-22,24-25H,5-14,19-20,23H2,1-4H3 VNMUKEWBYJPDPC-UHFFFAOYSA-N 50610274 CHEMBL5269046 Cholinesterase 880 ChEMBL 10.7270/Q2HX1HVC 36580744 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610274 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610274&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171343302 494500022 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516413 CCN(CCCCCCCCCCCCn1cc(C=O)c2cc(OC)ccc12)Cc1cccc(O)c1 InChI=1S/C31H44N2O3/c1-3-32(23-26-15-14-16-28(35)21-26)19-12-10-8-6-4-5-7-9-11-13-20-33-24-27(25-34)30-22-29(36-2)17-18-31(30)33/h14-18,21-22,24-25,35H,3-13,19-20,23H2,1-2H3 OESTWNDKVZPZBM-UHFFFAOYSA-N 50610275 CHEMBL5282063 Cholinesterase 190 ChEMBL 10.7270/Q2HX1HVC 36580744 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610275 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610275&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171355002 494500023 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516414 COc1ccc2n(CCCCCCCCCCCCCCN(C)Cc3cccc(O)c3)cc(C=O)c2c1 InChI=1S/C32H46N2O3/c1-33(24-27-16-15-17-29(36)22-27)20-13-11-9-7-5-3-4-6-8-10-12-14-21-34-25-28(26-35)31-23-30(37-2)18-19-32(31)34/h15-19,22-23,25-26,36H,3-14,20-21,24H2,1-2H3 VZRUYRPWHHFPLI-UHFFFAOYSA-N 50610276 CHEMBL5291266 Cholinesterase 8760 ChEMBL 10.7270/Q2HX1HVC 36580744 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610276 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610276&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171351831 494500024 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516415 CN(CCCCCCCCCCCCn1cc(C=O)c2cc(O)ccc12)Cc1cccc(O)c1 InChI=1S/C29H40N2O3/c1-30(21-24-13-12-14-26(33)19-24)17-10-8-6-4-2-3-5-7-9-11-18-31-22-25(23-32)28-20-27(34)15-16-29(28)31/h12-16,19-20,22-23,33-34H,2-11,17-18,21H2,1H3 FSMMMQWAIKAMQM-UHFFFAOYSA-N 50610277 CHEMBL5270722 Cholinesterase 2140 ChEMBL 10.7270/Q2HX1HVC 36580744 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50610277 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50610277&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 171344289 494500025 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51516416 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 4260 ChEMBL 10.7270/Q2HX1HVC 36580744 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991337 FC(F)(F)c1ccc(cc1)C(CCNC(=N)NCCCc1cnc[nH]1)c1ccccn1 InChI=1S/C22H25F3N6/c23-22(24,25)17-8-6-16(7-9-17)19(20-5-1-2-11-28-20)10-13-30-21(26)29-12-3-4-18-14-27-15-31-18/h1-2,5-9,11,14-15,19H,3-4,10,12-13H2,(H,27,31)(H3,26,29,30) RDKPIVNTLCLZFP-UHFFFAOYSA-N 50406038 CHEMBL5280065 Cholinesterase 25220 ChEMBL 10.7270/Q2XG9WBG 36706609 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406038 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406038&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14660355 163355062 CHEMBL291396 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991357 Clc1ccc(cc1Cl)C(CCNC(=N)NCCCc1cnc[nH]1)c1ccccn1 InChI=1S/C21H24Cl2N6/c22-18-7-6-15(12-19(18)23)17(20-5-1-2-9-26-20)8-11-28-21(24)27-10-3-4-16-13-25-14-29-16/h1-2,5-7,9,12-14,17H,3-4,8,10-11H2,(H,25,29)(H3,24,27,28) GHJQICOITUKHSP-UHFFFAOYSA-N 50406042 CHEMBL5280795 Cholinesterase 1620 ChEMBL 10.7270/Q2XG9WBG 36706609 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406042 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406042&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 10094258 163355066 CHEMBL58740 ZINC29567103 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991358 Nc1cccc(c1)C(CCNC(=N)NCCCc1cnc[nH]1)c1ccccn1 InChI=1S/C21H27N7/c22-17-6-3-5-16(13-17)19(20-8-1-2-10-25-20)9-12-27-21(23)26-11-4-7-18-14-24-15-28-18/h1-3,5-6,8,10,13-15,19H,4,7,9,11-12,22H2,(H,24,28)(H3,23,26,27) ZVJWXSZIONDMGN-UHFFFAOYSA-N 50406043 CHEMBL5289255 Cholinesterase 13720 ChEMBL 10.7270/Q2XG9WBG 36706609 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406043 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406043&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14660416 163355067 CHEMBL60006 ZINC13816192 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991359 Cc1ccc(cc1)C(CCNC(=N)NCCCc1cnc[nH]1)c1ccccn1 InChI=1S/C22H28N6/c1-17-7-9-18(10-8-17)20(21-6-2-3-12-25-21)11-14-27-22(23)26-13-4-5-19-15-24-16-28-19/h2-3,6-10,12,15-16,20H,4-5,11,13-14H2,1H3,(H,24,28)(H3,23,26,27) KOBGFFQPCHDLPG-UHFFFAOYSA-N 50406044 CHEMBL5284034 Cholinesterase 3280 ChEMBL 10.7270/Q2XG9WBG 36706609 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406044 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406044&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14660348 163355068 CHEMBL59294 ZINC13816099 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991360 Clc1ccccc1C(CCNC(=N)NCCCc1cnc[nH]1)c1ccccn1 InChI=1S/C21H25ClN6/c22-19-8-2-1-7-17(19)18(20-9-3-4-11-25-20)10-13-27-21(23)26-12-5-6-16-14-24-15-28-16/h1-4,7-9,11,14-15,18H,5-6,10,12-13H2,(H,24,28)(H3,23,26,27) NGCWRJSBWWJCRH-UHFFFAOYSA-N 50406045 CHEMBL5266623 Cholinesterase 7960 ChEMBL 10.7270/Q2XG9WBG 36706609 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406045 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406045&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14660365 163355069 CHEMBL59521 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991361 Fc1ccc(cc1)C(CCCNC(=N)NCCCc1cnc[nH]1)c1ccccn1 InChI=1S/C22H27FN6/c23-18-10-8-17(9-11-18)20(21-7-1-2-12-26-21)6-4-14-28-22(24)27-13-3-5-19-15-25-16-29-19/h1-2,7-12,15-16,20H,3-6,13-14H2,(H,25,29)(H3,24,27,28) LATRARGFEILASK-UHFFFAOYSA-N 50406047 CHEMBL5275640 Cholinesterase 13410 ChEMBL 10.7270/Q2XG9WBG 36706609 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406047 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406047&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14660345 163355071 CHEMBL58869 ZINC13816253 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991362 Fc1ccc(cc1)C(=CCNC(=N)NCCCc1cnc[nH]1)c1ccccn1 InChI=1S/C21H23FN6/c22-17-8-6-16(7-9-17)19(20-5-1-2-11-25-20)10-13-27-21(23)26-12-3-4-18-14-24-15-28-18/h1-2,5-11,14-15H,3-4,12-13H2,(H,24,28)(H3,23,26,27) FZGVIVHYTULKOJ-UHFFFAOYSA-N 50406048 CHEMBL5265953 Cholinesterase 9490 ChEMBL 10.7270/Q2XG9WBG 36706609 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406048 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406048&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14660395 163355072 CHEMBL62147 ZINC29572066 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991363 Oc1ccc(cc1)C(CCNC(=N)NCCCc1cnc[nH]1)c1ccccn1 InChI=1S/C21H26N6O/c22-21(25-12-3-4-17-14-23-15-27-17)26-13-10-19(20-5-1-2-11-24-20)16-6-8-18(28)9-7-16/h1-2,5-9,11,14-15,19,28H,3-4,10,12-13H2,(H,23,27)(H3,22,25,26) PURJINCZJZSCOZ-UHFFFAOYSA-N 50406049 CHEMBL5268014 Cholinesterase 10550 ChEMBL 10.7270/Q2XG9WBG 36706609 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406049 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406049&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14660412 163355073 CHEMBL60972 ZINC13816185 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991364 Clc1ccc(cc1)C(CCNC(=N)NCCCc1cnc[nH]1)c1ccccn1 InChI=1S/C21H25ClN6/c22-17-8-6-16(7-9-17)19(20-5-1-2-11-25-20)10-13-27-21(23)26-12-3-4-18-14-24-15-28-18/h1-2,5-9,11,14-15,19H,3-4,10,12-13H2,(H,24,28)(H3,23,26,27) ZOROCGHIPADEFK-UHFFFAOYSA-N 50406050 CHEMBL5268619 Cholinesterase 15600 ChEMBL 10.7270/Q2XG9WBG 36706609 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406050 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406050&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14660352 163355074 CHEMBL304239 ZINC13816106 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991365 Clc1cc(Cl)cc(c1)C(CCNC(=N)NCCCc1cnc[nH]1)c1ccccn1 InChI=1S/C21H24Cl2N6/c22-16-10-15(11-17(23)12-16)19(20-5-1-2-7-26-20)6-9-28-21(24)27-8-3-4-18-13-25-14-29-18/h1-2,5,7,10-14,19H,3-4,6,8-9H2,(H,25,29)(H3,24,27,28) IKUJLRABEABAKF-UHFFFAOYSA-N 50406053 CHEMBL5281121 Cholinesterase 6560 ChEMBL 10.7270/Q2XG9WBG 36706609 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406053 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406053&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14660370 163355077 CHEMBL418508 ZINC13816140 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991366 Fc1ccc(cc1)C(CCNC(=N)NCCCc1cnc[nH]1)Cc1ccccc1 InChI=1S/C23H28FN5/c24-21-10-8-19(9-11-21)20(15-18-5-2-1-3-6-18)12-14-28-23(25)27-13-4-7-22-16-26-17-29-22/h1-3,5-6,8-11,16-17,20H,4,7,12-15H2,(H,26,29)(H3,25,27,28) ONAVRKQWVRBIKW-UHFFFAOYSA-N 50406055 CHEMBL5270330 Cholinesterase 5230 ChEMBL 10.7270/Q2XG9WBG 36706609 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406055 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406055&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14660389 163355079 CHEMBL61022 ZINC13816587 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991367 Fc1ccc(cc1F)C(CCNC(=N)NCCCc1cnc[nH]1)c1ccccn1 InChI=1S/C21H24F2N6/c22-18-7-6-15(12-19(18)23)17(20-5-1-2-9-26-20)8-11-28-21(24)27-10-3-4-16-13-25-14-29-16/h1-2,5-7,9,12-14,17H,3-4,8,10-11H2,(H,25,29)(H3,24,27,28) ZHUPJEZTXBUHGR-UHFFFAOYSA-N 50406056 CHEMBL5284274 Cholinesterase 6190 ChEMBL 10.7270/Q2XG9WBG 36706609 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406056 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406056&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 3081063 163355080 CHEMBL60519 ZINC29566767 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991368 OC(CCNC(=N)NCCCc1cnc[nH]1)(c1ccc(F)cc1)c1ccccn1 InChI=1S/C21H25FN6O/c22-17-8-6-16(7-9-17)21(29,19-5-1-2-11-25-19)10-13-27-20(23)26-12-3-4-18-14-24-15-28-18/h1-2,5-9,11,14-15,29H,3-4,10,12-13H2,(H,24,28)(H3,23,26,27) ZOILEKQURKOEQC-UHFFFAOYSA-N 50406059 CHEMBL5274776 Cholinesterase 12630 ChEMBL 10.7270/Q2XG9WBG 36706609 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406059 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406059&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14660410 163355083 CHEMBL58621 ZINC29569525 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991369 N=C(NCCCc1cnc[nH]1)NCCC(c1ccccc1)c1ccccn1 InChI=1S/C21H26N6/c22-21(25-13-6-9-18-15-23-16-27-18)26-14-11-19(17-7-2-1-3-8-17)20-10-4-5-12-24-20/h1-5,7-8,10,12,15-16,19H,6,9,11,13-14H2,(H,23,27)(H3,22,25,26) VQDMUIMMHGPYOH-UHFFFAOYSA-N 50406060 CHEMBL5278887 Cholinesterase 13840 ChEMBL 10.7270/Q2XG9WBG 36706609 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406060 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406060&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 11726167 163355084 CHEMBL59295 ZINC13816087 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991370 Fc1ccc(cc1)C(CCNC(=N)NCCCc1cnc[nH]1)c1ccccc1 InChI=1S/C22H26FN5/c23-19-10-8-18(9-11-19)21(17-5-2-1-3-6-17)12-14-27-22(24)26-13-4-7-20-15-25-16-28-20/h1-3,5-6,8-11,15-16,21H,4,7,12-14H2,(H,25,28)(H3,24,26,27) HRJKYGAMOZFSGI-UHFFFAOYSA-N 50406061 CHEMBL5283091 Cholinesterase 13220 ChEMBL 10.7270/Q2XG9WBG 36706609 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50406061 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50406061&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 14660384 163355085 CHEMBL61852 ZINC13726804 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991371 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase 5130 ChEMBL 10.7270/Q2XG9WBG 36706609 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 50991372 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase 50 ChEMBL 10.7270/Q2XG9WBG 36706609 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,8T5G,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 2WIF,2WIJ,2WIK,2Y1K,4BBZ,5NN0 Cholinesterase CHLE_HORSE P81908 51549544 OC(CNCc1ccccc1)CNC(=O)C(c1ccccc1)c1ccccc1 InChI=1S/C24H26N2O2/c27-22(17-25-16-19-10-4-1-5-11-19)18-26-24(28)23(20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-15,22-23,25,27H,16-18H2,(H,26,28) JNMXMISYKZPFOY-UHFFFAOYSA-N 50623296 CHEMBL5427370 Cholinesterase Equus caballus 2540 ChEMBL 10.1016/j.ejmech.2023.115135 10.7270/Q2571HDJ 36696766 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623296 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623296&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51549545 OC(CNCc1ccccc1)CNC(=O)CC(c1ccccc1)c1ccccc1 InChI=1S/C25H28N2O2/c28-23(18-26-17-20-10-4-1-5-11-20)19-27-25(29)16-24(21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-15,23-24,26,28H,16-19H2,(H,27,29) LYPYECBUODEXHF-UHFFFAOYSA-N 50623297 CHEMBL5436917 Cholinesterase Equus caballus 610 ChEMBL 10.1016/j.ejmech.2023.115135 10.7270/Q2571HDJ 36696766 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623297 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623297&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51549546 C[C@H](NCC(O)CNC(=O)C(c1ccccc1)c1ccccc1)c1ccccc1 InChI=1S/C25H28N2O2/c1-19(20-11-5-2-6-12-20)26-17-23(28)18-27-25(29)24(21-13-7-3-8-14-21)22-15-9-4-10-16-22/h2-16,19,23-24,26,28H,17-18H2,1H3,(H,27,29)/t19-,23?/m0/s1 ARIHQJKRKRIBCF-HSTJUUNISA-N 50623298 CHEMBL5410733 Cholinesterase Equus caballus 4540 ChEMBL 10.1016/j.ejmech.2023.115135 10.7270/Q2571HDJ 36696766 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623298 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623298&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51549547 C[C@H](NCC(O)CNC(=O)CC(c1ccccc1)c1ccccc1)c1ccccc1 InChI=1S/C26H30N2O2/c1-20(21-11-5-2-6-12-21)27-18-24(29)19-28-26(30)17-25(22-13-7-3-8-14-22)23-15-9-4-10-16-23/h2-16,20,24-25,27,29H,17-19H2,1H3,(H,28,30)/t20-,24?/m0/s1 PBMPIEOCZIKIDZ-QHELBMECSA-N 50623299 CHEMBL5425105 Cholinesterase Equus caballus 4770 ChEMBL 10.1016/j.ejmech.2023.115135 10.7270/Q2571HDJ 36696766 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623299 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623299&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51549548 COc1cccc(CNCC(O)CNC(=O)C(c2ccccc2)c2ccccc2)c1 InChI=1S/C25H28N2O3/c1-30-23-14-8-9-19(15-23)16-26-17-22(28)18-27-25(29)24(20-10-4-2-5-11-20)21-12-6-3-7-13-21/h2-15,22,24,26,28H,16-18H2,1H3,(H,27,29) VTMDHJIXDMSNJC-UHFFFAOYSA-N 50623300 CHEMBL5431728 Cholinesterase Equus caballus 2180 ChEMBL 10.1016/j.ejmech.2023.115135 10.7270/Q2571HDJ 36696766 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623300 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623300&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51549549 COc1cccc(CNCC(O)CNC(=O)CC(c2ccccc2)c2ccccc2)c1 InChI=1S/C26H30N2O3/c1-31-24-14-8-9-20(15-24)17-27-18-23(29)19-28-26(30)16-25(21-10-4-2-5-11-21)22-12-6-3-7-13-22/h2-15,23,25,27,29H,16-19H2,1H3,(H,28,30) ASQUMXWOQSHYDY-UHFFFAOYSA-N 50623301 CHEMBL5439292 Cholinesterase Equus caballus 660 ChEMBL 10.1016/j.ejmech.2023.115135 10.7270/Q2571HDJ 36696766 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623301 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623301&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51549550 OC(CNCc1cccc(c1)C(F)(F)F)CNC(=O)C(c1ccccc1)c1ccccc1 InChI=1S/C25H25F3N2O2/c26-25(27,28)21-13-7-8-18(14-21)15-29-16-22(31)17-30-24(32)23(19-9-3-1-4-10-19)20-11-5-2-6-12-20/h1-14,22-23,29,31H,15-17H2,(H,30,32) ZBDLPSZZKVJYPT-UHFFFAOYSA-N 50623302 CHEMBL5395541 Cholinesterase Equus caballus 960 ChEMBL 10.1016/j.ejmech.2023.115135 10.7270/Q2571HDJ 36696766 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623302 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623302&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51549551 OC(CNCc1cccc(c1)C(F)(F)F)CNC(=O)CC(c1ccccc1)c1ccccc1 InChI=1S/C26H27F3N2O2/c27-26(28,29)22-13-7-8-19(14-22)16-30-17-23(32)18-31-25(33)15-24(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h1-14,23-24,30,32H,15-18H2,(H,31,33) FNAZQUMHXDGESK-UHFFFAOYSA-N 50623303 CHEMBL5418088 Cholinesterase Equus caballus 1730 ChEMBL 10.1016/j.ejmech.2023.115135 10.7270/Q2571HDJ 36696766 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623303 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623303&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51549552 CC(C)c1cccc(CNCC(O)CNC(=O)CC(c2ccccc2)c2ccccc2)c1 InChI=1S/C28H34N2O2/c1-21(2)25-15-9-10-22(16-25)18-29-19-26(31)20-30-28(32)17-27(23-11-5-3-6-12-23)24-13-7-4-8-14-24/h3-16,21,26-27,29,31H,17-20H2,1-2H3,(H,30,32) LHYAJFLALQIPKQ-UHFFFAOYSA-N 50623304 CHEMBL5413749 Cholinesterase Equus caballus 630 ChEMBL 10.1016/j.ejmech.2023.115135 10.7270/Q2571HDJ 36696766 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623304 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623304&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51549553 CC(C)(C)c1cccc(CNCC(O)CNC(=O)C(c2ccccc2)c2ccccc2)c1 InChI=1S/C28H34N2O2/c1-28(2,3)24-16-10-11-21(17-24)18-29-19-25(31)20-30-27(32)26(22-12-6-4-7-13-22)23-14-8-5-9-15-23/h4-17,25-26,29,31H,18-20H2,1-3H3,(H,30,32) TYSLCNCHLZPVES-UHFFFAOYSA-N 50623305 CHEMBL5425456 Cholinesterase Equus caballus 260 ChEMBL 10.1016/j.ejmech.2023.115135 10.7270/Q2571HDJ 36696766 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623305 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623305&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51549554 CC(C)(C)c1cccc(CNCC(O)CNC(=O)CC(c2ccccc2)c2ccccc2)c1 InChI=1S/C29H36N2O2/c1-29(2,3)25-16-10-11-22(17-25)19-30-20-26(32)21-31-28(33)18-27(23-12-6-4-7-13-23)24-14-8-5-9-15-24/h4-17,26-27,30,32H,18-21H2,1-3H3,(H,31,33) FHYXNOQJXBMOOA-UHFFFAOYSA-N 50623306 CHEMBL5435772 Cholinesterase Equus caballus 320 ChEMBL 10.1016/j.ejmech.2023.115135 10.7270/Q2571HDJ 36696766 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623306 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623306&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51549555 CC(C)(C)c1ccc(CNCC(O)CNC(=O)C(c2ccccc2)c2ccccc2)cc1 InChI=1S/C28H34N2O2/c1-28(2,3)24-16-14-21(15-17-24)18-29-19-25(31)20-30-27(32)26(22-10-6-4-7-11-22)23-12-8-5-9-13-23/h4-17,25-26,29,31H,18-20H2,1-3H3,(H,30,32) GNMVSYOKROHOMO-UHFFFAOYSA-N 50623307 CHEMBL5411568 Cholinesterase Equus caballus 1120 ChEMBL 10.1016/j.ejmech.2023.115135 10.7270/Q2571HDJ 36696766 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623307 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623307&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51549556 CC(C)(C)c1ccc(CNCC(O)CNC(=O)CC(c2ccccc2)c2ccccc2)cc1 InChI=1S/C29H36N2O2/c1-29(2,3)25-16-14-22(15-17-25)19-30-20-26(32)21-31-28(33)18-27(23-10-6-4-7-11-23)24-12-8-5-9-13-24/h4-17,26-27,30,32H,18-21H2,1-3H3,(H,31,33) SIQBNBDAWQXJFN-UHFFFAOYSA-N 50623308 CHEMBL5431415 Cholinesterase Equus caballus 1940 ChEMBL 10.1016/j.ejmech.2023.115135 10.7270/Q2571HDJ 36696766 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623308 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623308&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51549557 OC(CNCC1CC1)CNC(=O)CC(c1ccccc1)c1ccccc1 InChI=1S/C22H28N2O2/c25-20(15-23-14-17-11-12-17)16-24-22(26)13-21(18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-10,17,20-21,23,25H,11-16H2,(H,24,26) QHHLBBKGSAHUCF-UHFFFAOYSA-N 50623309 CHEMBL5423691 Cholinesterase Equus caballus 3580 ChEMBL 10.1016/j.ejmech.2023.115135 10.7270/Q2571HDJ 36696766 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623309 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623309&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51549558 OC(CNCC1CCCCC1)CNC(=O)C(c1ccccc1)c1ccccc1 InChI=1S/C24H32N2O2/c27-22(17-25-16-19-10-4-1-5-11-19)18-26-24(28)23(20-12-6-2-7-13-20)21-14-8-3-9-15-21/h2-3,6-9,12-15,19,22-23,25,27H,1,4-5,10-11,16-18H2,(H,26,28) FUOOCCYGXAKPCY-UHFFFAOYSA-N 50623310 CHEMBL5414920 Cholinesterase Equus caballus 130 ChEMBL 10.1016/j.ejmech.2023.115135 10.7270/Q2571HDJ 36696766 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623310 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623310&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 8IS 7Q1M 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51549559 O[C@@H](CNCC1CCCCC1)CNC(=O)C(c1ccccc1)c1ccccc1 InChI=1S/C24H32N2O2/c27-22(17-25-16-19-10-4-1-5-11-19)18-26-24(28)23(20-12-6-2-7-13-20)21-14-8-3-9-15-21/h2-3,6-9,12-15,19,22-23,25,27H,1,4-5,10-11,16-18H2,(H,26,28)/t22-/m0/s1 FUOOCCYGXAKPCY-QFIPXVFZSA-N 50623311 CHEMBL5421371 Cholinesterase Equus caballus 100 ChEMBL 10.1016/j.ejmech.2023.115135 10.7270/Q2571HDJ 36696766 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623311 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623311&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 8IS 7Q1M 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51549560 O[C@H](CNCC1CCCCC1)CNC(=O)C(c1ccccc1)c1ccccc1 InChI=1S/C24H32N2O2/c27-22(17-25-16-19-10-4-1-5-11-19)18-26-24(28)23(20-12-6-2-7-13-20)21-14-8-3-9-15-21/h2-3,6-9,12-15,19,22-23,25,27H,1,4-5,10-11,16-18H2,(H,26,28)/t22-/m1/s1 FUOOCCYGXAKPCY-JOCHJYFZSA-N 50623312 CHEMBL5439275 Cholinesterase Equus caballus 630 ChEMBL 10.1016/j.ejmech.2023.115135 10.7270/Q2571HDJ 36696766 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623312 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623312&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 8IV 7Q1N 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51549561 OC(CNCC1CCCCC1)CNC(=O)CC(c1ccccc1)c1ccccc1 InChI=1S/C25H34N2O2/c28-23(18-26-17-20-10-4-1-5-11-20)19-27-25(29)16-24(21-12-6-2-7-13-21)22-14-8-3-9-15-22/h2-3,6-9,12-15,20,23-24,26,28H,1,4-5,10-11,16-19H2,(H,27,29) AGQFRFDHZZBREO-UHFFFAOYSA-N 50623313 CHEMBL5401934 Cholinesterase Equus caballus 80 ChEMBL 10.1016/j.ejmech.2023.115135 10.7270/Q2571HDJ 36696766 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623313 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623313&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 8UW 7Q1P 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51549562 O[C@@H](CNCC1CCCCC1)CNC(=O)CC(c1ccccc1)c1ccccc1 InChI=1S/C25H34N2O2/c28-23(18-26-17-20-10-4-1-5-11-20)19-27-25(29)16-24(21-12-6-2-7-13-21)22-14-8-3-9-15-22/h2-3,6-9,12-15,20,23-24,26,28H,1,4-5,10-11,16-19H2,(H,27,29)/t23-/m0/s1 AGQFRFDHZZBREO-QHCPKHFHSA-N 50623314 CHEMBL5396685 Cholinesterase Equus caballus 80 ChEMBL 10.1016/j.ejmech.2023.115135 10.7270/Q2571HDJ 36696766 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623314 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623314&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 9CI 7Q1O 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51549563 O[C@H](CNCC1CCCCC1)CNC(=O)CC(c1ccccc1)c1ccccc1 InChI=1S/C25H34N2O2/c28-23(18-26-17-20-10-4-1-5-11-20)19-27-25(29)16-24(21-12-6-2-7-13-21)22-14-8-3-9-15-22/h2-3,6-9,12-15,20,23-24,26,28H,1,4-5,10-11,16-19H2,(H,27,29)/t23-/m1/s1 AGQFRFDHZZBREO-HSZRJFAPSA-N 50623315 CHEMBL5433771 Cholinesterase Equus caballus 40 ChEMBL 10.1016/j.ejmech.2023.115135 10.7270/Q2571HDJ 36696766 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623315 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623315&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 8UW 7Q1P 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51549564 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase Equus caballus 20 ChEMBL 10.1016/j.ejmech.2023.115135 10.7270/Q2571HDJ 36696766 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,8T5G,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51549565 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase Equus caballus 1830 ChEMBL 10.1016/j.ejmech.2023.115135 10.7270/Q2571HDJ 36696766 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552690 Cl.N[C@H]1CCN(C1)c1c2CCCCCc2nc2ccc(cc12)-c1ccnc(NC(=O)C2CC2)c1 InChI=1S/C27H31N5O.ClH/c28-20-11-13-32(16-20)26-21-4-2-1-3-5-23(21)30-24-9-8-18(14-22(24)26)19-10-12-29-25(15-19)31-27(33)17-6-7-17;/h8-10,12,14-15,17,20H,1-7,11,13,16,28H2,(H,29,31,33);1H/t20-;/m0./s1 DRFMFDMGSZBDTP-BDQAORGHSA-N 50624654 CHEMBL5440541 Cholinesterase Equus caballus 1958 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624654 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624654&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552691 Cl.N[C@@H]1CCN(C1)c1c2CCCCCc2nc2ccc(cc12)-c1ccnc(NC(=O)C2CC2)c1 InChI=1S/C27H31N5O.ClH/c28-20-11-13-32(16-20)26-21-4-2-1-3-5-23(21)30-24-9-8-18(14-22(24)26)19-10-12-29-25(15-19)31-27(33)17-6-7-17;/h8-10,12,14-15,17,20H,1-7,11,13,16,28H2,(H,29,31,33);1H/t20-;/m1./s1 DRFMFDMGSZBDTP-VEIFNGETSA-N 50624655 CHEMBL5431262 Cholinesterase Equus caballus 4778 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624655 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624655&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552692 Cl.N[C@H]1CCN(C1)c1c2CCCCCc2nc2ccc(cc12)-c1ccnc(c1)C(=O)NC1CC1 InChI=1S/C27H31N5O.ClH/c28-19-11-13-32(16-19)26-21-4-2-1-3-5-23(21)31-24-9-6-17(14-22(24)26)18-10-12-29-25(15-18)27(33)30-20-7-8-20;/h6,9-10,12,14-15,19-20H,1-5,7-8,11,13,16,28H2,(H,30,33);1H/t19-;/m0./s1 YIZDTQHXIMTEOM-FYZYNONXSA-N 50624656 CHEMBL5438785 Cholinesterase Equus caballus 4986 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624656 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624656&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552693 Cl.N[C@H]1CCN(C1)c1c2CCCCCc2nc2ccc(cc12)-c1ccnc(NC(=O)C2CCC2)c1 InChI=1S/C28H33N5O.ClH/c29-21-12-14-33(17-21)27-22-7-2-1-3-8-24(22)31-25-10-9-19(15-23(25)27)20-11-13-30-26(16-20)32-28(34)18-5-4-6-18;/h9-11,13,15-16,18,21H,1-8,12,14,17,29H2,(H,30,32,34);1H/t21-;/m0./s1 YFMOIJRIGRVZKR-BOXHHOBZSA-N 50624657 CHEMBL5419410 Cholinesterase Equus caballus 1182 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624657 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624657&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552694 Cl.N[C@H]1CCN(C1)c1c2CCCCCc2nc2ccc(cc12)-c1ccnc(NC(=O)C2CCCC2)c1 InChI=1S/C29H35N5O.ClH/c30-22-13-15-34(18-22)28-23-8-2-1-3-9-25(23)32-26-11-10-20(16-24(26)28)21-12-14-31-27(17-21)33-29(35)19-6-4-5-7-19;/h10-12,14,16-17,19,22H,1-9,13,15,18,30H2,(H,31,33,35);1H/t22-;/m0./s1 YFRZXOHLZPTPDL-FTBISJDPSA-N 50624658 CHEMBL5416382 Cholinesterase Equus caballus 1176 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624658 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624658&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543509 CN(CCOCCN1c2ccccc2Sc2ccccc12)C(CCO)C(=O)NCc1ccccc1 InChI=1S/C28H33N3O3S/c1-30(25(15-18-32)28(33)29-21-22-9-3-2-4-10-22)16-19-34-20-17-31-23-11-5-7-13-26(23)35-27-14-8-6-12-24(27)31/h2-14,25,32H,15-21H2,1H3,(H,29,33) FMAQUTNXWDSUCP-UHFFFAOYSA-N 50620818 CHEMBL5412199 Cholinesterase Equus caballus 4340 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620818 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620818&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543510 CN(CCOCCN1c2ccccc2Sc2ccccc12)C(CCO)C(=O)NCc1ccccc1Cl InChI=1S/C28H32ClN3O3S/c1-31(25(14-17-33)28(34)30-20-21-8-2-3-9-22(21)29)15-18-35-19-16-32-23-10-4-6-12-26(23)36-27-13-7-5-11-24(27)32/h2-13,25,33H,14-20H2,1H3,(H,30,34) LZMGFBSYUJBWOZ-UHFFFAOYSA-N 50620819 CHEMBL5397616 Cholinesterase Equus caballus 3550 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620819 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620819&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543511 CN(CCOCCN1c2ccccc2Sc2ccccc12)C(CCO)C(=O)NCc1ccc(Cl)cc1 InChI=1S/C28H32ClN3O3S/c1-31(25(14-17-33)28(34)30-20-21-10-12-22(29)13-11-21)15-18-35-19-16-32-23-6-2-4-8-26(23)36-27-9-5-3-7-24(27)32/h2-13,25,33H,14-20H2,1H3,(H,30,34) LXLBBUVOJZCVFP-UHFFFAOYSA-N 50620820 CHEMBL5412629 Cholinesterase Equus caballus 4270 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620820 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620820&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543512 CN(CCOCCN1c2ccccc2Sc2ccccc12)C(CCO)C(=O)NCc1ccc(F)cc1 InChI=1S/C28H32FN3O3S/c1-31(25(14-17-33)28(34)30-20-21-10-12-22(29)13-11-21)15-18-35-19-16-32-23-6-2-4-8-26(23)36-27-9-5-3-7-24(27)32/h2-13,25,33H,14-20H2,1H3,(H,30,34) AHNNHVJPKFYOOR-UHFFFAOYSA-N 50620821 CHEMBL5407267 Cholinesterase Equus caballus 4540 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620821 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620821&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543513 CN(CCOCCN1c2ccccc2Sc2ccccc12)C(CCO)C(=O)NCc1ccc(C)cc1 InChI=1S/C29H35N3O3S/c1-22-11-13-23(14-12-22)21-30-29(34)26(15-18-33)31(2)16-19-35-20-17-32-24-7-3-5-9-27(24)36-28-10-6-4-8-25(28)32/h3-14,26,33H,15-21H2,1-2H3,(H,30,34) BSRRATHPYWJBJT-UHFFFAOYSA-N 50620822 CHEMBL5419107 Cholinesterase Equus caballus 2480 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620822 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620822&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543514 CN(CCOCCN1c2ccccc2Sc2ccccc12)C(CCN)C(=O)NCc1ccccc1 InChI=1S/C28H34N4O2S/c1-31(25(15-16-29)28(33)30-21-22-9-3-2-4-10-22)17-19-34-20-18-32-23-11-5-7-13-26(23)35-27-14-8-6-12-24(27)32/h2-14,25H,15-21,29H2,1H3,(H,30,33) VWNUHTBUXQXDBB-UHFFFAOYSA-N 50620816 CHEMBL5411369 Cholinesterase Equus caballus 350 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620816 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620816&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543515 CN(CCOCCN1c2ccccc2Sc2ccccc12)C(CCN)C(=O)NCc1ccccc1Cl InChI=1S/C28H33ClN4O2S/c1-32(25(14-15-30)28(34)31-20-21-8-2-3-9-22(21)29)16-18-35-19-17-33-23-10-4-6-12-26(23)36-27-13-7-5-11-24(27)33/h2-13,25H,14-20,30H2,1H3,(H,31,34) YHPOZYSNXJXRBZ-UHFFFAOYSA-N 50620823 CHEMBL5423337 Cholinesterase Equus caballus 411 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620823 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620823&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543516 CN(CCOCCN1c2ccccc2Sc2ccccc12)C(CCN)C(=O)NCc1ccc(Cl)cc1 InChI=1S/C28H33ClN4O2S/c1-32(25(14-15-30)28(34)31-20-21-10-12-22(29)13-11-21)16-18-35-19-17-33-23-6-2-4-8-26(23)36-27-9-5-3-7-24(27)33/h2-13,25H,14-20,30H2,1H3,(H,31,34) HAJZMHJFOROAIK-UHFFFAOYSA-N 50620824 CHEMBL5423316 Cholinesterase Equus caballus 559 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620824 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620824&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543517 CN(CCOCCN1c2ccccc2Sc2ccccc12)C(CCN)C(=O)NCc1ccc(F)cc1 InChI=1S/C28H33FN4O2S/c1-32(25(14-15-30)28(34)31-20-21-10-12-22(29)13-11-21)16-18-35-19-17-33-23-6-2-4-8-26(23)36-27-9-5-3-7-24(27)33/h2-13,25H,14-20,30H2,1H3,(H,31,34) SBYUTIVVJPVTAS-UHFFFAOYSA-N 50620825 CHEMBL5411905 Cholinesterase Equus caballus 1020 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620825 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620825&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543518 CN(CCOCCN1c2ccccc2Sc2ccccc12)C(CCN)C(=O)NCc1ccc(C)cc1 InChI=1S/C29H36N4O2S/c1-22-11-13-23(14-12-22)21-31-29(34)26(15-16-30)32(2)17-19-35-20-18-33-24-7-3-5-9-27(24)36-28-10-6-4-8-25(28)33/h3-14,26H,15-21,30H2,1-2H3,(H,31,34) LGBPBKNNJPNGRN-UHFFFAOYSA-N 50620826 CHEMBL5409309 Cholinesterase Equus caballus 3630 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620826 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620826&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543519 CN(CCOCCN1c2ccccc2Sc2ccccc12)C(CCNC(C)=O)C(=O)NCc1ccccc1Cl InChI=1S/C30H35ClN4O3S/c1-22(36)32-16-15-27(30(37)33-21-23-9-3-4-10-24(23)31)34(2)17-19-38-20-18-35-25-11-5-7-13-28(25)39-29-14-8-6-12-26(29)35/h3-14,27H,15-21H2,1-2H3,(H,32,36)(H,33,37) NKZNWMQOXRMFOA-UHFFFAOYSA-N 50620827 CHEMBL5414446 Cholinesterase Equus caballus 2790 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620827 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620827&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543520 CN(CCOCCN1c2ccccc2Sc2ccccc12)C(CCNC(C)=O)C(=O)NCc1ccc(Cl)cc1 InChI=1S/C30H35ClN4O3S/c1-22(36)32-16-15-27(30(37)33-21-23-11-13-24(31)14-12-23)34(2)17-19-38-20-18-35-25-7-3-5-9-28(25)39-29-10-6-4-8-26(29)35/h3-14,27H,15-21H2,1-2H3,(H,32,36)(H,33,37) HBTVFDCJXRLIMO-UHFFFAOYSA-N 50620828 CHEMBL5409538 Cholinesterase Equus caballus 4700 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620828 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620828&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543521 CN(CCOCCN1c2ccccc2Sc2ccccc12)C(CCNC(C)=O)C(=O)NCc1ccc(F)cc1 InChI=1S/C30H35FN4O3S/c1-22(36)32-16-15-27(30(37)33-21-23-11-13-24(31)14-12-23)34(2)17-19-38-20-18-35-25-7-3-5-9-28(25)39-29-10-6-4-8-26(29)35/h3-14,27H,15-21H2,1-2H3,(H,32,36)(H,33,37) CPLUDDZZLTXBHC-UHFFFAOYSA-N 50620829 CHEMBL5413754 Cholinesterase Equus caballus 8250 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620829 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620829&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543522 CN(CCOCCN1c2ccccc2Sc2ccccc12)C(CCNC(C)=O)C(=O)NCc1ccc(C)cc1 InChI=1S/C31H38N4O3S/c1-23-12-14-25(15-13-23)22-33-31(37)28(16-17-32-24(2)36)34(3)18-20-38-21-19-35-26-8-4-6-10-29(26)39-30-11-7-5-9-27(30)35/h4-15,28H,16-22H2,1-3H3,(H,32,36)(H,33,37) VKUDZYRTMNWLKT-UHFFFAOYSA-N 50620830 CHEMBL5405236 Cholinesterase Equus caballus 3200 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620830 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620830&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543523 CN(CCOCCn1c2ccccc2c2ccccc12)C(CCO)C(=O)NCc1ccccc1 InChI=1S/C28H33N3O3/c1-30(27(15-18-32)28(33)29-21-22-9-3-2-4-10-22)16-19-34-20-17-31-25-13-7-5-11-23(25)24-12-6-8-14-26(24)31/h2-14,27,32H,15-21H2,1H3,(H,29,33) DWVPGBULXLHTTA-UHFFFAOYSA-N 50620831 CHEMBL5416743 Cholinesterase Equus caballus 4160 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620831 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620831&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543524 CN(CCOCCn1c2ccccc2c2ccccc12)C(CCO)C(=O)NCc1ccccc1Cl InChI=1S/C28H32ClN3O3/c1-31(27(14-17-33)28(34)30-20-21-8-2-5-11-24(21)29)15-18-35-19-16-32-25-12-6-3-9-22(25)23-10-4-7-13-26(23)32/h2-13,27,33H,14-20H2,1H3,(H,30,34) KLLRNTLWDWNCCD-UHFFFAOYSA-N 50620832 CHEMBL5435638 Cholinesterase Equus caballus 2650 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620832 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620832&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543525 CN(CCOCCn1c2ccccc2c2ccccc12)C(CCO)C(=O)NCc1ccc(F)cc1 InChI=1S/C28H32FN3O3/c1-31(27(14-17-33)28(34)30-20-21-10-12-22(29)13-11-21)15-18-35-19-16-32-25-8-4-2-6-23(25)24-7-3-5-9-26(24)32/h2-13,27,33H,14-20H2,1H3,(H,30,34) WDVRKVPNGSFWTB-UHFFFAOYSA-N 50620833 CHEMBL5423098 Cholinesterase Equus caballus 4830 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620833 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620833&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543526 CN(CCOCCn1c2ccccc2c2ccccc12)C(CCN)C(=O)NCc1ccccc1 InChI=1S/C28H34N4O2/c1-31(27(15-16-29)28(33)30-21-22-9-3-2-4-10-22)17-19-34-20-18-32-25-13-7-5-11-23(25)24-12-6-8-14-26(24)32/h2-14,27H,15-21,29H2,1H3,(H,30,33) QKQLOWOEIZDYQR-UHFFFAOYSA-N 50620834 CHEMBL5440565 Cholinesterase Equus caballus 173 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620834 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620834&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543527 CN(CCOCCn1c2ccccc2c2ccccc12)C(CCN)C(=O)NCc1ccccc1Cl InChI=1S/C28H33ClN4O2/c1-32(27(14-15-30)28(34)31-20-21-8-2-5-11-24(21)29)16-18-35-19-17-33-25-12-6-3-9-22(25)23-10-4-7-13-26(23)33/h2-13,27H,14-20,30H2,1H3,(H,31,34) NFLLISGWDUXVNJ-UHFFFAOYSA-N 50620835 CHEMBL5416293 Cholinesterase Equus caballus 204 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620835 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620835&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543528 CN(CCOCCn1c2ccccc2c2ccccc12)C(CCN)C(=O)NCc1ccc(F)cc1 InChI=1S/C28H33FN4O2/c1-32(27(14-15-30)28(34)31-20-21-10-12-22(29)13-11-21)16-18-35-19-17-33-25-8-4-2-6-23(25)24-7-3-5-9-26(24)33/h2-13,27H,14-20,30H2,1H3,(H,31,34) ZPHJCXAVMJWFRY-UHFFFAOYSA-N 50620836 CHEMBL5438498 Cholinesterase Equus caballus 345 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620836 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620836&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543529 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase Equus caballus 15 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,8T5G,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543530 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase Equus caballus 1830 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543531 CN(CC\C=C\c1ccccc1-c1ccccc1)C(CO)C(=O)NCc1ccccc1 InChI=1S/C27H30N2O2/c1-29(26(21-30)27(31)28-20-22-12-4-2-5-13-22)19-11-10-17-24-16-8-9-18-25(24)23-14-6-3-7-15-23/h2-10,12-18,26,30H,11,19-21H2,1H3,(H,28,31)/b17-10+ BWOAKQPAPPKCQD-LICLKQGHSA-N 50620837 CHEMBL5425025 Cholinesterase Equus caballus 683 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620837 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620837&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543532 CN(CC\C=C\c1ccccc1-c1ccccc1)C(CO)C(=O)NCc1ccccc1Cl InChI=1S/C27H29ClN2O2/c1-30(26(20-31)27(32)29-19-23-15-6-8-17-25(23)28)18-10-9-14-22-13-5-7-16-24(22)21-11-3-2-4-12-21/h2-9,11-17,26,31H,10,18-20H2,1H3,(H,29,32)/b14-9+ BPINBUVFRVILJC-NTEUORMPSA-N 50620838 CHEMBL5423441 Cholinesterase Equus caballus 2270 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620838 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620838&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543533 CN(CC\C=C\c1ccccc1-c1ccccc1)C(CO)C(=O)NCc1ccc(F)cc1 InChI=1S/C27H29FN2O2/c1-30(26(20-31)27(32)29-19-21-14-16-24(28)17-15-21)18-8-7-12-23-11-5-6-13-25(23)22-9-3-2-4-10-22/h2-7,9-17,26,31H,8,18-20H2,1H3,(H,29,32)/b12-7+ QLFCWKOBGHTBLK-KPKJPENVSA-N 50620839 CHEMBL5397274 Cholinesterase Equus caballus 917 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620839 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620839&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543534 CC(O)CC(N(C)CC\C=C\c1ccccc1-c1ccccc1)C(=O)NCc1ccccc1 InChI=1S/C29H34N2O2/c1-23(32)21-28(29(33)30-22-24-13-5-3-6-14-24)31(2)20-12-11-18-26-17-9-10-19-27(26)25-15-7-4-8-16-25/h3-11,13-19,23,28,32H,12,20-22H2,1-2H3,(H,30,33)/b18-11+ OXIPDDGLJYYMCA-WOJGMQOQSA-N 50620840 CHEMBL5424877 Cholinesterase Equus caballus 3710 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620840 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620840&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543535 CC(O)CC(N(C)CC\C=C\c1ccccc1-c1ccccc1)C(=O)NCc1ccccc1Cl InChI=1S/C29H33ClN2O2/c1-22(33)20-28(29(34)31-21-25-16-7-9-18-27(25)30)32(2)19-11-10-15-24-14-6-8-17-26(24)23-12-4-3-5-13-23/h3-10,12-18,22,28,33H,11,19-21H2,1-2H3,(H,31,34)/b15-10+ PONSBHSNGKVFRZ-XNTDXEJSSA-N 50620841 CHEMBL5394533 Cholinesterase Equus caballus 3670 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620841 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620841&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543536 CN(CC\C=C\c1ccccc1-c1ccc(Cl)cc1Cl)C(CCN)C(=O)NCc1ccccc1 InChI=1S/C28H31Cl2N3O/c1-33(27(16-17-31)28(34)32-20-21-9-3-2-4-10-21)18-8-7-12-22-11-5-6-13-24(22)25-15-14-23(29)19-26(25)30/h2-7,9-15,19,27H,8,16-18,20,31H2,1H3,(H,32,34)/b12-7+ MQYNXCWNQOZLMM-KPKJPENVSA-N 50620815 CHEMBL5404846 Cholinesterase Equus caballus 1430 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620815 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620815&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543537 CN(CCC=C(c1ccccc1)c1ccccc1)C(=O)C1Cc2c(CN1)[nH]c1ccccc21 InChI=1S/C29H29N3O/c1-32(18-10-16-23(21-11-4-2-5-12-21)22-13-6-3-7-14-22)29(33)27-19-25-24-15-8-9-17-26(24)31-28(25)20-30-27/h2-9,11-17,27,30-31H,10,18-20H2,1H3 QSATYTMYQAUJGT-UHFFFAOYSA-N 50620817 CHEMBL5419680 Cholinesterase Equus caballus 3130 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620817 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620817&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543538 CN(CCC=C1c2ccccc2-c2ccccc12)C(CCO)C(=O)NCc1ccccc1 InChI=1S/C28H30N2O2/c1-30(27(17-19-31)28(32)29-20-21-10-3-2-4-11-21)18-9-16-26-24-14-7-5-12-22(24)23-13-6-8-15-25(23)26/h2-8,10-16,27,31H,9,17-20H2,1H3,(H,29,32) QTUSIFYNKFDOPP-UHFFFAOYSA-N 50577063 CHEMBL4868987 Cholinesterase Equus caballus 978 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577063 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577063&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164620637 471053186 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552695 Cl.N[C@H]1CCN(C1)c1c2CCCCCc2nc2ccc(cc12)-c1ccnc(NC(=O)C2CCCCC2)c1 InChI=1S/C30H37N5O.ClH/c31-23-14-16-35(19-23)29-24-9-5-2-6-10-26(24)33-27-12-11-21(17-25(27)29)22-13-15-32-28(18-22)34-30(36)20-7-3-1-4-8-20;/h11-13,15,17-18,20,23H,1-10,14,16,19,31H2,(H,32,34,36);1H/t23-;/m0./s1 ULQWQACBLAPXHH-BQAIUKQQSA-N 50624659 CHEMBL5435196 Cholinesterase Equus caballus 1664 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624659 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624659&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552696 Cl.N[C@H]1CCN(C1)c1c2CCCCCc2nc2ccc(cc12)-c1ccccc1 InChI=1S/C24H27N3.ClH/c25-19-13-14-27(16-19)24-20-9-5-2-6-10-22(20)26-23-12-11-18(15-21(23)24)17-7-3-1-4-8-17;/h1,3-4,7-8,11-12,15,19H,2,5-6,9-10,13-14,16,25H2;1H/t19-;/m0./s1 VHZPLMNDROZHNJ-FYZYNONXSA-N 50624660 CHEMBL5427706 Cholinesterase Equus caballus 133 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624660 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624660&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552697 Cl.N[C@H]1CCN(C1)c1c2CCCCCc2nc2ccc(cc12)-c1ccncc1 InChI=1S/C23H26N4.ClH/c24-18-10-13-27(15-18)23-19-4-2-1-3-5-21(19)26-22-7-6-17(14-20(22)23)16-8-11-25-12-9-16;/h6-9,11-12,14,18H,1-5,10,13,15,24H2;1H/t18-;/m0./s1 CKFDGRDJABKGQA-FERBBOLQSA-N 50624661 CHEMBL5407954 Cholinesterase Equus caballus 422 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624661 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624661&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552698 Cl.N[C@H]1CCN(C1)c1c2CCCCCc2nc2ccc(cc12)-c1cccnc1 InChI=1S/C23H26N4.ClH/c24-18-10-12-27(15-18)23-19-6-2-1-3-7-21(19)26-22-9-8-16(13-20(22)23)17-5-4-11-25-14-17;/h4-5,8-9,11,13-14,18H,1-3,6-7,10,12,15,24H2;1H/t18-;/m0./s1 QGEOXZBYCVOQPZ-FERBBOLQSA-N 50624662 CHEMBL5424301 Cholinesterase Equus caballus 722 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624662 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624662&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552699 Cl.N[C@H]1CCN(C1)c1c2CCCCCc2nc2ccc(cc12)-c1ccnc(F)c1 InChI=1S/C23H25FN4.ClH/c24-22-13-16(8-10-26-22)15-6-7-21-19(12-15)23(28-11-9-17(25)14-28)18-4-2-1-3-5-20(18)27-21;/h6-8,10,12-13,17H,1-5,9,11,14,25H2;1H/t17-;/m0./s1 CIPXVERBJHHRSR-LMOVPXPDSA-N 50624663 CHEMBL5426469 Cholinesterase Equus caballus 2248 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624663 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624663&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552700 Cl.N[C@H]1CCN(C1)c1c2CCCCCc2nc2ccc(cc12)-c1nccc(NC(=O)C2CC2)n1 InChI=1S/C26H30N6O.ClH/c27-18-11-13-32(15-18)24-19-4-2-1-3-5-21(19)29-22-9-8-17(14-20(22)24)25-28-12-10-23(30-25)31-26(33)16-6-7-16;/h8-10,12,14,16,18H,1-7,11,13,15,27H2,(H,28,30,31,33);1H/t18-;/m0./s1 PQCNTQCJAZOYTD-FERBBOLQSA-N 50624665 CHEMBL5394141 Cholinesterase Equus caballus 2511 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624665 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624665&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552701 Cl.N[C@H]1CCN(C1)c1c2CCCCCc2nc2ccc(cc12)-c1ccnc(NC(=O)C2CC2)n1 InChI=1S/C26H30N6O.ClH/c27-18-11-13-32(15-18)24-19-4-2-1-3-5-22(19)29-23-9-8-17(14-20(23)24)21-10-12-28-26(30-21)31-25(33)16-6-7-16;/h8-10,12,14,16,18H,1-7,11,13,15,27H2,(H,28,30,31,33);1H/t18-;/m0./s1 GWIFNRNAHQHJOF-FERBBOLQSA-N 50624666 CHEMBL5416114 Cholinesterase Equus caballus 2768 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624666 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624666&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552702 Cl.N[C@H]1CCN(C1)c1c2CCCCCc2nc2ccc(cc12)-c1cc(NC(=O)C2CC2)ncn1 InChI=1S/C26H30N6O.ClH/c27-18-10-11-32(14-18)25-19-4-2-1-3-5-21(19)30-22-9-8-17(12-20(22)25)23-13-24(29-15-28-23)31-26(33)16-6-7-16;/h8-9,12-13,15-16,18H,1-7,10-11,14,27H2,(H,28,29,31,33);1H/t18-;/m0./s1 WHHHELMURHCMDD-FERBBOLQSA-N 50624667 CHEMBL5426191 Cholinesterase Equus caballus 3846 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624667 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624667&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552703 Cl.N[C@H]1CCN(C1)c1c2CCCCCCc2nc2ccc(cc12)-c1ccnc(NC(=O)C2CC2)c1 InChI=1S/C28H33N5O.ClH/c29-21-12-14-33(17-21)27-22-5-3-1-2-4-6-24(22)31-25-10-9-19(15-23(25)27)20-11-13-30-26(16-20)32-28(34)18-7-8-18;/h9-11,13,15-16,18,21H,1-8,12,14,17,29H2,(H,30,32,34);1H/t21-;/m0./s1 CZOPGAJLLJTGOM-BOXHHOBZSA-N 50624668 CHEMBL5436326 Cholinesterase Equus caballus 2806 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624668 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624668&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552704 Cl.N[C@H]1CCN(C1)c1c2CCCCCCc2nc2ccc(cc12)-c1ccnc(NC(=O)C2CCC2)c1 InChI=1S/C29H35N5O.ClH/c30-22-13-15-34(18-22)28-23-8-3-1-2-4-9-25(23)32-26-11-10-20(16-24(26)28)21-12-14-31-27(17-21)33-29(35)19-6-5-7-19;/h10-12,14,16-17,19,22H,1-9,13,15,18,30H2,(H,31,33,35);1H/t22-;/m0./s1 ZENMDQOVZIKSED-FTBISJDPSA-N 50624669 CHEMBL5431814 Cholinesterase Equus caballus 698 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624669 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624669&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552705 Cl.N[C@H]1CCN(C1)c1c2CCCCCCc2nc2ccc(cc12)-c1ccnc(NC(=O)C2CC2)n1 InChI=1S/C27H32N6O.ClH/c28-19-12-14-33(16-19)25-20-5-3-1-2-4-6-23(20)30-24-10-9-18(15-21(24)25)22-11-13-29-27(31-22)32-26(34)17-7-8-17;/h9-11,13,15,17,19H,1-8,12,14,16,28H2,(H,29,31,32,34);1H/t19-;/m0./s1 BUXIIMOXKODZTE-FYZYNONXSA-N 50624670 CHEMBL5402856 Cholinesterase Equus caballus 2730 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624670 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624670&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552706 Cl.N[C@H]1CCN(C1)c1c2CCCc2nc2ccc(cc12)-c1ccnc(NC(=O)C2CC2)c1 InChI=1S/C25H27N5O.ClH/c26-18-9-11-30(14-18)24-19-2-1-3-21(19)28-22-7-6-16(12-20(22)24)17-8-10-27-23(13-17)29-25(31)15-4-5-15;/h6-8,10,12-13,15,18H,1-5,9,11,14,26H2,(H,27,29,31);1H/t18-;/m0./s1 VSTGREJEJAWCOE-FERBBOLQSA-N 50624671 CHEMBL5406985 Cholinesterase Equus caballus 6011 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624671 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624671&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552707 Cl.N[C@H]1CCN(C1)c1c2CCCc2nc2ccc(cc12)-c1ccnc(NC(=O)C2CCC2)c1 InChI=1S/C26H29N5O.ClH/c27-19-10-12-31(15-19)25-20-5-2-6-22(20)29-23-8-7-17(13-21(23)25)18-9-11-28-24(14-18)30-26(32)16-3-1-4-16;/h7-9,11,13-14,16,19H,1-6,10,12,15,27H2,(H,28,30,32);1H/t19-;/m0./s1 RHXZAHXCRFJYGK-FYZYNONXSA-N 50624672 CHEMBL5421410 Cholinesterase Equus caballus 3176 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624672 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624672&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552708 Cl.N[C@H]1CCN(C1)c1c2CCCc3ccccc3-c2nc2ccc(cc12)-c1ccnc(NC(=O)C2CC2)c1 InChI=1S/C31H31N5O.ClH/c32-23-13-15-36(18-23)30-25-7-3-5-19-4-1-2-6-24(19)29(25)34-27-11-10-21(16-26(27)30)22-12-14-33-28(17-22)35-31(37)20-8-9-20;/h1-2,4,6,10-12,14,16-17,20,23H,3,5,7-9,13,15,18,32H2,(H,33,35,37);1H/t23-;/m0./s1 FXFJEJCSJUOOGD-BQAIUKQQSA-N 50624673 CHEMBL5405290 Cholinesterase Equus caballus 3344 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624673 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624673&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552709 Cl.N[C@H]1CCN(C1)c1c2CCCc3ccccc3-c2nc2ccc(cc12)-c1ccnc(NC(=O)C2CC2)n1 InChI=1S/C30H30N6O.ClH/c31-21-13-15-36(17-21)28-23-7-3-5-18-4-1-2-6-22(18)27(23)33-26-11-10-20(16-24(26)28)25-12-14-32-30(34-25)35-29(37)19-8-9-19;/h1-2,4,6,10-12,14,16,19,21H,3,5,7-9,13,15,17,31H2,(H,32,34,35,37);1H/t21-;/m0./s1 AGVGOCHGKRMMQH-BOXHHOBZSA-N 50624674 CHEMBL5405636 Cholinesterase Equus caballus 12660 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624674 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624674&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552710 Cl.CS(=O)(=O)c1ccc(Nc2cc(ccn2)-c2ccc3nc4CCCCCc4c(N4CC[C@H](N)C4)c3c2)cc1 InChI=1S/C30H33N5O2S.ClH/c1-38(36,37)24-10-8-23(9-11-24)33-29-18-21(13-15-32-29)20-7-12-28-26(17-20)30(35-16-14-22(31)19-35)25-5-3-2-4-6-27(25)34-28;/h7-13,15,17-18,22H,2-6,14,16,19,31H2,1H3,(H,32,33);1H/t22-;/m0./s1 QZWBKNBOYFGYLJ-FTBISJDPSA-N 50624679 CHEMBL5395474 Cholinesterase Equus caballus 3052 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624679 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624679&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552711 Cl.CN(C)S(=O)(=O)c1ccc(Nc2cc(ccn2)-c2ccc3nc4CCCCCc4c(N4CC[C@H](N)C4)c3c2)cc1 InChI=1S/C31H36N6O2S.ClH/c1-36(2)40(38,39)25-11-9-24(10-12-25)34-30-19-22(14-16-33-30)21-8-13-29-27(18-21)31(37-17-15-23(32)20-37)26-6-4-3-5-7-28(26)35-29;/h8-14,16,18-19,23H,3-7,15,17,20,32H2,1-2H3,(H,33,34);1H/t23-;/m0./s1 KGXBYXUMAMZVCP-BQAIUKQQSA-N 50624675 CHEMBL5432535 Cholinesterase Equus caballus 1056 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624675 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624675&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552712 Cl.N[C@H]1CCN(C1)c1c2CCCCCc2nc2ccc(cc12)-c1ccnc(Nc2ccc(cc2)S(=O)(=O)N2CCCC2)c1 InChI=1S/C33H38N6O2S.ClH/c34-25-15-19-38(22-25)33-28-6-2-1-3-7-30(28)37-31-13-8-23(20-29(31)33)24-14-16-35-32(21-24)36-26-9-11-27(12-10-26)42(40,41)39-17-4-5-18-39;/h8-14,16,20-21,25H,1-7,15,17-19,22,34H2,(H,35,36);1H/t25-;/m0./s1 HNDHLWWANDTOAT-UQIIZPHYSA-N 50624677 CHEMBL5415697 Cholinesterase Equus caballus 4957 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624677 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624677&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552713 Cl.N[C@H]1CCN(C1)c1c2CCCCCc2nc2ccc(cc12)-c1ccnc(Nc2ccc(cc2)S(=O)(=O)N2CCNCC2)c1 InChI=1S/C33H39N7O2S.ClH/c34-25-13-17-39(22-25)33-28-4-2-1-3-5-30(28)38-31-11-6-23(20-29(31)33)24-12-14-36-32(21-24)37-26-7-9-27(10-8-26)43(41,42)40-18-15-35-16-19-40;/h6-12,14,20-21,25,35H,1-5,13,15-19,22,34H2,(H,36,37);1H/t25-;/m0./s1 YRUHOLQEDNSTMY-UQIIZPHYSA-N 50624678 CHEMBL5423439 Cholinesterase Equus caballus 2824 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624678 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624678&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552714 Cl.CN1CCN(CC1)S(=O)(=O)c1ccc(Nc2cc(ccn2)-c2ccc3nc4CCCCCc4c(N4CC[C@H](N)C4)c3c2)cc1 InChI=1S/C34H41N7O2S.ClH/c1-39-17-19-41(20-18-39)44(42,43)28-10-8-27(9-11-28)37-33-22-25(13-15-36-33)24-7-12-32-30(21-24)34(40-16-14-26(35)23-40)29-5-3-2-4-6-31(29)38-32;/h7-13,15,21-22,26H,2-6,14,16-20,23,35H2,1H3,(H,36,37);1H/t26-;/m0./s1 DOHVXXFLXSSSSY-SNYZSRNZSA-N 50624680 CHEMBL5439122 Cholinesterase Equus caballus 4378 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624680 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624680&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552715 Cl.N[C@H]1CCN(C1)c1c2CCCCCc2nc2ccc(cc12)-c1ccnc(Nc2ccc(cc2)S(=O)(=O)N2CCOCC2)c1 InChI=1S/C33H38N6O3S.ClH/c34-25-13-15-38(22-25)33-28-4-2-1-3-5-30(28)37-31-11-6-23(20-29(31)33)24-12-14-35-32(21-24)36-26-7-9-27(10-8-26)43(40,41)39-16-18-42-19-17-39;/h6-12,14,20-21,25H,1-5,13,15-19,22,34H2,(H,35,36);1H/t25-;/m0./s1 RZEXCBIQBLPVHE-UQIIZPHYSA-N 50624681 CHEMBL5422892 Cholinesterase Equus caballus 1816 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624681 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624681&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552716 Cl.N[C@H]1CCN(C1)c1c2CCCCCc2nc2ccc(cc12)-c1ccnc(Nc2cccc(c2)S(=O)(=O)N2CCOCC2)c1 InChI=1S/C33H38N6O3S.ClH/c34-25-12-14-38(22-25)33-28-7-2-1-3-8-30(28)37-31-10-9-23(19-29(31)33)24-11-13-35-32(20-24)36-26-5-4-6-27(21-26)43(40,41)39-15-17-42-18-16-39;/h4-6,9-11,13,19-21,25H,1-3,7-8,12,14-18,22,34H2,(H,35,36);1H/t25-;/m0./s1 WRFGXXCXIRTJNE-UQIIZPHYSA-N 50624676 CHEMBL5424161 Cholinesterase Equus caballus 1982 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624676 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624676&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552717 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase Equus caballus 13 ChEMBL 10.1016/j.ejmech.2022.114701 10.7270/Q2F76HZ3 36054949 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,8T5G,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543539 CN(CCC=C1c2ccccc2-c2ccccc12)C(CCO)C(=O)NCc1ccccc1Cl InChI=1S/C28H29ClN2O2/c1-31(27(16-18-32)28(33)30-19-20-9-2-7-15-26(20)29)17-8-14-25-23-12-5-3-10-21(23)22-11-4-6-13-24(22)25/h2-7,9-15,27,32H,8,16-19H2,1H3,(H,30,33) QAJPGPJUFIXPGH-UHFFFAOYSA-N 50577064 CHEMBL4874054 Cholinesterase Equus caballus 1630 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577064 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577064&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164628627 471053187 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543540 CN(CCC=C1c2ccccc2-c2ccccc12)C(CCO)C(=O)NCc1ccc(F)cc1 InChI=1S/C28H29FN2O2/c1-31(27(16-18-32)28(33)30-19-20-12-14-21(29)15-13-20)17-6-11-26-24-9-4-2-7-22(24)23-8-3-5-10-25(23)26/h2-5,7-15,27,32H,6,16-19H2,1H3,(H,30,33) KWEXLOGIZOTABQ-UHFFFAOYSA-N 50577066 CHEMBL4870136 Cholinesterase Equus caballus 978 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577066 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577066&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164624676 471053189 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543541 CN(CCC=C1c2ccccc2CCc2ccccc12)C(CCN)C(=O)NCc1ccccc1 InChI=1S/C30H35N3O/c1-33(29(19-20-31)30(34)32-22-23-10-3-2-4-11-23)21-9-16-28-26-14-7-5-12-24(26)17-18-25-13-6-8-15-27(25)28/h2-8,10-16,29H,9,17-22,31H2,1H3,(H,32,34) GNTZZKMAQQSFOH-UHFFFAOYSA-N 50577078 CHEMBL4854550 Cholinesterase Equus caballus 1470 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577078 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577078&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164614582 471053201 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543542 CN(CCC=C1c2ccccc2CCc2ccccc12)C(CCN)C(=O)NCc1ccccc1Cl InChI=1S/C30H34ClN3O/c1-34(29(18-19-32)30(35)33-21-24-11-4-7-15-28(24)31)20-8-14-27-25-12-5-2-9-22(25)16-17-23-10-3-6-13-26(23)27/h2-7,9-15,29H,8,16-21,32H2,1H3,(H,33,35) JPAMFFFLVIJEBI-UHFFFAOYSA-N 50577079 CHEMBL4859850 Cholinesterase Equus caballus 1230 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577079 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577079&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164618011 471053202 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543543 CN(CCC=C1c2ccccc2CCc2ccccc12)C(CCN)C(=O)NCc1ccc(Cl)cc1 InChI=1S/C30H34ClN3O/c1-34(29(18-19-32)30(35)33-21-22-12-16-25(31)17-13-22)20-6-11-28-26-9-4-2-7-23(26)14-15-24-8-3-5-10-27(24)28/h2-5,7-13,16-17,29H,6,14-15,18-21,32H2,1H3,(H,33,35) MEYQZEAPWOENKX-UHFFFAOYSA-N 50577080 CHEMBL4873878 Cholinesterase Equus caballus 2980 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577080 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577080&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164619901 471053203 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543544 CN(CCC=C1c2ccccc2CCc2ccccc12)C(CCN)C(=O)NCc1ccc(F)cc1 InChI=1S/C30H34FN3O/c1-34(29(18-19-32)30(35)33-21-22-12-16-25(31)17-13-22)20-6-11-28-26-9-4-2-7-23(26)14-15-24-8-3-5-10-27(24)28/h2-5,7-13,16-17,29H,6,14-15,18-21,32H2,1H3,(H,33,35) XQKOUGSYVSHRGU-UHFFFAOYSA-N 50577081 CHEMBL4852705 Cholinesterase Equus caballus 1210 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577081 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577081&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164611745 471053204 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543545 CN(CCC=C1c2ccccc2CCc2ccccc12)C(CCN)C(=O)NCc1ccc(C)cc1 InChI=1S/C31H37N3O/c1-23-13-15-24(16-14-23)22-33-31(35)30(19-20-32)34(2)21-7-12-29-27-10-5-3-8-25(27)17-18-26-9-4-6-11-28(26)29/h3-6,8-16,30H,7,17-22,32H2,1-2H3,(H,33,35) LTGIWDWJRRMWFN-UHFFFAOYSA-N 50577082 CHEMBL4861574 Cholinesterase Equus caballus 2350 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50577082 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50577082&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 164613652 471053205 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543546 CN(CCC=C1c2ccccc2C=Cc2ccccc12)C(CO)C(=O)NCc1ccccc1 InChI=1S/C29H30N2O2/c1-31(28(21-32)29(33)30-20-22-10-3-2-4-11-22)19-9-16-27-25-14-7-5-12-23(25)17-18-24-13-6-8-15-26(24)27/h2-8,10-18,28,32H,9,19-21H2,1H3,(H,30,33) DLLJTIVLTYPCTK-UHFFFAOYSA-N 50620842 CHEMBL5429596 Cholinesterase Equus caballus 4350 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620842 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620842&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543547 CN(CCC=C1c2ccccc2C=Cc2ccccc12)C(CO)C(=O)NCc1ccccc1Cl InChI=1S/C29H29ClN2O2/c1-32(28(20-33)29(34)31-19-23-11-4-7-15-27(23)30)18-8-14-26-24-12-5-2-9-21(24)16-17-22-10-3-6-13-25(22)26/h2-7,9-17,28,33H,8,18-20H2,1H3,(H,31,34) JJVVYAQYJIRGKI-UHFFFAOYSA-N 50620843 CHEMBL5421996 Cholinesterase Equus caballus 8230 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620843 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620843&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543548 CN(CCC=C1c2ccccc2C=Cc2ccccc12)C(CO)C(=O)NCc1ccc(F)cc1 InChI=1S/C29H29FN2O2/c1-32(28(20-33)29(34)31-19-21-12-16-24(30)17-13-21)18-6-11-27-25-9-4-2-7-22(25)14-15-23-8-3-5-10-26(23)27/h2-5,7-17,28,33H,6,18-20H2,1H3,(H,31,34) KCUSODZXLMWOTH-UHFFFAOYSA-N 50620844 CHEMBL5427565 Cholinesterase Equus caballus 3240 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620844 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620844&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543549 CN(CCC=C1c2ccccc2C=Cc2ccccc12)C(CO)C(=O)NCc1ccc(C)cc1 InChI=1S/C30H32N2O2/c1-22-13-15-23(16-14-22)20-31-30(34)29(21-33)32(2)19-7-12-28-26-10-5-3-8-24(26)17-18-25-9-4-6-11-27(25)28/h3-6,8-18,29,33H,7,19-21H2,1-2H3,(H,31,34) ZGRUJXYNNOKTJQ-UHFFFAOYSA-N 50620845 CHEMBL5435738 Cholinesterase Equus caballus 6220 ChEMBL 10.1016/j.ejmech.2023.115832 10.7270/Q2WM1JS6 37837674 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620845 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620845&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552858 [O-][N+](=O)c1ccccc1CN(CC(=O)Nc1ccccc1)Cc1ccco1 InChI=1S/C20H19N3O4/c24-20(21-17-8-2-1-3-9-17)15-22(14-18-10-6-12-27-18)13-16-7-4-5-11-19(16)23(25)26/h1-12H,13-15H2,(H,21,24) CMVXDUZFKKRYCX-UHFFFAOYSA-N 50624755 CHEMBL5436165 Cholinesterase Equus caballus 1300 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624755 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624755&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552859 O=C(CN(Cc1ccco1)Cc1ccccc1)Nc1ccccc1 InChI=1S/C20H20N2O2/c23-20(21-18-10-5-2-6-11-18)16-22(15-19-12-7-13-24-19)14-17-8-3-1-4-9-17/h1-13H,14-16H2,(H,21,23) XMEAJOOXRIFYIS-UHFFFAOYSA-N 50624756 CHEMBL5404604 Cholinesterase Equus caballus 15440 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624756 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624756&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552860 Cc1ccccc1NC(=O)CN(Cc1ccco1)Cc1ccccc1 InChI=1S/C21H22N2O2/c1-17-8-5-6-12-20(17)22-21(24)16-23(15-19-11-7-13-25-19)14-18-9-3-2-4-10-18/h2-13H,14-16H2,1H3,(H,22,24) UTGVGSIOVRQHOC-UHFFFAOYSA-N 50624757 CHEMBL5424282 Cholinesterase Equus caballus 5460 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624757 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624757&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552861 Cc1cccc(NC(=O)CN(Cc2ccco2)Cc2ccccc2)c1 InChI=1S/C21H22N2O2/c1-17-7-5-10-19(13-17)22-21(24)16-23(15-20-11-6-12-25-20)14-18-8-3-2-4-9-18/h2-13H,14-16H2,1H3,(H,22,24) WCAUBKYFTKHIKA-UHFFFAOYSA-N 50624758 CHEMBL5403182 Cholinesterase Equus caballus 7330 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624758 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624758&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552862 Cc1ccc(NC(=O)CN(Cc2ccco2)Cc2ccccc2)cc1 InChI=1S/C21H22N2O2/c1-17-9-11-19(12-10-17)22-21(24)16-23(15-20-8-5-13-25-20)14-18-6-3-2-4-7-18/h2-13H,14-16H2,1H3,(H,22,24) RRBJRSNGYOBNOB-UHFFFAOYSA-N 50624759 CHEMBL5414053 Cholinesterase Equus caballus 148800 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624759 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624759&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552863 COc1ccccc1NC(=O)CN(Cc1ccco1)Cc1ccccc1 InChI=1S/C21H22N2O3/c1-25-20-12-6-5-11-19(20)22-21(24)16-23(15-18-10-7-13-26-18)14-17-8-3-2-4-9-17/h2-13H,14-16H2,1H3,(H,22,24) MBVDZKRQOKGMDP-UHFFFAOYSA-N 50624760 CHEMBL5415062 Cholinesterase Equus caballus 26360 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624760 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624760&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552864 COc1cccc(NC(=O)CN(Cc2ccco2)Cc2ccccc2)c1 InChI=1S/C21H22N2O3/c1-25-19-10-5-9-18(13-19)22-21(24)16-23(15-20-11-6-12-26-20)14-17-7-3-2-4-8-17/h2-13H,14-16H2,1H3,(H,22,24) SPVSZJXXTCMJIQ-UHFFFAOYSA-N 50624761 CHEMBL5405682 Cholinesterase Equus caballus 24760 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624761 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624761&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552865 COc1ccc(NC(=O)CN(Cc2ccco2)Cc2ccccc2)cc1 InChI=1S/C21H22N2O3/c1-25-19-11-9-18(10-12-19)22-21(24)16-23(15-20-8-5-13-26-20)14-17-6-3-2-4-7-17/h2-13H,14-16H2,1H3,(H,22,24) XGVHPUVDBSRNBV-UHFFFAOYSA-N 50624762 CHEMBL5404709 Cholinesterase Equus caballus 121500 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624762 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624762&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552866 Fc1ccccc1NC(=O)CN(Cc1ccco1)Cc1ccccc1 InChI=1S/C20H19FN2O2/c21-18-10-4-5-11-19(18)22-20(24)15-23(14-17-9-6-12-25-17)13-16-7-2-1-3-8-16/h1-12H,13-15H2,(H,22,24) KGLRSZOMPUNXGK-UHFFFAOYSA-N 50624763 CHEMBL5433269 Cholinesterase Equus caballus 8860 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624763 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624763&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552867 Fc1cccc(NC(=O)CN(Cc2ccco2)Cc2ccccc2)c1 InChI=1S/C20H19FN2O2/c21-17-8-4-9-18(12-17)22-20(24)15-23(14-19-10-5-11-25-19)13-16-6-2-1-3-7-16/h1-12H,13-15H2,(H,22,24) BFCQOORVNGUWFA-UHFFFAOYSA-N 50624764 CHEMBL5440572 Cholinesterase Equus caballus 31680 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624764 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624764&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552868 Fc1ccc(NC(=O)CN(Cc2ccco2)Cc2ccccc2)cc1 InChI=1S/C20H19FN2O2/c21-17-8-10-18(11-9-17)22-20(24)15-23(14-19-7-4-12-25-19)13-16-5-2-1-3-6-16/h1-12H,13-15H2,(H,22,24) CRECSZZWMBITEB-UHFFFAOYSA-N 50624765 CHEMBL5428280 Cholinesterase Equus caballus 28300 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624765 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624765&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552869 Clc1ccccc1NC(=O)CN(Cc1ccco1)Cc1ccccc1 InChI=1S/C20H19ClN2O2/c21-18-10-4-5-11-19(18)22-20(24)15-23(14-17-9-6-12-25-17)13-16-7-2-1-3-8-16/h1-12H,13-15H2,(H,22,24) ACHFFRNAKLHWOQ-UHFFFAOYSA-N 50624766 CHEMBL5417054 Cholinesterase Equus caballus 9960 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624766 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624766&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552870 Clc1cccc(NC(=O)CN(Cc2ccco2)Cc2ccccc2)c1 InChI=1S/C20H19ClN2O2/c21-17-8-4-9-18(12-17)22-20(24)15-23(14-19-10-5-11-25-19)13-16-6-2-1-3-7-16/h1-12H,13-15H2,(H,22,24) PZSWHHCFPBWXSF-UHFFFAOYSA-N 50624767 CHEMBL5422242 Cholinesterase Equus caballus 47350 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624767 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624767&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552871 Brc1cccc(NC(=O)CN(Cc2ccco2)Cc2ccccc2)c1 InChI=1S/C20H19BrN2O2/c21-17-8-4-9-18(12-17)22-20(24)15-23(14-19-10-5-11-25-19)13-16-6-2-1-3-7-16/h1-12H,13-15H2,(H,22,24) XSCWDVOFERXTRT-UHFFFAOYSA-N 50624768 CHEMBL5421519 Cholinesterase Equus caballus 6230 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624768 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624768&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552872 FC(F)(F)c1ccc(NC(=O)CN(Cc2ccco2)Cc2ccccc2)cc1 InChI=1S/C21H19F3N2O2/c22-21(23,24)17-8-10-18(11-9-17)25-20(27)15-26(14-19-7-4-12-28-19)13-16-5-2-1-3-6-16/h1-12H,13-15H2,(H,25,27) ABKPLKHBQNAEIU-UHFFFAOYSA-N 50624769 CHEMBL5406280 Cholinesterase Equus caballus 6800 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624769 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624769&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552873 O=C(CN(Cc1ccco1)Cc1ccccc1)Nc1ccccc1C#N InChI=1S/C21H19N3O2/c22-13-18-9-4-5-11-20(18)23-21(25)16-24(15-19-10-6-12-26-19)14-17-7-2-1-3-8-17/h1-12H,14-16H2,(H,23,25) QPVNKSZVLGNJKM-UHFFFAOYSA-N 50624770 CHEMBL5398094 Cholinesterase Equus caballus 117800 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624770 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624770&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552874 O=C(CN(Cc1ccco1)Cc1ccccc1)Nc1ccc(cc1)C#N InChI=1S/C21H19N3O2/c22-13-17-8-10-19(11-9-17)23-21(25)16-24(15-20-7-4-12-26-20)14-18-5-2-1-3-6-18/h1-12H,14-16H2,(H,23,25) FYACYEGDKVBMRC-UHFFFAOYSA-N 50624771 CHEMBL5418925 Cholinesterase Equus caballus 710000 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624771 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624771&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552875 Cc1cccc(NC(=O)CN(Cc2ccco2)Cc2ccccc2)c1C InChI=1S/C22H24N2O2/c1-17-8-6-12-21(18(17)2)23-22(25)16-24(15-20-11-7-13-26-20)14-19-9-4-3-5-10-19/h3-13H,14-16H2,1-2H3,(H,23,25) BNWLDGSYYZSBGO-UHFFFAOYSA-N 50624772 CHEMBL5417660 Cholinesterase Equus caballus 2670 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624772 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624772&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552876 Fc1cccc(NC(=O)CN(Cc2ccco2)Cc2ccccc2)c1F InChI=1S/C20H18F2N2O2/c21-17-9-4-10-18(20(17)22)23-19(25)14-24(13-16-8-5-11-26-16)12-15-6-2-1-3-7-15/h1-11H,12-14H2,(H,23,25) XVHGYXJJMITBCI-UHFFFAOYSA-N 50624773 CHEMBL5397885 Cholinesterase Equus caballus 13320 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624773 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624773&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552877 COc1cc(NC(=O)CN(Cc2ccco2)Cc2ccccc2)cc(OC)c1OC InChI=1S/C23H26N2O5/c1-27-20-12-18(13-21(28-2)23(20)29-3)24-22(26)16-25(15-19-10-7-11-30-19)14-17-8-5-4-6-9-17/h4-13H,14-16H2,1-3H3,(H,24,26) PMISUSCCBQNBIP-UHFFFAOYSA-N 50624774 CHEMBL5438113 Cholinesterase Equus caballus 52350 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624774 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624774&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552878 O=C(CN(Cc1ccco1)Cc1ccccc1)Nc1cccc2ccccc12 InChI=1S/C24H22N2O2/c27-24(25-23-14-6-11-20-10-4-5-13-22(20)23)18-26(17-21-12-7-15-28-21)16-19-8-2-1-3-9-19/h1-15H,16-18H2,(H,25,27) NOODDATYEDGUGS-UHFFFAOYSA-N 50624775 CHEMBL5431454 Cholinesterase Equus caballus 3530 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624775 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624775&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552879 O=C(CN(Cc1ccco1)Cc1ccccc1)Nc1ccc2ccccc2c1 InChI=1S/C24H22N2O2/c27-24(25-22-13-12-20-9-4-5-10-21(20)15-22)18-26(17-23-11-6-14-28-23)16-19-7-2-1-3-8-19/h1-15H,16-18H2,(H,25,27) LLRJEGCIEQQXKZ-UHFFFAOYSA-N 50624776 CHEMBL5427070 Cholinesterase Equus caballus 9770 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624776 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624776&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552880 O=C(CN(Cc1ccco1)Cc1ccccc1)Nc1cnc2ccccc2c1 InChI=1S/C23H21N3O2/c27-23(25-20-13-19-9-4-5-11-22(19)24-14-20)17-26(16-21-10-6-12-28-21)15-18-7-2-1-3-8-18/h1-14H,15-17H2,(H,25,27) HMUWJYZUFIRWQO-UHFFFAOYSA-N 50624777 CHEMBL5423191 Cholinesterase Equus caballus 27940 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624777 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624777&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552881 O=C(CN(Cc1ccco1)Cc1ccccc1)Nc1ccc2OCOc2c1 InChI=1S/C21H20N2O4/c24-21(22-17-8-9-19-20(11-17)27-15-26-19)14-23(13-18-7-4-10-25-18)12-16-5-2-1-3-6-16/h1-11H,12-15H2,(H,22,24) YRWUHPMPMKUYLJ-UHFFFAOYSA-N 50624778 CHEMBL5430438 Cholinesterase Equus caballus 8260 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624778 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624778&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552882 O=C(CN(Cc1ccco1)Cc1ccco1)Nc1ccccc1 InChI=1S/C18H18N2O3/c21-18(19-15-6-2-1-3-7-15)14-20(12-16-8-4-10-22-16)13-17-9-5-11-23-17/h1-11H,12-14H2,(H,19,21) XAPVNWSCVAUVTO-UHFFFAOYSA-N 50624779 CHEMBL5406083 Cholinesterase Equus caballus 7810 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624779 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624779&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552883 O=C(CN(Cc1ccco1)Cc1cccc2ccccc12)Nc1ccccc1 InChI=1S/C24H22N2O2/c27-24(25-21-11-2-1-3-12-21)18-26(17-22-13-7-15-28-22)16-20-10-6-9-19-8-4-5-14-23(19)20/h1-15H,16-18H2,(H,25,27) BOXOFOJEJMZKNH-UHFFFAOYSA-N 50624780 CHEMBL5420905 Cholinesterase Equus caballus 21750 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624780 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624780&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552884 O=C(CN(Cc1ccco1)Cc1c[nH]c2ccccc12)Nc1ccccc1 InChI=1S/C22H21N3O2/c26-22(24-18-7-2-1-3-8-18)16-25(15-19-9-6-12-27-19)14-17-13-23-21-11-5-4-10-20(17)21/h1-13,23H,14-16H2,(H,24,26) QVJXXOAZYRJNLU-UHFFFAOYSA-N 50624781 CHEMBL5400291 Cholinesterase Equus caballus 2140 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624781 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624781&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552885 Cc1ccccc1NC(=O)CN(Cc1ccco1)Cc1c[nH]c2ccccc12 InChI=1S/C23H23N3O2/c1-17-7-2-4-10-21(17)25-23(27)16-26(15-19-8-6-12-28-19)14-18-13-24-22-11-5-3-9-20(18)22/h2-13,24H,14-16H2,1H3,(H,25,27) JJYZUCVLMBBYPV-UHFFFAOYSA-N 50624782 CHEMBL5414770 Cholinesterase Equus caballus 4390 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624782 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624782&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552886 Cc1cccc(NC(=O)CN(Cc2ccco2)Cc2c[nH]c3ccccc23)c1 InChI=1S/C23H23N3O2/c1-17-6-4-7-19(12-17)25-23(27)16-26(15-20-8-5-11-28-20)14-18-13-24-22-10-3-2-9-21(18)22/h2-13,24H,14-16H2,1H3,(H,25,27) KCRVEUDHFZNHQQ-UHFFFAOYSA-N 50624783 CHEMBL5420796 Cholinesterase Equus caballus 6610 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624783 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624783&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552887 Cc1cccc(NC(=O)CN(Cc2ccco2)Cc2c[nH]c3ccccc23)c1C InChI=1S/C24H25N3O2/c1-17-7-5-11-22(18(17)2)26-24(28)16-27(15-20-8-6-12-29-20)14-19-13-25-23-10-4-3-9-21(19)23/h3-13,25H,14-16H2,1-2H3,(H,26,28) LVDYJPXFAHSPOQ-UHFFFAOYSA-N 50624784 CHEMBL5394645 Cholinesterase Equus caballus 10880 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624784 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624784&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552888 O=C(CN(Cc1ccco1)Cc1ccc2ccccc2c1)Nc1ccccc1 InChI=1S/C24H22N2O2/c27-24(25-22-9-2-1-3-10-22)18-26(17-23-11-6-14-28-23)16-19-12-13-20-7-4-5-8-21(20)15-19/h1-15H,16-18H2,(H,25,27) WBYIZYZEXAUULL-UHFFFAOYSA-N 50624785 CHEMBL5417369 Cholinesterase Equus caballus 2260 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624785 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624785&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552889 Cc1ccccc1NC(=O)CN(Cc1ccco1)Cc1ccc2ccccc2c1 InChI=1S/C25H24N2O2/c1-19-7-2-5-11-24(19)26-25(28)18-27(17-23-10-6-14-29-23)16-20-12-13-21-8-3-4-9-22(21)15-20/h2-15H,16-18H2,1H3,(H,26,28) NQCLJWAIBRCCOW-UHFFFAOYSA-N 50624786 CHEMBL5412334 Cholinesterase Equus caballus 1220 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624786 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624786&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552890 Cc1cccc(NC(=O)CN(Cc2ccco2)Cc2ccc3ccccc3c2)c1 InChI=1S/C25H24N2O2/c1-19-6-4-9-23(14-19)26-25(28)18-27(17-24-10-5-13-29-24)16-20-11-12-21-7-2-3-8-22(21)15-20/h2-15H,16-18H2,1H3,(H,26,28) NXQNKTPFQHNZQO-UHFFFAOYSA-N 50624787 CHEMBL5403387 Cholinesterase Equus caballus 1740 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624787 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624787&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552891 Cc1cccc(NC(=O)CN(Cc2ccco2)Cc2ccc3ccccc3c2)c1C InChI=1S/C26H26N2O2/c1-19-7-5-11-25(20(19)2)27-26(29)18-28(17-24-10-6-14-30-24)16-21-12-13-22-8-3-4-9-23(22)15-21/h3-15H,16-18H2,1-2H3,(H,27,29) RSJPDYXBTZQFJO-UHFFFAOYSA-N 50624788 CHEMBL5426534 Cholinesterase Equus caballus 11020 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624788 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624788&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552892 C(CN(Cc1ccco1)Cc1ccc2ccccc2c1)Cc1ccccc1 InChI=1S/C25H25NO/c1-2-8-21(9-3-1)10-6-16-26(20-25-13-7-17-27-25)19-22-14-15-23-11-4-5-12-24(23)18-22/h1-5,7-9,11-15,17-18H,6,10,16,19-20H2 SDBRYSCCUDBFFL-UHFFFAOYSA-N 50624789 CHEMBL5421870 Cholinesterase Equus caballus 15700 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624789 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624789&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552893 CCCN(CCCc1ccccc1)Cc1ccc2ccccc2c1 InChI=1S/C23H27N/c1-2-16-24(17-8-11-20-9-4-3-5-10-20)19-21-14-15-22-12-6-7-13-23(22)18-21/h3-7,9-10,12-15,18H,2,8,11,16-17,19H2,1H3 YNZZDLPGQNWRQR-UHFFFAOYSA-N 50624790 CHEMBL5435700 Cholinesterase Equus caballus 1450 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624790 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624790&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552894 CCCCN(CCCc1ccccc1)Cc1ccc2ccccc2c1 InChI=1S/C24H29N/c1-2-3-17-25(18-9-12-21-10-5-4-6-11-21)20-22-15-16-23-13-7-8-14-24(23)19-22/h4-8,10-11,13-16,19H,2-3,9,12,17-18,20H2,1H3 NAKYNKMYONGAHY-UHFFFAOYSA-N 50624791 CHEMBL5416136 Cholinesterase Equus caballus 230 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624791 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624791&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552895 CC(C)CN(CCCc1ccccc1)Cc1ccc2ccccc2c1 InChI=1S/C24H29N/c1-20(2)18-25(16-8-11-21-9-4-3-5-10-21)19-22-14-15-23-12-6-7-13-24(23)17-22/h3-7,9-10,12-15,17,20H,8,11,16,18-19H2,1-2H3 QPZCQZRXCJHWCT-UHFFFAOYSA-N 50624792 CHEMBL5405011 Cholinesterase Equus caballus 4040 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624792 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624792&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552896 CCCN(CC(=O)Nc1ccccc1C)Cc1ccc2ccccc2c1 InChI=1S/C23H26N2O/c1-3-14-25(17-23(26)24-22-11-7-4-8-18(22)2)16-19-12-13-20-9-5-6-10-21(20)15-19/h4-13,15H,3,14,16-17H2,1-2H3,(H,24,26) UFXPVHHQTFAOAI-UHFFFAOYSA-N 50624793 CHEMBL5414031 Cholinesterase Equus caballus 190 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624793 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624793&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552897 CCCCN(CC(=O)Nc1ccccc1C)Cc1ccc2ccccc2c1 InChI=1S/C24H28N2O/c1-3-4-15-26(18-24(27)25-23-12-8-5-9-19(23)2)17-20-13-14-21-10-6-7-11-22(21)16-20/h5-14,16H,3-4,15,17-18H2,1-2H3,(H,25,27) QQVAYJRQVBERGT-UHFFFAOYSA-N 50624794 CHEMBL5425810 Cholinesterase Equus caballus 1480 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624794 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624794&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552898 CC(C)CN(CC(=O)Nc1ccccc1C)Cc1ccc2ccccc2c1 InChI=1S/C24H28N2O/c1-18(2)15-26(17-24(27)25-23-11-7-4-8-19(23)3)16-20-12-13-21-9-5-6-10-22(21)14-20/h4-14,18H,15-17H2,1-3H3,(H,25,27) ULIOAMNTKXKLNZ-UHFFFAOYSA-N 50624795 CHEMBL5403451 Cholinesterase Equus caballus 220 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624795 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624795&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552899 Cc1ccccc1NC(=O)CN(Cc1ccc2ccccc2c1)C1CCCCC1 InChI=1S/C26H30N2O/c1-20-9-5-8-14-25(20)27-26(29)19-28(24-12-3-2-4-13-24)18-21-15-16-22-10-6-7-11-23(22)17-21/h5-11,14-17,24H,2-4,12-13,18-19H2,1H3,(H,27,29) ICZKGSQUBHHGOD-UHFFFAOYSA-N 50624796 CHEMBL5414945 Cholinesterase Equus caballus 4260 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624796 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624796&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552900 CCN(CC)CCN(CC(=O)Nc1ccccc1C)Cc1ccc2ccccc2c1 InChI=1S/C26H33N3O/c1-4-28(5-2)16-17-29(20-26(30)27-25-13-9-6-10-21(25)3)19-22-14-15-23-11-7-8-12-24(23)18-22/h6-15,18H,4-5,16-17,19-20H2,1-3H3,(H,27,30) GGTMEVKAHJJUQB-UHFFFAOYSA-N 50624797 CHEMBL5436125 Cholinesterase Equus caballus 1450 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624797 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624797&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552901 Cc1ccccc1NC(=O)CN(Cc1ccc2ccccc2c1)CC(C)(C)C InChI=1S/C25H30N2O/c1-19-9-5-8-12-23(19)26-24(28)17-27(18-25(2,3)4)16-20-13-14-21-10-6-7-11-22(21)15-20/h5-15H,16-18H2,1-4H3,(H,26,28) AGDABZRBCXWDDH-UHFFFAOYSA-N 50624798 CHEMBL5439234 Cholinesterase Equus caballus 4100 ChEMBL 10.1016/j.ejmech.2022.114729 10.7270/Q2J107KF 36084535 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624798 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624798&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51545108 Clc1ccccc1CNCC12CC3CC(CC(C3)C1)C2 InChI=1S/C18H24ClN/c19-17-4-2-1-3-16(17)11-20-12-18-8-13-5-14(9-18)7-15(6-13)10-18/h1-4,13-15,20H,5-12H2 DGIPDOBNBPBNJQ-UHFFFAOYSA-N 50404094 CHEMBL5265926 Cholinesterase Equus caballus 7500 ChEMBL 10.1016/j.ejmech.2022.114695 10.7270/Q2K078MX 36044812 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50404094 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50404094&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 44352813 163353118 CHEMBL336517 ZINC13587521 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51545126 Cc1ccc(cc1)S(=O)(=O)NCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C25H31N3O2S/c1-19-13-15-20(16-14-19)31(29,30)27-18-8-2-7-17-26-25-21-9-3-5-11-23(21)28-24-12-6-4-10-22(24)25/h3,5,9,11,13-16,27H,2,4,6-8,10,12,17-18H2,1H3,(H,26,28) AZQJBDNDDDGKPV-UHFFFAOYSA-N 50621455 CHEMBL5433193 Cholinesterase Equus caballus 68 ChEMBL 10.1016/j.ejmech.2022.114695 10.7270/Q2K078MX 36044812 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621455 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621455&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51545131 Clc1ccc(cc1)-c1cc(no1)C(=O)NCCNc1c2CCCCc2nc2cc(Cl)ccc12 InChI=1S/C25H22Cl2N4O2/c26-16-7-5-15(6-8-16)23-14-22(31-33-23)25(32)29-12-11-28-24-18-3-1-2-4-20(18)30-21-13-17(27)9-10-19(21)24/h5-10,13-14H,1-4,11-12H2,(H,28,30)(H,29,32) ZOLIYHKIBNXSAZ-UHFFFAOYSA-N 50621456 CHEMBL5402779 Cholinesterase Equus caballus 372 ChEMBL 10.1016/j.ejmech.2022.114695 10.7270/Q2K078MX 36044812 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621456 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621456&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51545132 C1CCN(C1)c1cc(nc2ccccc12)-c1ccc2OCOc2c1 InChI=1S/C20H18N2O2/c1-2-6-16-15(5-1)18(22-9-3-4-10-22)12-17(21-16)14-7-8-19-20(11-14)24-13-23-19/h1-2,5-8,11-12H,3-4,9-10,13H2 BJQZRZYHRTZRQE-UHFFFAOYSA-N 50540157 CHEMBL4641481 Cholinesterase Equus caballus 160 ChEMBL 10.1016/j.ejmech.2022.114695 10.7270/Q2K078MX 36044812 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50540157 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50540157&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 156017275 442141720 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51545136 [O-][N+](=O)c1cccc(c1)-c1cc(no1)C(=O)NC1CCN(Cc2ccccc2)CC1 InChI=1S/C22H22N4O4/c27-22(20-14-21(30-24-20)17-7-4-8-19(13-17)26(28)29)23-18-9-11-25(12-10-18)15-16-5-2-1-3-6-16/h1-8,13-14,18H,9-12,15H2,(H,23,27) LCBXBZBIIJCRPP-UHFFFAOYSA-N 50621458 CHEMBL5420918 Cholinesterase Equus caballus 15160 ChEMBL 10.1016/j.ejmech.2022.114695 10.7270/Q2K078MX 36044812 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621458 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621458&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51545137 CN(C)\C=C\C(=O)c1cc2ccc(OCc3cn(Cc4ccc(F)c(F)c4)nn3)cc2oc1=O InChI=1S/C24H20F2N4O4/c1-29(2)8-7-22(31)19-10-16-4-5-18(11-23(16)34-24(19)32)33-14-17-13-30(28-27-17)12-15-3-6-20(25)21(26)9-15/h3-11,13H,12,14H2,1-2H3/b8-7+ YTJZWLBHUIONEM-BQYQJAHWSA-N 50621459 CHEMBL5395479 Cholinesterase Equus caballus 21710 ChEMBL 10.1016/j.ejmech.2022.114695 10.7270/Q2K078MX 36044812 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621459 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621459&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51545153 CCCOc1ccc2c(C)cc(=S)oc2c1OCCC InChI=1S/C16H20O3S/c1-4-8-17-13-7-6-12-11(3)10-14(20)19-15(12)16(13)18-9-5-2/h6-7,10H,4-5,8-9H2,1-3H3 VSRJCSLKWFOAFC-UHFFFAOYSA-N 50621468 CHEMBL5418095 Cholinesterase Equus caballus 17020 ChEMBL 10.1016/j.ejmech.2022.114695 10.7270/Q2K078MX 36044812 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621468 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621468&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51545158 C(CCCN1CCCC1)CCNc1nnc2c(n1)[nH]c1ccc(cc21)N1CCCCC1 InChI=1S/C24H35N7/c1(2-5-13-30-14-8-9-15-30)4-12-25-24-27-23-22(28-29-24)20-18-19(10-11-21(20)26-23)31-16-6-3-7-17-31/h10-11,18H,1-9,12-17H2,(H2,25,26,27,29) POPGUCONQNKJKN-UHFFFAOYSA-N 50621471 CHEMBL5435163 Cholinesterase Equus caballus 210 ChEMBL 10.1016/j.ejmech.2022.114695 10.7270/Q2K078MX 36044812 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621471 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621471&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51545160 CCc1cc(-c2nnc(Nc3ccccc3Cl)s2)c(O)cc1O InChI=1S/C16H14ClN3O2S/c1-2-9-7-10(14(22)8-13(9)21)15-19-20-16(23-15)18-12-6-4-3-5-11(12)17/h3-8,21-22H,2H2,1H3,(H,18,20) XKUKWIJAZRJSBE-UHFFFAOYSA-N 50621472 CHEMBL5438102 Cholinesterase Equus caballus 18340 ChEMBL 10.1016/j.ejmech.2022.114695 10.7270/Q2K078MX 36044812 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621472 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621472&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552118 Cc1ccc2cc(NC(=O)Cn3c(nc4ccccc34)-c3nonc3N)ccc2n1 InChI=1S/C21H17N7O2/c1-12-6-7-13-10-14(8-9-15(13)23-12)24-18(29)11-28-17-5-3-2-4-16(17)25-21(28)19-20(22)27-30-26-19/h2-10H,11H2,1H3,(H2,22,27)(H,24,29) LESZNGMDDFKRPH-UHFFFAOYSA-N 50544536 CHEMBL4638758 Cholinesterase Equus caballus 177 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50544536 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50544536&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1259483 442146099 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552119 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1cnc2ccccc2c1 InChI=1S/C20H15N7O2/c21-19-18(25-29-26-19)20-24-15-7-3-4-8-16(15)27(20)11-17(28)23-13-9-12-5-1-2-6-14(12)22-10-13/h1-10H,11H2,(H2,21,26)(H,23,28) FPAMWJFOROLHQH-UHFFFAOYSA-N 50582481 CHEMBL5093535 Cholinesterase Equus caballus 20 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50582481 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50582481&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 141740365 476027486 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552120 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1cc(F)cc(F)c1 InChI=1S/C17H12F2N6O2/c18-9-5-10(19)7-11(6-9)21-14(26)8-25-13-4-2-1-3-12(13)22-17(25)15-16(20)24-27-23-15/h1-7H,8H2,(H2,20,24)(H,21,26) YSSAWFZYJXYMDY-UHFFFAOYSA-N 50624431 CHEMBL5407485 Cholinesterase Equus caballus 58 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624431 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624431&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552121 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1cc(Cl)cc(Cl)c1 InChI=1S/C17H12Cl2N6O2/c18-9-5-10(19)7-11(6-9)21-14(26)8-25-13-4-2-1-3-12(13)22-17(25)15-16(20)24-27-23-15/h1-7H,8H2,(H2,20,24)(H,21,26) PTNCYBDSBAWRIM-UHFFFAOYSA-N 50624432 CHEMBL5409702 Cholinesterase Equus caballus 4.3 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624432 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624432&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552122 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1cc(Br)cc(Br)c1 InChI=1S/C17H12Br2N6O2/c18-9-5-10(19)7-11(6-9)21-14(26)8-25-13-4-2-1-3-12(13)22-17(25)15-16(20)24-27-23-15/h1-7H,8H2,(H2,20,24)(H,21,26) PLBHSDQNBMWSKU-UHFFFAOYSA-N 50624433 CHEMBL5433321 Cholinesterase Equus caballus 3.8 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624433 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624433&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552123 Cc1cc(C)cc(NC(=O)Cn2c(nc3ccccc23)-c2nonc2N)c1 InChI=1S/C19H18N6O2/c1-11-7-12(2)9-13(8-11)21-16(26)10-25-15-6-4-3-5-14(15)22-19(25)17-18(20)24-27-23-17/h3-9H,10H2,1-2H3,(H2,20,24)(H,21,26) RZZZQERCJNXUSH-UHFFFAOYSA-N 50624434 CHEMBL3422163 Cholinesterase Equus caballus 13 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624434 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624434&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552124 COc1cc(NC(=O)Cn2c(nc3ccccc23)-c2nonc2N)cc(OC)c1 InChI=1S/C19H18N6O4/c1-27-12-7-11(8-13(9-12)28-2)21-16(26)10-25-15-6-4-3-5-14(15)22-19(25)17-18(20)24-29-23-17/h3-9H,10H2,1-2H3,(H2,20,24)(H,21,26) JKQZRBPODKZQGN-UHFFFAOYSA-N 50624435 CHEMBL5408001 Cholinesterase Equus caballus 107 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624435 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624435&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552125 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O InChI=1S/C17H12N8O6/c18-16-15(21-31-22-16)17-20-12-3-1-2-4-13(12)23(17)8-14(26)19-9-5-10(24(27)28)7-11(6-9)25(29)30/h1-7H,8H2,(H2,18,22)(H,19,26) SGNCDLWGLSRLPO-UHFFFAOYSA-N 50624436 CHEMBL5429305 Cholinesterase Equus caballus 2.9 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624436 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624436&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552126 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F InChI=1S/C19H12F6N6O2/c20-18(21,22)9-5-10(19(23,24)25)7-11(6-9)27-14(32)8-31-13-4-2-1-3-12(13)28-17(31)15-16(26)30-33-29-15/h1-7H,8H2,(H2,26,30)(H,27,32) FXQJHNAVAJWPNX-UHFFFAOYSA-N 50624437 CHEMBL5422749 Cholinesterase Equus caballus 7.7 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624437 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624437&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552127 COC(=O)c1cc(NC(=O)Cn2c(nc3ccccc23)-c2nonc2N)cc(c1)C(=O)OC InChI=1S/C21H18N6O6/c1-31-20(29)11-7-12(21(30)32-2)9-13(8-11)23-16(28)10-27-15-6-4-3-5-14(15)24-19(27)17-18(22)26-33-25-17/h3-9H,10H2,1-2H3,(H2,22,26)(H,23,28) PTQIUVLGXUYAIN-UHFFFAOYSA-N 50624438 CHEMBL5427974 Cholinesterase Equus caballus 1.5 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624438 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624438&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552128 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1cc(F)cc(Cl)c1 InChI=1S/C17H12ClFN6O2/c18-9-5-10(19)7-11(6-9)21-14(26)8-25-13-4-2-1-3-12(13)22-17(25)15-16(20)24-27-23-15/h1-7H,8H2,(H2,20,24)(H,21,26) BMKONAGAIXPXOF-UHFFFAOYSA-N 50624439 CHEMBL5432696 Cholinesterase Equus caballus 5.3 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624439 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624439&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552129 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1cc(F)cc(Br)c1 InChI=1S/C17H12BrFN6O2/c18-9-5-10(19)7-11(6-9)21-14(26)8-25-13-4-2-1-3-12(13)22-17(25)15-16(20)24-27-23-15/h1-7H,8H2,(H2,20,24)(H,21,26) XZYCKDDEZWEITK-UHFFFAOYSA-N 50624440 CHEMBL5430550 Cholinesterase Equus caballus 14 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624440 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624440&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552130 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1cc(Cl)cc(Br)c1 InChI=1S/C17H12BrClN6O2/c18-9-5-10(19)7-11(6-9)21-14(26)8-25-13-4-2-1-3-12(13)22-17(25)15-16(20)24-27-23-15/h1-7H,8H2,(H2,20,24)(H,21,26) FRLLBJFWKYRHBQ-UHFFFAOYSA-N 50624441 CHEMBL5395594 Cholinesterase Equus caballus 1.6 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624441 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624441&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552131 Cc1cc(F)cc(NC(=O)Cn2c(nc3ccccc23)-c2nonc2N)c1 InChI=1S/C18H15FN6O2/c1-10-6-11(19)8-12(7-10)21-15(26)9-25-14-5-3-2-4-13(14)22-18(25)16-17(20)24-27-23-16/h2-8H,9H2,1H3,(H2,20,24)(H,21,26) PKNLXDCEFOGZKX-UHFFFAOYSA-N 50624442 CHEMBL5407914 Cholinesterase Equus caballus 58 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624442 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624442&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552132 Cc1cc(Cl)cc(NC(=O)Cn2c(nc3ccccc23)-c2nonc2N)c1 InChI=1S/C18H15ClN6O2/c1-10-6-11(19)8-12(7-10)21-15(26)9-25-14-5-3-2-4-13(14)22-18(25)16-17(20)24-27-23-16/h2-8H,9H2,1H3,(H2,20,24)(H,21,26) JUBJKJSNNNKCJX-UHFFFAOYSA-N 50624443 CHEMBL5409824 Cholinesterase Equus caballus 9.2 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624443 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624443&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552133 Cc1cc(Br)cc(NC(=O)Cn2c(nc3ccccc23)-c2nonc2N)c1 InChI=1S/C18H15BrN6O2/c1-10-6-11(19)8-12(7-10)21-15(26)9-25-14-5-3-2-4-13(14)22-18(25)16-17(20)24-27-23-16/h2-8H,9H2,1H3,(H2,20,24)(H,21,26) JNBZYWYMAYTPOE-UHFFFAOYSA-N 50624444 CHEMBL5428925 Cholinesterase Equus caballus 6.4 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624444 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624444&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552134 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1cc(F)cc(c1)C(F)(F)F InChI=1S/C18H12F4N6O2/c19-10-5-9(18(20,21)22)6-11(7-10)24-14(29)8-28-13-4-2-1-3-12(13)25-17(28)15-16(23)27-30-26-15/h1-7H,8H2,(H2,23,27)(H,24,29) JGOPXTSIOCHJAP-UHFFFAOYSA-N 50624445 CHEMBL5425608 Cholinesterase Equus caballus 255 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624445 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624445&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552135 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1cc(Cl)cc(c1)C(F)(F)F InChI=1S/C18H12ClF3N6O2/c19-10-5-9(18(20,21)22)6-11(7-10)24-14(29)8-28-13-4-2-1-3-12(13)25-17(28)15-16(23)27-30-26-15/h1-7H,8H2,(H2,23,27)(H,24,29) BTXUOKGSNSBXMC-UHFFFAOYSA-N 50624446 CHEMBL5428904 Cholinesterase Equus caballus 2.6 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624446 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624446&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552136 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1cc(Br)cc(c1)C(F)(F)F InChI=1S/C18H12BrF3N6O2/c19-10-5-9(18(20,21)22)6-11(7-10)24-14(29)8-28-13-4-2-1-3-12(13)25-17(28)15-16(23)27-30-26-15/h1-7H,8H2,(H2,23,27)(H,24,29) LUEKRYFILGNLFU-UHFFFAOYSA-N 50624447 CHEMBL5419428 Cholinesterase Equus caballus 4.2 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624447 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624447&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552137 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1cc(Cl)cc(c1)C#N InChI=1S/C18H12ClN7O2/c19-11-5-10(8-20)6-12(7-11)22-15(27)9-26-14-4-2-1-3-13(14)23-18(26)16-17(21)25-28-24-16/h1-7H,9H2,(H2,21,25)(H,22,27) KZBZRHOMVBWNKL-UHFFFAOYSA-N 50624448 CHEMBL5409016 Cholinesterase Equus caballus 2.0 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624448 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624448&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552138 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1cc(Br)cc(c1)C#N InChI=1S/C18H12BrN7O2/c19-11-5-10(8-20)6-12(7-11)22-15(27)9-26-14-4-2-1-3-13(14)23-18(26)16-17(21)25-28-24-16/h1-7H,9H2,(H2,21,25)(H,22,27) IFFSXCHPOGNWKL-UHFFFAOYSA-N 50624449 CHEMBL5435836 Cholinesterase Equus caballus 0.150000 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624449 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624449&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552139 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1cc(cc(c1)C(F)(F)F)[N+]([O-])=O InChI=1S/C18H12F3N7O4/c19-18(20,21)9-5-10(7-11(6-9)28(30)31)23-14(29)8-27-13-4-2-1-3-12(13)24-17(27)15-16(22)26-32-25-15/h1-7H,8H2,(H2,22,26)(H,23,29) XSZBUAMQMYUQSD-UHFFFAOYSA-N 50624450 CHEMBL5432482 Cholinesterase Equus caballus 0.350000 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624450 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624450&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552140 Cc1cc(NC(=O)Cn2c(nc3ccccc23)-c2nonc2N)cc(c1)[N+]([O-])=O InChI=1S/C18H15N7O4/c1-10-6-11(8-12(7-10)25(27)28)20-15(26)9-24-14-5-3-2-4-13(14)21-18(24)16-17(19)23-29-22-16/h2-8H,9H2,1H3,(H2,19,23)(H,20,26) NFXMNSONDSOGEK-UHFFFAOYSA-N 50624451 CHEMBL5398901 Cholinesterase Equus caballus 48 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624451 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624451&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552141 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1ccc(c(Cl)c1)[N+]([O-])=O InChI=1S/C17H12ClN7O4/c18-10-7-9(5-6-12(10)25(27)28)20-14(26)8-24-13-4-2-1-3-11(13)21-17(24)15-16(19)23-29-22-15/h1-7H,8H2,(H2,19,23)(H,20,26) WJROXZDPQLMOHT-UHFFFAOYSA-N 50624452 CHEMBL5408157 Cholinesterase Equus caballus 11 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624452 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624452&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552142 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1ccc(c(Br)c1)[N+]([O-])=O InChI=1S/C17H12BrN7O4/c18-10-7-9(5-6-12(10)25(27)28)20-14(26)8-24-13-4-2-1-3-11(13)21-17(24)15-16(19)23-29-22-15/h1-7H,8H2,(H2,19,23)(H,20,26) AHFNASODICHIRA-UHFFFAOYSA-N 50624453 CHEMBL5417887 Cholinesterase Equus caballus 34 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624453 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624453&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552143 Nc1nonc1-c1nc2ccccc2n1CC(=O)Nc1ccc(F)cc1Br InChI=1S/C17H12BrFN6O2/c18-10-7-9(19)5-6-11(10)21-14(26)8-25-13-4-2-1-3-12(13)22-17(25)15-16(20)24-27-23-15/h1-7H,8H2,(H2,20,24)(H,21,26) QTQQLLXQVBRMJG-UHFFFAOYSA-N 50624454 CHEMBL5431464 Cholinesterase Equus caballus 119 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624454 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624454&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552144 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase Equus caballus 5.2 ChEMBL 10.1016/j.ejmech.2022.114510 10.7270/Q2057MBX 35728508 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,8T5G,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544320 O=C(NCCCCCNc1c2CCCCc2nc2ccccc12)C1CCN(CC1)C(=O)c1ccccc1 InChI=1S/C31H38N4O2/c36-30(23-17-21-35(22-18-23)31(37)24-11-3-1-4-12-24)33-20-10-2-9-19-32-29-25-13-5-7-15-27(25)34-28-16-8-6-14-26(28)29/h1,3-5,7,11-13,15,23H,2,6,8-10,14,16-22H2,(H,32,34)(H,33,36) DINCRWLXSQGFFN-UHFFFAOYSA-N 50621128 CHEMBL5424356 Cholinesterase Equus caballus 47 ChEMBL 10.1016/j.bmc.2024.117649 10.7270/Q29P361C 38401458 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621128 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621128&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544321 O=C(NCCCCCNc1c2CCCCc2nc2ccccc12)C1CCN(CC1)C(=O)c1ccccn1 InChI=1S/C30H37N5O2/c36-29(22-15-20-35(21-16-22)30(37)27-14-6-9-17-31-27)33-19-8-1-7-18-32-28-23-10-2-4-12-25(23)34-26-13-5-3-11-24(26)28/h2,4,6,9-10,12,14,17,22H,1,3,5,7-8,11,13,15-16,18-21H2,(H,32,34)(H,33,36) IZNBACCYGFHUTP-UHFFFAOYSA-N 50621129 CHEMBL5397984 Cholinesterase Equus caballus 324 ChEMBL 10.1016/j.bmc.2024.117649 10.7270/Q29P361C 38401458 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621129 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621129&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544322 O=C(NCCCCCNc1c2CCCCc2nc2ccccc12)C1CCN(CC1)C(=O)c1cccnc1 InChI=1S/C30H37N5O2/c36-29(22-14-19-35(20-15-22)30(37)23-9-8-16-31-21-23)33-18-7-1-6-17-32-28-24-10-2-4-12-26(24)34-27-13-5-3-11-25(27)28/h2,4,8-10,12,16,21-22H,1,3,5-7,11,13-15,17-20H2,(H,32,34)(H,33,36) VRIDBFYGFITWTL-UHFFFAOYSA-N 50621130 CHEMBL5407770 Cholinesterase Equus caballus 99 ChEMBL 10.1016/j.bmc.2024.117649 10.7270/Q29P361C 38401458 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621130 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621130&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544323 O=C(NCCCCCNc1c2CCCCc2nc2ccccc12)C1CCN(CC1)C(=O)c1ccncc1 InChI=1S/C30H37N5O2/c36-29(22-14-20-35(21-15-22)30(37)23-12-18-31-19-13-23)33-17-7-1-6-16-32-28-24-8-2-4-10-26(24)34-27-11-5-3-9-25(27)28/h2,4,8,10,12-13,18-19,22H,1,3,5-7,9,11,14-17,20-21H2,(H,32,34)(H,33,36) OWDZZEHAWJUENW-UHFFFAOYSA-N 50621131 CHEMBL5408459 Cholinesterase Equus caballus 84 ChEMBL 10.1016/j.bmc.2024.117649 10.7270/Q29P361C 38401458 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621131 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621131&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544324 Fc1ccccc1C(=O)N1CCC(CC1)C(=O)NCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C31H37FN4O2/c32-26-13-5-2-10-23(26)31(38)36-20-16-22(17-21-36)30(37)34-19-9-1-8-18-33-29-24-11-3-6-14-27(24)35-28-15-7-4-12-25(28)29/h2-3,5-6,10-11,13-14,22H,1,4,7-9,12,15-21H2,(H,33,35)(H,34,37) ZSVPCGICTHFCFA-UHFFFAOYSA-N 50621132 CHEMBL5414519 Cholinesterase Equus caballus 34 ChEMBL 10.1016/j.bmc.2024.117649 10.7270/Q29P361C 38401458 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621132 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621132&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544325 Fc1cccc(c1)C(=O)N1CCC(CC1)C(=O)NCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C31H37FN4O2/c32-24-10-8-9-23(21-24)31(38)36-19-15-22(16-20-36)30(37)34-18-7-1-6-17-33-29-25-11-2-4-13-27(25)35-28-14-5-3-12-26(28)29/h2,4,8-11,13,21-22H,1,3,5-7,12,14-20H2,(H,33,35)(H,34,37) VKFGBURRHISYFA-UHFFFAOYSA-N 50621133 CHEMBL5403281 Cholinesterase Equus caballus 74 ChEMBL 10.1016/j.bmc.2024.117649 10.7270/Q29P361C 38401458 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621133 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621133&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544326 Fc1ccc(cc1)C(=O)N1CCC(CC1)C(=O)NCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C31H37FN4O2/c32-24-14-12-23(13-15-24)31(38)36-20-16-22(17-21-36)30(37)34-19-7-1-6-18-33-29-25-8-2-4-10-27(25)35-28-11-5-3-9-26(28)29/h2,4,8,10,12-15,22H,1,3,5-7,9,11,16-21H2,(H,33,35)(H,34,37) DYPQVAPMKJBJTE-UHFFFAOYSA-N 50621134 CHEMBL5436402 Cholinesterase Equus caballus 154 ChEMBL 10.1016/j.bmc.2024.117649 10.7270/Q29P361C 38401458 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621134 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621134&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544327 Clc1ccccc1C(=O)N1CCC(CC1)C(=O)NCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C31H37ClN4O2/c32-26-13-5-2-10-23(26)31(38)36-20-16-22(17-21-36)30(37)34-19-9-1-8-18-33-29-24-11-3-6-14-27(24)35-28-15-7-4-12-25(28)29/h2-3,5-6,10-11,13-14,22H,1,4,7-9,12,15-21H2,(H,33,35)(H,34,37) ADIKRIYAGSRODZ-UHFFFAOYSA-N 50621135 CHEMBL5394272 Cholinesterase Equus caballus 83 ChEMBL 10.1016/j.bmc.2024.117649 10.7270/Q29P361C 38401458 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621135 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621135&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544328 Clc1cccc(c1)C(=O)N1CCC(CC1)C(=O)NCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C31H37ClN4O2/c32-24-10-8-9-23(21-24)31(38)36-19-15-22(16-20-36)30(37)34-18-7-1-6-17-33-29-25-11-2-4-13-27(25)35-28-14-5-3-12-26(28)29/h2,4,8-11,13,21-22H,1,3,5-7,12,14-20H2,(H,33,35)(H,34,37) LDGYCTIANASNDI-UHFFFAOYSA-N 50621136 CHEMBL5398943 Cholinesterase Equus caballus 71 ChEMBL 10.1016/j.bmc.2024.117649 10.7270/Q29P361C 38401458 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621136 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621136&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544329 Clc1ccc(cc1)C(=O)N1CCC(CC1)C(=O)NCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C31H37ClN4O2/c32-24-14-12-23(13-15-24)31(38)36-20-16-22(17-21-36)30(37)34-19-7-1-6-18-33-29-25-8-2-4-10-27(25)35-28-11-5-3-9-26(28)29/h2,4,8,10,12-15,22H,1,3,5-7,9,11,16-21H2,(H,33,35)(H,34,37) WBUJDJILDZMYLZ-UHFFFAOYSA-N 50621137 CHEMBL5418800 Cholinesterase Equus caballus 115 ChEMBL 10.1016/j.bmc.2024.117649 10.7270/Q29P361C 38401458 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621137 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621137&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544330 COc1ccccc1C(=O)N1CCC(CC1)C(=O)NCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C32H40N4O3/c1-39-29-16-8-5-13-26(29)32(38)36-21-17-23(18-22-36)31(37)34-20-10-2-9-19-33-30-24-11-3-6-14-27(24)35-28-15-7-4-12-25(28)30/h3,5-6,8,11,13-14,16,23H,2,4,7,9-10,12,15,17-22H2,1H3,(H,33,35)(H,34,37) PKGLSOYRQQJMRE-UHFFFAOYSA-N 50621138 CHEMBL5422348 Cholinesterase Equus caballus 48 ChEMBL 10.1016/j.bmc.2024.117649 10.7270/Q29P361C 38401458 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621138 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621138&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544331 COc1cccc(c1)C(=O)N1CCC(CC1)C(=O)NCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C32H40N4O3/c1-39-25-11-9-10-24(22-25)32(38)36-20-16-23(17-21-36)31(37)34-19-8-2-7-18-33-30-26-12-3-5-14-28(26)35-29-15-6-4-13-27(29)30/h3,5,9-12,14,22-23H,2,4,6-8,13,15-21H2,1H3,(H,33,35)(H,34,37) NVPWITDHFBUZNJ-UHFFFAOYSA-N 50621139 CHEMBL5405550 Cholinesterase Equus caballus 61 ChEMBL 10.1016/j.bmc.2024.117649 10.7270/Q29P361C 38401458 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621139 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621139&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544332 COc1ccc(cc1)C(=O)N1CCC(CC1)C(=O)NCCCCCNc1c2CCCCc2nc2ccccc12 InChI=1S/C32H40N4O3/c1-39-25-15-13-24(14-16-25)32(38)36-21-17-23(18-22-36)31(37)34-20-8-2-7-19-33-30-26-9-3-5-11-28(26)35-29-12-6-4-10-27(29)30/h3,5,9,11,13-16,23H,2,4,6-8,10,12,17-22H2,1H3,(H,33,35)(H,34,37) LXGQLXLSJFGRPI-UHFFFAOYSA-N 50621140 CHEMBL5422925 Cholinesterase Equus caballus 246 ChEMBL 10.1016/j.bmc.2024.117649 10.7270/Q29P361C 38401458 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621140 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621140&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544333 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase Equus caballus 5.2 ChEMBL 10.1016/j.bmc.2024.117649 10.7270/Q29P361C 38401458 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,8T5G,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544334 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase Equus caballus 1260 ChEMBL 10.1016/j.bmc.2024.117649 10.7270/Q29P361C 38401458 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51548094 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase Equus caballus 4220 ChEMBL 10.1016/j.ejmech.2022.114630 10.7270/Q20R9TSV 35987018 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51548095 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase Equus caballus 11680 ChEMBL 10.1016/j.ejmech.2022.114630 10.7270/Q20R9TSV 35987018 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51548096 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase Equus caballus 57 ChEMBL 10.1016/j.ejmech.2022.114630 10.7270/Q20R9TSV 35987018 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,8T5G,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544430 CCN1\C(Sc2ccc(OC(=O)N(C)C)cc12)=C\C(C)=O InChI=1S/C15H18N2O3S/c1-5-17-12-9-11(20-15(19)16(3)4)6-7-13(12)21-14(17)8-10(2)18/h6-9H,5H2,1-4H3/b14-8- ZQZYETBDVZHHOZ-ZSOIEALJSA-N 50621195 CHEMBL5400482 Cholinesterase Equus caballus >10000 ChEMBL 10.1039/d3md00708a 10.7270/Q2J67N96 38516603 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621195 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621195&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544431 CCN(C)C(=O)Oc1ccc2S\C(=C/C(C)=O)N(Cc3ccccc3)c2c1 InChI=1S/C21H22N2O3S/c1-4-22(3)21(25)26-17-10-11-19-18(13-17)23(20(27-19)12-15(2)24)14-16-8-6-5-7-9-16/h5-13H,4,14H2,1-3H3/b20-12- TWPPWPGNMZYYCN-NDENLUEZSA-N 50621196 CHEMBL5396284 Cholinesterase Equus caballus 68 ChEMBL 10.1039/d3md00708a 10.7270/Q2J67N96 38516603 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621196 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621196&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544432 CCN(C)C(=O)Oc1ccc2S\C(=C/C(C)=O)N(CCc3ccccc3)c2c1 InChI=1S/C22H24N2O3S/c1-4-23(3)22(26)27-18-10-11-20-19(15-18)24(21(28-20)14-16(2)25)13-12-17-8-6-5-7-9-17/h5-11,14-15H,4,12-13H2,1-3H3/b21-14- MKCVKIHXSAJEKL-STZFKDTASA-N 50621197 CHEMBL5408824 Cholinesterase Equus caballus 439 ChEMBL 10.1039/d3md00708a 10.7270/Q2J67N96 38516603 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621197 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621197&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544433 CCCCCCCNC(=O)Oc1ccc2S\C(=C/C(C)=O)N(CC)c2c1 InChI=1S/C20H28N2O3S/c1-4-6-7-8-9-12-21-20(24)25-16-10-11-18-17(14-16)22(5-2)19(26-18)13-15(3)23/h10-11,13-14H,4-9,12H2,1-3H3,(H,21,24)/b19-13- LKENGLOGKVMJPB-UYRXBGFRSA-N 50621198 CHEMBL5398767 Cholinesterase Equus caballus 1640 ChEMBL 10.1039/d3md00708a 10.7270/Q2J67N96 38516603 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621198 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621198&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544434 CCCCCCCNC(=O)Oc1ccc2S\C(=C/C(C)=O)N(Cc3ccccc3)c2c1 InChI=1S/C25H30N2O3S/c1-3-4-5-6-10-15-26-25(29)30-21-13-14-23-22(17-21)27(24(31-23)16-19(2)28)18-20-11-8-7-9-12-20/h7-9,11-14,16-17H,3-6,10,15,18H2,1-2H3,(H,26,29)/b24-16- LOAOHCCERCMJQY-JLPGSUDCSA-N 50621199 CHEMBL5417812 Cholinesterase Equus caballus 154 ChEMBL 10.1039/d3md00708a 10.7270/Q2J67N96 38516603 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621199 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621199&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544435 CCCCCCCNC(=O)Oc1ccc2S\C(=C/C(C)=O)N(CCc3ccccc3)c2c1 InChI=1S/C26H32N2O3S/c1-3-4-5-6-10-16-27-26(30)31-22-13-14-24-23(19-22)28(25(32-24)18-20(2)29)17-15-21-11-8-7-9-12-21/h7-9,11-14,18-19H,3-6,10,15-17H2,1-2H3,(H,27,30)/b25-18- WKDAUMAPOWQTIW-BWAHOGKJSA-N 50621200 CHEMBL5402840 Cholinesterase Equus caballus 27 ChEMBL 10.1039/d3md00708a 10.7270/Q2J67N96 38516603 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621200 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621200&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544436 CCCCCCCNC(=O)Oc1ccc2S\C(=C/C(C)=O)N(Cc3cccc(C)c3)c2c1 InChI=1S/C26H32N2O3S/c1-4-5-6-7-8-14-27-26(30)31-22-12-13-24-23(17-22)28(25(32-24)16-20(3)29)18-21-11-9-10-19(2)15-21/h9-13,15-17H,4-8,14,18H2,1-3H3,(H,27,30)/b25-16- MUKXHEKVJMXIIP-XYGWBWBKSA-N 50621201 CHEMBL5397089 Cholinesterase Equus caballus 761 ChEMBL 10.1039/d3md00708a 10.7270/Q2J67N96 38516603 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621201 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621201&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544437 CCCCCCCNC(=O)Oc1ccc2S\C(=C/C(C)=O)N(Cc3cccc(Cl)c3)c2c1 InChI=1S/C25H29ClN2O3S/c1-3-4-5-6-7-13-27-25(30)31-21-11-12-23-22(16-21)28(24(32-23)14-18(2)29)17-19-9-8-10-20(26)15-19/h8-12,14-16H,3-7,13,17H2,1-2H3,(H,27,30)/b24-14- JWVOABVUSMHWDB-OYKKKHCWSA-N 50621202 CHEMBL5408141 Cholinesterase Equus caballus 703 ChEMBL 10.1039/d3md00708a 10.7270/Q2J67N96 38516603 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621202 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621202&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544438 CCCCCCCNC(=O)Oc1ccc2S\C(=C/C(C)=O)N(Cc3ccc(Cl)cc3)c2c1 InChI=1S/C25H29ClN2O3S/c1-3-4-5-6-7-14-27-25(30)31-21-12-13-23-22(16-21)28(24(32-23)15-18(2)29)17-19-8-10-20(26)11-9-19/h8-13,15-16H,3-7,14,17H2,1-2H3,(H,27,30)/b24-15- SQFMJFDGOCQQLX-IWIPYMOSSA-N 50621203 CHEMBL5398338 Cholinesterase Equus caballus 821 ChEMBL 10.1039/d3md00708a 10.7270/Q2J67N96 38516603 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621203 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621203&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544439 CCCCCCCNC(=O)Oc1ccc2S\C(=C/C(C)=O)N(Cc3ccc4ccccc4c3)c2c1 InChI=1S/C29H32N2O3S/c1-3-4-5-6-9-16-30-29(33)34-25-14-15-27-26(19-25)31(28(35-27)17-21(2)32)20-22-12-13-23-10-7-8-11-24(23)18-22/h7-8,10-15,17-19H,3-6,9,16,20H2,1-2H3,(H,30,33)/b28-17- DGBGQZCUFLNGJB-QRQIAZFYSA-N 50621204 CHEMBL5440931 Cholinesterase Equus caballus >10000 ChEMBL 10.1039/d3md00708a 10.7270/Q2J67N96 38516603 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621204 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621204&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544440 CCCCCCCNC(=O)Oc1ccc2S\C(=C/C(C)=O)N(Cc3cccc(OC)c3)c2c1 InChI=1S/C26H32N2O4S/c1-4-5-6-7-8-14-27-26(30)32-22-12-13-24-23(17-22)28(25(33-24)15-19(2)29)18-20-10-9-11-21(16-20)31-3/h9-13,15-17H,4-8,14,18H2,1-3H3,(H,27,30)/b25-15- BUGGRHRBCOOWND-MYYYXRDXSA-N 50621205 CHEMBL5428725 Cholinesterase Equus caballus 2195 ChEMBL 10.1039/d3md00708a 10.7270/Q2J67N96 38516603 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621205 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621205&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544441 CCCCCCNC(=O)Oc1ccc2S\C(=C/C(C)=O)N(Cc3ccccc3)c2c1 InChI=1S/C24H28N2O3S/c1-3-4-5-9-14-25-24(28)29-20-12-13-22-21(16-20)26(23(30-22)15-18(2)27)17-19-10-7-6-8-11-19/h6-8,10-13,15-16H,3-5,9,14,17H2,1-2H3,(H,25,28)/b23-15- GZGBLJGZDWZONO-HAHDFKILSA-N 50621206 CHEMBL5402721 Cholinesterase Equus caballus 470 ChEMBL 10.1039/d3md00708a 10.7270/Q2J67N96 38516603 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621206 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621206&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544442 CCCCNC(=O)Oc1ccc2S\C(=C/C(C)=O)N(Cc3ccccc3)c2c1 InChI=1S/C22H24N2O3S/c1-3-4-12-23-22(26)27-18-10-11-20-19(14-18)24(21(28-20)13-16(2)25)15-17-8-6-5-7-9-17/h5-11,13-14H,3-4,12,15H2,1-2H3,(H,23,26)/b21-13- XNGGSBQUPQTKHN-BKUYFWCQSA-N 50621207 CHEMBL5412852 Cholinesterase Equus caballus >10000 ChEMBL 10.1039/d3md00708a 10.7270/Q2J67N96 38516603 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621207 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621207&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544443 CCN1\C(Sc2ccc(OC(=O)NC3CCCCC3)cc12)=C\C(C)=O InChI=1S/C19H24N2O3S/c1-3-21-16-12-15(9-10-17(16)25-18(21)11-13(2)22)24-19(23)20-14-7-5-4-6-8-14/h9-12,14H,3-8H2,1-2H3,(H,20,23)/b18-11- YWVFIQIWZRMQIM-WQRHYEAKSA-N 50621208 CHEMBL5414144 Cholinesterase Equus caballus 13000 ChEMBL 10.1039/d3md00708a 10.7270/Q2J67N96 38516603 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621208 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621208&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544444 CCCCCCNC(=O)Oc1ccc2S\C(=C/C(C)=O)N(CC)c2c1 InChI=1S/C19H26N2O3S/c1-4-6-7-8-11-20-19(23)24-15-9-10-17-16(13-15)21(5-2)18(25-17)12-14(3)22/h9-10,12-13H,4-8,11H2,1-3H3,(H,20,23)/b18-12- ONBVYCYXZOZZNN-PDGQHHTCSA-N 50621209 CHEMBL5407180 Cholinesterase Equus caballus 2000 ChEMBL 10.1039/d3md00708a 10.7270/Q2J67N96 38516603 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621209 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621209&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544445 CCN1\C(Sc2ccc(OC(=O)NCc3cccnc3)cc12)=C\C(C)=O InChI=1S/C19H19N3O3S/c1-3-22-16-10-15(6-7-17(16)26-18(22)9-13(2)23)25-19(24)21-12-14-5-4-8-20-11-14/h4-11H,3,12H2,1-2H3,(H,21,24)/b18-9- PPCRHFHUQHNFIU-NVMNQCDNSA-N 50621210 CHEMBL5434888 Cholinesterase Equus caballus 12000 ChEMBL 10.1039/d3md00708a 10.7270/Q2J67N96 38516603 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621210 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621210&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544446 CCN1\C(Sc2ccc(OC(=O)NCCc3ccccc3)cc12)=C\C(C)=O InChI=1S/C21H22N2O3S/c1-3-23-18-14-17(9-10-19(18)27-20(23)13-15(2)24)26-21(25)22-12-11-16-7-5-4-6-8-16/h4-10,13-14H,3,11-12H2,1-2H3,(H,22,25)/b20-13- FVVRODREEMLXIT-MOSHPQCFSA-N 50621211 CHEMBL5407164 Cholinesterase Equus caballus 6000 ChEMBL 10.1039/d3md00708a 10.7270/Q2J67N96 38516603 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50621211 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50621211&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51544447 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase Equus caballus 1.9 ChEMBL 10.1039/d3md00708a 10.7270/Q2J67N96 38516603 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,8T5G,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51550269 CN(C)C(=O)Oc1ccccc1C(=O)\C=C\c1ccc(F)cc1 InChI=1S/C18H16FNO3/c1-20(2)18(22)23-17-6-4-3-5-15(17)16(21)12-9-13-7-10-14(19)11-8-13/h3-12H,1-2H3/b12-9+ DRLPKTSEZCLKPN-FMIVXFBMSA-N 50623705 CHEMBL5425979 Cholinesterase Equus caballus 6300 ChEMBL 10.1016/j.ejmech.2023.115253 10.7270/Q2ST7V75 36921526 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623705 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623705&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51550270 CCN(C)C(=O)Oc1ccccc1C(=O)\C=C\c1ccc(F)cc1 InChI=1S/C19H18FNO3/c1-3-21(2)19(23)24-18-7-5-4-6-16(18)17(22)13-10-14-8-11-15(20)12-9-14/h4-13H,3H2,1-2H3/b13-10+ RGWXKYMXEBSYDQ-JLHYYAGUSA-N 50623706 CHEMBL5435172 Cholinesterase Equus caballus 12400 ChEMBL 10.1016/j.ejmech.2023.115253 10.7270/Q2ST7V75 36921526 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623706 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623706&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51550271 CCN(CC)C(=O)Oc1ccccc1C(=O)\C=C\c1ccc(F)cc1 InChI=1S/C20H20FNO3/c1-3-22(4-2)20(24)25-19-8-6-5-7-17(19)18(23)14-11-15-9-12-16(21)13-10-15/h5-14H,3-4H2,1-2H3/b14-11+ VEXQCJFMMRCIJK-SDNWHVSQSA-N 50623707 CHEMBL5411972 Cholinesterase Equus caballus 18900 ChEMBL 10.1016/j.ejmech.2023.115253 10.7270/Q2ST7V75 36921526 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623707 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623707&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51550272 CCN(C)C(=O)Oc1cccc(c1)[C@H](C)N(C)C InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1 XSVMFMHYUFZWBK-NSHDSACASA-N 11682 2,3-dihydroxybutanedioic acid; 3-[(1S)-1-(dimethylamino)ethyl]phenyl N-ethyl-N-methylcarbamate::Rivastigmine.tartrate::US9586925, Rivastigmine Cholinesterase Equus caballus 960 ChEMBL 10.1016/j.ejmech.2023.115253 10.7270/Q2ST7V75 36921526 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=11682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=11682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 77991 46512204 DB00989 C11766 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51550273 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase Equus caballus 3100 ChEMBL 10.1016/j.ejmech.2023.115253 10.7270/Q2ST7V75 36921526 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552374 CC(C)=CC(O)C\C(C)=C\COc1c2ccoc2cc2oc(=O)ccc12 InChI=1S/C21H22O5/c1-13(2)10-15(22)11-14(3)6-8-25-21-16-4-5-20(23)26-19(16)12-18-17(21)7-9-24-18/h4-7,9-10,12,15,22H,8,11H2,1-3H3/b14-6+ BKIACVAZUKISOR-MKMNVTDBSA-N 50375219 CHEMBL258939 Cholinesterase Equus caballus >100000 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50375219 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50375219&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 5320227 160854309 CHEMBL258939 C17499 ZINC29056306 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552375 O=c1cc(OCCCN2CCOCC2)c2ccc(cc2o1)-c1cccnc1 InChI=1S/C21H22N2O4/c24-21-14-19(26-10-2-7-23-8-11-25-12-9-23)18-5-4-16(13-20(18)27-21)17-3-1-6-22-15-17/h1,3-6,13-15H,2,7-12H2 CHMQSJBOLSPVLM-UHFFFAOYSA-N 50624562 CHEMBL5414445 Cholinesterase Equus caballus >50000 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624562 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624562&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552376 Brc1ccc2c(OCCCN3CCC(CC3)NCc3ccccc3)cc(=O)oc2c1 InChI=1S/C24H27BrN2O3/c25-19-7-8-21-22(16-24(28)30-23(21)15-19)29-14-4-11-27-12-9-20(10-13-27)26-17-18-5-2-1-3-6-18/h1-3,5-8,15-16,20,26H,4,9-14,17H2 VUPOVEFYHCERDZ-UHFFFAOYSA-N 50624561 CHEMBL5395336 Cholinesterase Equus caballus 35720 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624561 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624561&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552377 O=c1cc(OCCCN2CCC(CC2)NCc2ccccc2)c2ccc(cc2o1)-c1cccnc1 InChI=1S/C29H31N3O3/c33-29-19-27(26-10-9-23(18-28(26)35-29)24-8-4-13-30-21-24)34-17-5-14-32-15-11-25(12-16-32)31-20-22-6-2-1-3-7-22/h1-4,6-10,13,18-19,21,25,31H,5,11-12,14-17,20H2 DGAACRJYBFPKCH-UHFFFAOYSA-N 50624563 CHEMBL5401281 Cholinesterase Equus caballus 21420 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624563 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624563&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552378 O=c1cc(OCCCN2CCC(CC2)NCc2ccccc2)c2ccc(cc2o1)-c1ccncc1 InChI=1S/C29H31N3O3/c33-29-20-27(26-8-7-24(19-28(26)35-29)23-9-13-30-14-10-23)34-18-4-15-32-16-11-25(12-17-32)31-21-22-5-2-1-3-6-22/h1-3,5-10,13-14,19-20,25,31H,4,11-12,15-18,21H2 WLCLLNWPEADTOA-UHFFFAOYSA-N 50624565 CHEMBL5440364 Cholinesterase Equus caballus >50000 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624565 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624565&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552379 Fc1ccccc1CNC1CCN(CCCOc2cc(=O)oc3cc(ccc23)-c2cccnc2)CC1 InChI=1S/C29H30FN3O3/c30-26-7-2-1-5-23(26)20-32-24-10-14-33(15-11-24)13-4-16-35-27-18-29(34)36-28-17-21(8-9-25(27)28)22-6-3-12-31-19-22/h1-3,5-9,12,17-19,24,32H,4,10-11,13-16,20H2 JGVJHFSVFGFSCK-UHFFFAOYSA-N 50624564 CHEMBL5429686 Cholinesterase Equus caballus >50000 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624564 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624564&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552380 Fc1cccc(CNC2CCN(CCCOc3cc(=O)oc4cc(ccc34)-c3cccnc3)CC2)c1 InChI=1S/C29H30FN3O3/c30-24-6-1-4-21(16-24)19-32-25-9-13-33(14-10-25)12-3-15-35-27-18-29(34)36-28-17-22(7-8-26(27)28)23-5-2-11-31-20-23/h1-2,4-8,11,16-18,20,25,32H,3,9-10,12-15,19H2 CSGZPLRXHQAFOC-UHFFFAOYSA-N 50624566 CHEMBL5406371 Cholinesterase Equus caballus 28397 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624566 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624566&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552381 Fc1ccc(CNC2CCN(CCCOc3cc(=O)oc4cc(ccc34)-c3cccnc3)CC2)cc1 InChI=1S/C29H30FN3O3/c30-24-7-4-21(5-8-24)19-32-25-10-14-33(15-11-25)13-2-16-35-27-18-29(34)36-28-17-22(6-9-26(27)28)23-3-1-12-31-20-23/h1,3-9,12,17-18,20,25,32H,2,10-11,13-16,19H2 XINTUFHPKPPXIW-UHFFFAOYSA-N 50624567 CHEMBL5413436 Cholinesterase Equus caballus >50000 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624567 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624567&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552382 Cc1cccc(CNC2CCN(CCCOc3cc(=O)oc4cc(ccc34)-c3cccnc3)CC2)c1 InChI=1S/C30H33N3O3/c1-22-5-2-6-23(17-22)20-32-26-10-14-33(15-11-26)13-4-16-35-28-19-30(34)36-29-18-24(8-9-27(28)29)25-7-3-12-31-21-25/h2-3,5-9,12,17-19,21,26,32H,4,10-11,13-16,20H2,1H3 NYYQHFFUHYQDAT-UHFFFAOYSA-N 50624568 CHEMBL5434920 Cholinesterase Equus caballus 18607 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624568 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624568&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552383 Cc1ccc(CNC2CCN(CCCOc3cc(=O)oc4cc(ccc34)-c3cccnc3)CC2)cc1 InChI=1S/C30H33N3O3/c1-22-5-7-23(8-6-22)20-32-26-11-15-33(16-12-26)14-3-17-35-28-19-30(34)36-29-18-24(9-10-27(28)29)25-4-2-13-31-21-25/h2,4-10,13,18-19,21,26,32H,3,11-12,14-17,20H2,1H3 IVXVCHCRQXBOLI-UHFFFAOYSA-N 50624569 CHEMBL5407586 Cholinesterase Equus caballus 16320 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624569 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624569&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552384 COc1cccc(CNC2CCN(CCCOc3cc(=O)oc4cc(ccc34)-c3cccnc3)CC2)c1 InChI=1S/C30H33N3O4/c1-35-26-7-2-5-22(17-26)20-32-25-10-14-33(15-11-25)13-4-16-36-28-19-30(34)37-29-18-23(8-9-27(28)29)24-6-3-12-31-21-24/h2-3,5-9,12,17-19,21,25,32H,4,10-11,13-16,20H2,1H3 POHWFMCQJKOYNV-UHFFFAOYSA-N 50624570 CHEMBL5405322 Cholinesterase Equus caballus 11280 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624570 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624570&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552385 COc1ccc(CNC2CCN(CCCOc3cc(=O)oc4cc(ccc34)-c3cccnc3)CC2)cc1 InChI=1S/C30H33N3O4/c1-35-26-8-5-22(6-9-26)20-32-25-11-15-33(16-12-25)14-3-17-36-28-19-30(34)37-29-18-23(7-10-27(28)29)24-4-2-13-31-21-24/h2,4-10,13,18-19,21,25,32H,3,11-12,14-17,20H2,1H3 JUUSFJDTWBMGRX-UHFFFAOYSA-N 50624571 CHEMBL5421502 Cholinesterase Equus caballus 11350 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624571 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624571&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552386 O=c1cc(OCCCN2CCC(CC2)NCc2cccc(c2)C#N)c2ccc(cc2o1)-c1cccnc1 InChI=1S/C30H30N4O3/c31-19-22-4-1-5-23(16-22)20-33-26-9-13-34(14-10-26)12-3-15-36-28-18-30(35)37-29-17-24(7-8-27(28)29)25-6-2-11-32-21-25/h1-2,4-8,11,16-18,21,26,33H,3,9-10,12-15,20H2 HHWHTQLLCMSDMD-UHFFFAOYSA-N 50624572 CHEMBL5433782 Cholinesterase Equus caballus >50000 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624572 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624572&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552387 [O-][N+](=O)c1cccc(CNC2CCN(CCCOc3cc(=O)oc4cc(ccc34)-c3cccnc3)CC2)c1 InChI=1S/C29H30N4O5/c34-29-18-27(26-8-7-22(17-28(26)38-29)23-5-2-11-30-20-23)37-15-3-12-32-13-9-24(10-14-32)31-19-21-4-1-6-25(16-21)33(35)36/h1-2,4-8,11,16-18,20,24,31H,3,9-10,12-15,19H2 JZTNSLDUIWUGNU-UHFFFAOYSA-N 50624573 CHEMBL5401344 Cholinesterase Equus caballus >50000 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624573 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624573&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552388 O=c1cc(OCCCN2CCC(CC2)NCc2ccsc2)c2ccc(cc2o1)-c1cccnc1 InChI=1S/C27H29N3O3S/c31-27-16-25(24-5-4-21(15-26(24)33-27)22-3-1-9-28-18-22)32-13-2-10-30-11-6-23(7-12-30)29-17-20-8-14-34-19-20/h1,3-5,8-9,14-16,18-19,23,29H,2,6-7,10-13,17H2 HTSNJIBRBCIQKM-UHFFFAOYSA-N 50624574 CHEMBL5397599 Cholinesterase Equus caballus 9983 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624574 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624574&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552389 Fc1ccc(CNC2CCN(CCCOc3cc(=O)oc4cc(ccc34)-c3cccnc3)CC2)cc1F InChI=1S/C29H29F2N3O3/c30-25-7-4-20(15-26(25)31)18-33-23-8-12-34(13-9-23)11-2-14-36-27-17-29(35)37-28-16-21(5-6-24(27)28)22-3-1-10-32-19-22/h1,3-7,10,15-17,19,23,33H,2,8-9,11-14,18H2 AAFCQPLQQXESIV-UHFFFAOYSA-N 50624575 CHEMBL5430322 Cholinesterase Equus caballus 22777 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624575 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624575&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552390 O=C(Nc1cc(ccn1)-c1ccc2c(OCCCN3CCC(CC3)NCc3ccccc3)cc(=O)oc2c1)C1CC1 InChI=1S/C33H36N4O4/c38-32-21-29(40-18-4-15-37-16-12-27(13-17-37)35-22-23-5-2-1-3-6-23)28-10-9-25(19-30(28)41-32)26-11-14-34-31(20-26)36-33(39)24-7-8-24/h1-3,5-6,9-11,14,19-21,24,27,35H,4,7-8,12-13,15-18,22H2,(H,34,36,39) YPWOGJMLJWSOQY-UHFFFAOYSA-N 50624576 CHEMBL5413089 Cholinesterase Equus caballus 28965 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624576 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624576&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552391 Fc1ccc(cn1)-c1ccc2c(OCCCN3CCC(CC3)NCc3ccccc3)cc(=O)oc2c1 InChI=1S/C29H30FN3O3/c30-28-10-8-23(20-32-28)22-7-9-25-26(18-29(34)36-27(25)17-22)35-16-4-13-33-14-11-24(12-15-33)31-19-21-5-2-1-3-6-21/h1-3,5-10,17-18,20,24,31H,4,11-16,19H2 REIIGCYBGMMKED-UHFFFAOYSA-N 50624577 CHEMBL5425139 Cholinesterase Equus caballus 44235 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624577 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624577&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552392 Fc1ccccc1CNCC1CCN(CCCOc2cc(=O)oc3cc(ccc23)-c2cccnc2)CC1 InChI=1S/C30H32FN3O3/c31-27-7-2-1-5-25(27)21-33-19-22-10-14-34(15-11-22)13-4-16-36-28-18-30(35)37-29-17-23(8-9-26(28)29)24-6-3-12-32-20-24/h1-3,5-9,12,17-18,20,22,33H,4,10-11,13-16,19,21H2 DJAQQMPPYQVKDC-UHFFFAOYSA-N 50624578 CHEMBL5397716 Cholinesterase Equus caballus 31085 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624578 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624578&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552393 CN(Cc1ccccc1)C1CCN(CCCOc2cc(=O)oc3cc(ccc23)-c2ccc(F)nc2)CC1 InChI=1S/C30H32FN3O3/c1-33(21-22-6-3-2-4-7-22)25-12-15-34(16-13-25)14-5-17-36-27-19-30(35)37-28-18-23(8-10-26(27)28)24-9-11-29(31)32-20-24/h2-4,6-11,18-20,25H,5,12-17,21H2,1H3 PBUJREUYSLXZKN-UHFFFAOYSA-N 50624579 CHEMBL5432645 Cholinesterase Equus caballus >50000 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624579 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624579&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543172 Cc1ccc(NCCCSC[C@@H]2CCCN3CCCC[C@H]23)c2c1sc1ccccc1c2=O InChI=1S/C27H34N2OS2/c1-19-12-13-22(25-26(30)21-9-2-3-11-24(21)32-27(19)25)28-14-7-17-31-18-20-8-6-16-29-15-5-4-10-23(20)29/h2-3,9,11-13,20,23,28H,4-8,10,14-18H2,1H3/t20-,23+/m0/s1 RTSVPQGEMHVGDV-NZQKXSOJSA-N 50620646 CHEMBL5422760 Cholinesterase Equus caballus 88 ChEMBL 10.1016/j.ejmech.2023.115169 10.7270/Q2TT4W9N 36753881 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620646 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620646&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543173 Cc1ccc(NCC[C@@H]2CCCN3CCCC[C@H]23)c2c1sc1ccc(O)cc1c2=O InChI=1S/C25H30N2O2S/c1-16-7-9-20(23-24(29)19-15-18(28)8-10-22(19)30-25(16)23)26-12-11-17-5-4-14-27-13-3-2-6-21(17)27/h7-10,15,17,21,26,28H,2-6,11-14H2,1H3/t17-,21+/m0/s1 DTVPCBIZJATWPE-LAUBAEHRSA-N 50620648 CHEMBL5431870 Cholinesterase Equus caballus 160 ChEMBL 10.1016/j.ejmech.2023.115169 10.7270/Q2TT4W9N 36753881 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620648 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620648&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543174 COc1ccc2sc3c(C)ccc(NCC[C@@H]4CCCN5CCCC[C@H]45)c3c(=O)c2c1 InChI=1S/C26H32N2O2S/c1-17-8-10-21(27-13-12-18-6-5-15-28-14-4-3-7-22(18)28)24-25(29)20-16-19(30-2)9-11-23(20)31-26(17)24/h8-11,16,18,22,27H,3-7,12-15H2,1-2H3/t18-,22+/m0/s1 QDOARVWOVAHJIU-PGRDOPGGSA-N 50620651 CHEMBL5419364 Cholinesterase Equus caballus 140 ChEMBL 10.1016/j.ejmech.2023.115169 10.7270/Q2TT4W9N 36753881 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620651 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620651&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543175 COc1ccc2sc3c(ccc(NCC[C@@H]4CCCN5CCCC[C@H]45)c3c(=O)c2c1)[N+]([O-])=O InChI=1S/C25H29N3O4S/c1-32-17-7-10-22-18(15-17)24(29)23-19(8-9-21(28(30)31)25(23)33-22)26-12-11-16-5-4-14-27-13-3-2-6-20(16)27/h7-10,15-16,20,26H,2-6,11-14H2,1H3/t16-,20+/m0/s1 ZPTZOXPYMMOGAB-OXJNMPFZSA-N 50620654 CHEMBL5415210 Cholinesterase Equus caballus 150 ChEMBL 10.1016/j.ejmech.2023.115169 10.7270/Q2TT4W9N 36753881 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620654 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620654&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543176 COc1ccc2sc3c(ccc(NCCC[C@@H]4CCCN5CCCC[C@H]45)c3c(=O)c2c1)[N+]([O-])=O InChI=1S/C26H31N3O4S/c1-33-18-9-12-23-19(16-18)25(30)24-20(10-11-22(29(31)32)26(24)34-23)27-13-4-6-17-7-5-15-28-14-3-2-8-21(17)28/h9-12,16-17,21,27H,2-8,13-15H2,1H3/t17-,21-/m1/s1 SDIALEIKIKXUSO-DYESRHJHSA-N 50620655 CHEMBL5405496 Cholinesterase Equus caballus 2000 ChEMBL 10.1016/j.ejmech.2023.115169 10.7270/Q2TT4W9N 36753881 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620655 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620655&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543177 COc1ccc2sc3c(N)ccc(NCC[C@@H]4CCCN5CCCC[C@H]45)c3c(=O)c2c1 InChI=1S/C25H31N3O2S/c1-30-17-7-10-22-18(15-17)24(29)23-20(9-8-19(26)25(23)31-22)27-12-11-16-5-4-14-28-13-3-2-6-21(16)28/h7-10,15-16,21,27H,2-6,11-14,26H2,1H3/t16-,21+/m0/s1 CFBPNQLXDNLVNE-HRAATJIYSA-N 50620666 CHEMBL5436261 Cholinesterase Equus caballus 150 ChEMBL 10.1016/j.ejmech.2023.115169 10.7270/Q2TT4W9N 36753881 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620666 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620666&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543178 COc1ccc2sc3c(C)ccc(NCCC4CCN(C)CC4)c3c(=O)c2c1 InChI=1S/C23H28N2O2S/c1-15-4-6-19(24-11-8-16-9-12-25(2)13-10-16)21-22(26)18-14-17(27-3)5-7-20(18)28-23(15)21/h4-7,14,16,24H,8-13H2,1-3H3 RGJSERYMQYYVAH-UHFFFAOYSA-N 50620657 CHEMBL5440445 Cholinesterase Equus caballus 960 ChEMBL 10.1016/j.ejmech.2023.115169 10.7270/Q2TT4W9N 36753881 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620657 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620657&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543179 Cc1ccc(NCCC[C@@H]2CCCN3CCCC[C@H]23)c2c1oc1ccccc1c2=O InChI=1S/C26H32N2O2/c1-18-13-14-21(24-25(29)20-10-2-3-12-23(20)30-26(18)24)27-15-6-8-19-9-7-17-28-16-5-4-11-22(19)28/h2-3,10,12-14,19,22,27H,4-9,11,15-17H2,1H3/t19-,22-/m1/s1 PLFDOJBDYAWUKJ-DENIHFKCSA-N 50620660 CHEMBL5438801 Cholinesterase Equus caballus 370 ChEMBL 10.1016/j.ejmech.2023.115169 10.7270/Q2TT4W9N 36753881 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50620660 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50620660&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51543180 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase Equus caballus 1900 ChEMBL 10.1016/j.ejmech.2023.115169 10.7270/Q2TT4W9N 36753881 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552394 CN(Cc1ccccc1)C1CCN(CCCOc2cc(=O)oc3cc(ccc23)-c2ccc(F)cc2)CC1 InChI=1S/C31H33FN2O3/c1-33(22-23-6-3-2-4-7-23)27-14-17-34(18-15-27)16-5-19-36-29-21-31(35)37-30-20-25(10-13-28(29)30)24-8-11-26(32)12-9-24/h2-4,6-13,20-21,27H,5,14-19,22H2,1H3 XQKUGYXGCHDLCT-UHFFFAOYSA-N 50624580 CHEMBL5408041 Cholinesterase Equus caballus >50000 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624580 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624580&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552395 O=c1cc(OCCCNC2CCN(Cc3ccccc3)CC2)c2ccc(cc2o1)-c1cccnc1 InChI=1S/C29H31N3O3/c33-29-19-27(26-10-9-23(18-28(26)35-29)24-8-4-13-30-20-24)34-17-5-14-31-25-11-15-32(16-12-25)21-22-6-2-1-3-7-22/h1-4,6-10,13,18-20,25,31H,5,11-12,14-17,21H2 XDBAVOMSRFQENP-UHFFFAOYSA-N 50624581 CHEMBL5396142 Cholinesterase Equus caballus 32330 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624581 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624581&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552396 O=c1cc(OCCCNC2CCN(Cc3ccccc3)CC2)c2ccc(cc2o1)-c1ccncc1 InChI=1S/C29H31N3O3/c33-29-20-27(26-8-7-24(19-28(26)35-29)23-9-14-30-15-10-23)34-18-4-13-31-25-11-16-32(17-12-25)21-22-5-2-1-3-6-22/h1-3,5-10,14-15,19-20,25,31H,4,11-13,16-18,21H2 WNFTUZGKFIWNNI-UHFFFAOYSA-N 50624582 CHEMBL5439636 Cholinesterase Equus caballus >50000 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624582 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624582&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552397 Fc1cc(ccn1)-c1ccc2c(OCCCNC3CCN(Cc4ccccc4)CC3)cc(=O)oc2c1 InChI=1S/C29H30FN3O3/c30-28-18-23(9-13-32-28)22-7-8-25-26(19-29(34)36-27(25)17-22)35-16-4-12-31-24-10-14-33(15-11-24)20-21-5-2-1-3-6-21/h1-3,5-9,13,17-19,24,31H,4,10-12,14-16,20H2 QOIWOTNCYQAZFP-UHFFFAOYSA-N 50624583 CHEMBL5416204 Cholinesterase Equus caballus >50000 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624583 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624583&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552398 Fc1ccc(cn1)-c1ccc2c(OCCCNC3CCN(Cc4ccccc4)CC3)cc(=O)oc2c1 InChI=1S/C29H30FN3O3/c30-28-10-8-23(19-32-28)22-7-9-25-26(18-29(34)36-27(25)17-22)35-16-4-13-31-24-11-14-33(15-12-24)20-21-5-2-1-3-6-21/h1-3,5-10,17-19,24,31H,4,11-16,20H2 ZLIMJSWOHFSNQL-UHFFFAOYSA-N 50624584 CHEMBL5419495 Cholinesterase Equus caballus >50000 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624584 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624584&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552399 Fc1ccc(cc1)-c1ccc2c(OCCCNC3CCN(Cc4ccccc4)CC3)cc(=O)oc2c1 InChI=1S/C30H31FN2O3/c31-25-10-7-23(8-11-25)24-9-12-27-28(20-30(34)36-29(27)19-24)35-18-4-15-32-26-13-16-33(17-14-26)21-22-5-2-1-3-6-22/h1-3,5-12,19-20,26,32H,4,13-18,21H2 NWEFIMKHVTZOJK-UHFFFAOYSA-N 50624585 CHEMBL5404997 Cholinesterase Equus caballus >50000 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624585 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624585&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552400 O=C(Nc1cc(ccn1)-c1ccc2c(OCCCNC3CCN(Cc4ccccc4)CC3)cc(=O)oc2c1)C1CC1 InChI=1S/C33H36N4O4/c38-32-21-29(40-18-4-14-34-27-12-16-37(17-13-27)22-23-5-2-1-3-6-23)28-10-9-25(19-30(28)41-32)26-11-15-35-31(20-26)36-33(39)24-7-8-24/h1-3,5-6,9-11,15,19-21,24,27,34H,4,7-8,12-14,16-18,22H2,(H,35,36,39) RTUCEZAZQQKDAC-UHFFFAOYSA-N 50624586 CHEMBL5438388 Cholinesterase Equus caballus >50000 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624586 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624586&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552401 O=C(Nc1cc(ccn1)-c1ccc2c(OCCCNC3CCN(Cc4ccccc4)CC3)cc(=O)oc2c1)c1ccccc1 InChI=1S/C36H36N4O4/c41-35-24-32(43-21-7-17-37-30-15-19-40(20-16-30)25-26-8-3-1-4-9-26)31-13-12-28(22-33(31)44-35)29-14-18-38-34(23-29)39-36(42)27-10-5-2-6-11-27/h1-6,8-14,18,22-24,30,37H,7,15-17,19-21,25H2,(H,38,39,42) BJRRGOKDCSOBTM-UHFFFAOYSA-N 50624587 CHEMBL5409761 Cholinesterase Equus caballus >50000 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50624587 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50624587&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51552402 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase Equus caballus 3550 ChEMBL 10.1016/j.ejmech.2022.114689 10.7270/Q22Z19X3 36007469 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51573739 Nc1c2CCCCc2nc2ccccc12 InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) YLJREFDVOIBQDA-UHFFFAOYSA-N 8961 1,2,3,4-tetrahydro-9-acridinamine::1,2,3,4-tetrahydroacridin-9-amine::9-THA::9-amino-1,2,3,4-tetrahydroacridine (THA)::CHEMBL1337960::CHEMBL95::Cognex::Tacrine::Tracine::US8999994, Tacrine::cid_1935::tacrine.HCl Cholinesterase Equus caballus 15 ChEMBL 10.1016/j.bmc.2023.117333 10.7270/Q2QR52K2 37236021 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search THA 2AOX,2AOW,8T5G,4BDS,1MX1,1ACJ,7XN1 1935 46509736 45980 CHEMBL1337960CHEMBL95 DB00382 6687 C01453 ZINC00016827 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51573740 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase Equus caballus 1830 ChEMBL 10.1016/j.bmc.2023.117333 10.7270/Q2QR52K2 37236021 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51573741 O[C@@H](CNCC1CCCCCC1)CNC(=O)C1c2ccccc2-c2ccccc12 InChI=1S/C25H32N2O2/c28-19(16-26-15-18-9-3-1-2-4-10-18)17-27-25(29)24-22-13-7-5-11-20(22)21-12-6-8-14-23(21)24/h5-8,11-14,18-19,24,26,28H,1-4,9-10,15-17H2,(H,27,29)/t19-/m0/s1 AUIJQYGDXHLXRX-IBGZPJMESA-N 50633021 CHEMBL5439464 Cholinesterase Equus caballus 31 ChEMBL 10.1016/j.bmc.2023.117333 10.7270/Q2QR52K2 37236021 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50633021 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50633021&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51573742 O[C@H](CNCC1CCCCCC1)CNC(=O)C1c2ccccc2-c2ccccc12 InChI=1S/C25H32N2O2/c28-19(16-26-15-18-9-3-1-2-4-10-18)17-27-25(29)24-22-13-7-5-11-20(22)21-12-6-8-14-23(21)24/h5-8,11-14,18-19,24,26,28H,1-4,9-10,15-17H2,(H,27,29)/t19-/m1/s1 AUIJQYGDXHLXRX-LJQANCHMSA-N 50633022 CHEMBL5440970 Cholinesterase Equus caballus 288 ChEMBL 10.1016/j.bmc.2023.117333 10.7270/Q2QR52K2 37236021 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50633022 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50633022&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51573743 OC(CNCC1CCCCCC1)CNC(=O)CC1c2ccccc2-c2ccccc12 InChI=1S/C26H34N2O2/c29-20(17-27-16-19-9-3-1-2-4-10-19)18-28-26(30)15-25-23-13-7-5-11-21(23)22-12-6-8-14-24(22)25/h5-8,11-14,19-20,25,27,29H,1-4,9-10,15-18H2,(H,28,30) MFQMGLKSUJYABY-UHFFFAOYSA-N 50633023 CHEMBL5405643 Cholinesterase Equus caballus 1090 ChEMBL 10.1016/j.bmc.2023.117333 10.7270/Q2QR52K2 37236021 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50633023 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50633023&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51573744 OC(CNCC1CCCCCC1)CNC(=O)C1c2ccccc2-c2ccccc12 InChI=1S/C25H32N2O2/c28-19(16-26-15-18-9-3-1-2-4-10-18)17-27-25(29)24-22-13-7-5-11-20(22)21-12-6-8-14-23(21)24/h5-8,11-14,18-19,24,26,28H,1-4,9-10,15-17H2,(H,27,29) AUIJQYGDXHLXRX-UHFFFAOYSA-N 50633024 CHEMBL5404105 Cholinesterase Equus caballus 38 ChEMBL 10.1016/j.bmc.2023.117333 10.7270/Q2QR52K2 37236021 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50633024 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50633024&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51573745 OC(CNCCC1CCCCC1)CNC(=O)CC1c2ccccc2-c2ccccc12 InChI=1S/C26H34N2O2/c29-20(17-27-15-14-19-8-2-1-3-9-19)18-28-26(30)16-25-23-12-6-4-10-21(23)22-11-5-7-13-24(22)25/h4-7,10-13,19-20,25,27,29H,1-3,8-9,14-18H2,(H,28,30) DPQHOKGAAYIRGX-UHFFFAOYSA-N 50633025 CHEMBL5402259 Cholinesterase Equus caballus 422 ChEMBL 10.1016/j.bmc.2023.117333 10.7270/Q2QR52K2 37236021 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50633025 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50633025&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51573746 OC(CNCCC1CCCCC1)CNC(=O)C1c2ccccc2-c2ccccc12 InChI=1S/C25H32N2O2/c28-19(16-26-15-14-18-8-2-1-3-9-18)17-27-25(29)24-22-12-6-4-10-20(22)21-11-5-7-13-23(21)24/h4-7,10-13,18-19,24,26,28H,1-3,8-9,14-17H2,(H,27,29) CVGMIWGWMUMSPB-UHFFFAOYSA-N 50633026 CHEMBL5400997 Cholinesterase Equus caballus 475 ChEMBL 10.1016/j.bmc.2023.117333 10.7270/Q2QR52K2 37236021 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50633026 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50633026&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51573747 OC(CNC1CCCCC1)CNC(=O)CC1c2ccccc2-c2ccccc12 InChI=1S/C24H30N2O2/c27-18(15-25-17-8-2-1-3-9-17)16-26-24(28)14-23-21-12-6-4-10-19(21)20-11-5-7-13-22(20)23/h4-7,10-13,17-18,23,25,27H,1-3,8-9,14-16H2,(H,26,28) ATUGFFSYSMJLEW-UHFFFAOYSA-N 50633027 CHEMBL5414205 Cholinesterase Equus caballus 1490 ChEMBL 10.1016/j.bmc.2023.117333 10.7270/Q2QR52K2 37236021 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50633027 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50633027&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51573748 OC(CNC1CCCCC1)CNC(=O)C1c2ccccc2-c2ccccc12 InChI=1S/C23H28N2O2/c26-17(14-24-16-8-2-1-3-9-16)15-25-23(27)22-20-12-6-4-10-18(20)19-11-5-7-13-21(19)22/h4-7,10-13,16-17,22,24,26H,1-3,8-9,14-15H2,(H,25,27) QFEOJMYEZXUOEF-UHFFFAOYSA-N 50633028 CHEMBL5429571 Cholinesterase Equus caballus 336 ChEMBL 10.1016/j.bmc.2023.117333 10.7270/Q2QR52K2 37236021 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50633028 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50633028&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51573749 OC(CNCC1CCCCC1)CNC(=O)CC1c2ccccc2-c2ccccc12 InChI=1S/C25H32N2O2/c28-19(16-26-15-18-8-2-1-3-9-18)17-27-25(29)14-24-22-12-6-4-10-20(22)21-11-5-7-13-23(21)24/h4-7,10-13,18-19,24,26,28H,1-3,8-9,14-17H2,(H,27,29) RJLYBCQWDISHDF-UHFFFAOYSA-N 50633029 CHEMBL5408229 Cholinesterase Equus caballus 1690 ChEMBL 10.1016/j.bmc.2023.117333 10.7270/Q2QR52K2 37236021 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50633029 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50633029&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51573750 OC(CNCC1CCCCC1)CNC(=O)C1c2ccccc2-c2ccccc12 InChI=1S/C24H30N2O2/c27-18(15-25-14-17-8-2-1-3-9-17)16-26-24(28)23-21-12-6-4-10-19(21)20-11-5-7-13-22(20)23/h4-7,10-13,17-18,23,25,27H,1-3,8-9,14-16H2,(H,26,28) ZLOKXELXZVGWCC-UHFFFAOYSA-N 50633030 CHEMBL5400604 Cholinesterase Equus caballus 231 ChEMBL 10.1016/j.bmc.2023.117333 10.7270/Q2QR52K2 37236021 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50633030 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50633030&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51573751 OC(CNCC1CCCC1)CNC(=O)CC1c2ccccc2-c2ccccc12 InChI=1S/C24H30N2O2/c27-18(15-25-14-17-7-1-2-8-17)16-26-24(28)13-23-21-11-5-3-9-19(21)20-10-4-6-12-22(20)23/h3-6,9-12,17-18,23,25,27H,1-2,7-8,13-16H2,(H,26,28) HPIFPHSLDUMHCD-UHFFFAOYSA-N 50633031 CHEMBL5419319 Cholinesterase Equus caballus 1710 ChEMBL 10.1016/j.bmc.2023.117333 10.7270/Q2QR52K2 37236021 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50633031 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50633031&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51573752 OC(CNCC1CCCC1)CNC(=O)C1c2ccccc2-c2ccccc12 InChI=1S/C23H28N2O2/c26-17(14-24-13-16-7-1-2-8-16)15-25-23(27)22-20-11-5-3-9-18(20)19-10-4-6-12-21(19)22/h3-6,9-12,16-17,22,24,26H,1-2,7-8,13-15H2,(H,25,27) FTCRVUSVEFVGSO-UHFFFAOYSA-N 50633032 CHEMBL5440250 Cholinesterase Equus caballus 379 ChEMBL 10.1016/j.bmc.2023.117333 10.7270/Q2QR52K2 37236021 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50633032 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50633032&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51573753 OC(CNCC1CC1)CNC(=O)C1c2ccccc2-c2ccccc12 InChI=1S/C21H24N2O2/c24-15(12-22-11-14-9-10-14)13-23-21(25)20-18-7-3-1-5-16(18)17-6-2-4-8-19(17)20/h1-8,14-15,20,22,24H,9-13H2,(H,23,25) BFBPAWVXUOAZNU-UHFFFAOYSA-N 50633033 CHEMBL5422079 Cholinesterase Equus caballus 435 ChEMBL 10.1016/j.bmc.2023.117333 10.7270/Q2QR52K2 37236021 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50633033 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50633033&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51573754 OC(CNCC(F)(F)F)CNC(=O)C1c2ccccc2-c2ccccc12 InChI=1S/C19H19F3N2O2/c20-19(21,22)11-23-9-12(25)10-24-18(26)17-15-7-3-1-5-13(15)14-6-2-4-8-16(14)17/h1-8,12,17,23,25H,9-11H2,(H,24,26) IPCKJZUAWWIZCR-UHFFFAOYSA-N 50633034 CHEMBL5440439 Cholinesterase Equus caballus 12930 ChEMBL 10.1016/j.bmc.2023.117333 10.7270/Q2QR52K2 37236021 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50633034 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50633034&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51573755 CC(C)(C)CNCC(O)CNC(=O)CC1c2ccccc2-c2ccccc12 InChI=1S/C23H30N2O2/c1-23(2,3)15-24-13-16(26)14-25-22(27)12-21-19-10-6-4-8-17(19)18-9-5-7-11-20(18)21/h4-11,16,21,24,26H,12-15H2,1-3H3,(H,25,27) MLZYKJIUMVXNHM-UHFFFAOYSA-N 50633035 CHEMBL5397614 Cholinesterase Equus caballus 672 ChEMBL 10.1016/j.bmc.2023.117333 10.7270/Q2QR52K2 37236021 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50633035 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50633035&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51573756 CC(C)(C)CNCC(O)CNC(=O)C1c2ccccc2-c2ccccc12 InChI=1S/C22H28N2O2/c1-22(2,3)14-23-12-15(25)13-24-21(26)20-18-10-6-4-8-16(18)17-9-5-7-11-19(17)20/h4-11,15,20,23,25H,12-14H2,1-3H3,(H,24,26) JQLLFMPECLTWAW-UHFFFAOYSA-N 50633036 CHEMBL5415530 Cholinesterase Equus caballus 385 ChEMBL 10.1016/j.bmc.2023.117333 10.7270/Q2QR52K2 37236021 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50633036 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50633036&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51573757 OC(CNCc1ccccc1)CNC(=O)CC1c2ccccc2-c2ccccc12 InChI=1S/C25H26N2O2/c28-19(16-26-15-18-8-2-1-3-9-18)17-27-25(29)14-24-22-12-6-4-10-20(22)21-11-5-7-13-23(21)24/h1-13,19,24,26,28H,14-17H2,(H,27,29) AJXJOFZHUHHUOW-UHFFFAOYSA-N 50633037 CHEMBL5419636 Cholinesterase Equus caballus 4330 ChEMBL 10.1016/j.bmc.2023.117333 10.7270/Q2QR52K2 37236021 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50633037 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50633037&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51573758 OC(CNCc1ccccc1)CNC(=O)C1c2ccccc2-c2ccccc12 InChI=1S/C24H24N2O2/c27-18(15-25-14-17-8-2-1-3-9-17)16-26-24(28)23-21-12-6-4-10-19(21)20-11-5-7-13-22(20)23/h1-13,18,23,25,27H,14-16H2,(H,26,28) DNGHIUYPTJZGFB-UHFFFAOYSA-N 50633038 CHEMBL5413039 Cholinesterase Equus caballus 627 ChEMBL 10.1016/j.bmc.2023.117333 10.7270/Q2QR52K2 37236021 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50633038 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50633038&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51573759 OC(CNCC1CCCCC1)CNC(=O)CC(c1ccccc1)c1ccccc1 InChI=1S/C25H34N2O2/c28-23(18-26-17-20-10-4-1-5-11-20)19-27-25(29)16-24(21-12-6-2-7-13-21)22-14-8-3-9-15-22/h2-3,6-9,12-15,20,23-24,26,28H,1,4-5,10-11,16-19H2,(H,27,29) AGQFRFDHZZBREO-UHFFFAOYSA-N 50623313 CHEMBL5401934 Cholinesterase Equus caballus 78 ChEMBL 10.1016/j.bmc.2023.117333 10.7270/Q2QR52K2 37236021 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50623313 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50623313&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 8UW 7Q1P 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51573760 CC(C)(C)c1cccc(CNCC(O)CNCCC(c2ccccc2)c2ccccc2)c1 InChI=1S/C29H38N2O/c1-29(2,3)26-16-10-11-23(19-26)20-31-22-27(32)21-30-18-17-28(24-12-6-4-7-13-24)25-14-8-5-9-15-25/h4-16,19,27-28,30-32H,17-18,20-22H2,1-3H3 QEVPSMYJQDNACG-UHFFFAOYSA-N 50570584 CHEMBL4860825 Cholinesterase Equus caballus 2920 ChEMBL 10.1016/j.bmc.2023.117333 10.7270/Q2QR52K2 37236021 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50570584 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50570584&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 154701599 471060729 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51565914 COc1cccc-2c1C[C@H]1N(C)CCc3cc4OCOc4c-2c13 InChI=1S/C19H19NO3/c1-20-7-6-11-8-16-19(23-10-22-16)18-12-4-3-5-15(21-2)13(12)9-14(20)17(11)18/h3-5,8,14H,6-7,9-10H2,1-2H3/t14-/m1/s1 UEAPAHNNFSZHMW-CQSZACIVSA-N 50306887 CHEMBL601020::Stephanine Cholinesterase Equus caballus 2800 ChEMBL 10.1016/j.ejmech.2023.115414 10.7270/Q26W9GJT 37172474 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50306887 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50306887&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 160501 104161248 CHEMBL601020 ZINC02561271 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51565915 CN1CCc2cc3OCOc3c3-c4ccccc4C[C@@H]1c23 InChI=1S/C18H17NO2/c1-19-7-6-12-9-15-18(21-10-20-15)17-13-5-3-2-4-11(13)8-14(19)16(12)17/h2-5,9,14H,6-8,10H2,1H3/t14-/m1/s1 JCTYWRARKVGOBK-CQSZACIVSA-N 50306886 CHEMBL602275::Roemerine-HBr Cholinesterase Equus caballus 2800 ChEMBL 10.1016/j.ejmech.2023.115414 10.7270/Q26W9GJT 37172474 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50306886 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50306886&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 119204 104161247 CHEMBL602275 ZINC00306698 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51565916 COc1cc2CC3N(C)CCc4cc5OCOc5c(-c2cc1OC)c34 InChI=1S/C20H21NO4/c1-21-5-4-11-7-17-20(25-10-24-17)19-13-9-16(23-3)15(22-2)8-12(13)6-14(21)18(11)19/h7-9,14H,4-6,10H2,1-3H3 YJWBWQWUHVXPNC-UHFFFAOYSA-N 50629672 CHEMBL481631 Cholinesterase Equus caballus 26410 ChEMBL 10.1016/j.ejmech.2023.115414 10.7270/Q26W9GJT 37172474 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50629672 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50629672&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51565917 COc1ccc-2c(C[C@H]3N(C)CCc4cc5OCOc5c-2c34)c1OC InChI=1S/C20H21NO4/c1-21-7-6-11-8-16-20(25-10-24-16)18-12-4-5-15(22-2)19(23-3)13(12)9-14(21)17(11)18/h4-5,8,14H,6-7,9-10H2,1-3H3/t14-/m1/s1 UVDQDNQWGQFIAO-CQSZACIVSA-N 50629673 CHEMBL1989287 Cholinesterase Equus caballus 17370 ChEMBL 10.1016/j.ejmech.2023.115414 10.7270/Q26W9GJT 37172474 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50629673 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50629673&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51565918 COc1c(O)cc2CCN[C@@H]3Cc4ccccc4-c1c23 InChI=1S/C17H17NO2/c1-20-17-14(19)9-11-6-7-18-13-8-10-4-2-3-5-12(10)16(17)15(11)13/h2-5,9,13,18-19H,6-8H2,1H3/t13-/m1/s1 NBDNEUOVIJYCGZ-CYBMUJFWSA-N 50241809 (-)-asimilobine::CHEMBL469423::[1-methoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-2-ol (6aR)] Cholinesterase Equus caballus 10080 ChEMBL 10.1016/j.ejmech.2023.115414 10.7270/Q26W9GJT 37172474 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50241809 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50241809&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 160875 104098873 70637 CHEMBL469423 ZINC31166315 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51565919 CN1CCc2cc3OCOc3c3-c4ccccc4[C@@H](O)[C@@H]1c23 InChI=1S/C18H17NO3/c1-19-7-6-10-8-13-18(22-9-21-13)15-11-4-2-3-5-12(11)17(20)16(19)14(10)15/h2-5,8,16-17,20H,6-7,9H2,1H3/t16-,17+/m0/s1 NVMGTUCOAQKLLO-DLBZAZTESA-N 50629677 CHEMBL1617041 Cholinesterase Equus caballus 7420 ChEMBL 10.1016/j.ejmech.2023.115414 10.7270/Q26W9GJT 37172474 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50629677 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50629677&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51565920 COc1cccc-2c1[C@@H](O)[C@H]1N(C)CCc3cc4OCOc4c-2c13 InChI=1S/C19H19NO4/c1-20-7-6-10-8-13-19(24-9-23-13)16-11-4-3-5-12(22-2)15(11)18(21)17(20)14(10)16/h3-5,8,17-18,21H,6-7,9H2,1-2H3/t17-,18+/m0/s1 HYWVELCSGZINQW-ZWKOTPCHSA-N 50629678 CHEMBL5430132 Cholinesterase Equus caballus 5870 ChEMBL 10.1016/j.ejmech.2023.115414 10.7270/Q26W9GJT 37172474 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50629678 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50629678&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51565921 COc1ccc-2c([C@@H](O)[C@H]3N(C)CCc4cc5OCOc5c-2c34)c1OC InChI=1S/C20H21NO5/c1-21-7-6-10-8-13-20(26-9-25-13)15-11-4-5-12(23-2)19(24-3)16(11)18(22)17(21)14(10)15/h4-5,8,17-18,22H,6-7,9H2,1-3H3/t17-,18+/m0/s1 RUNAFDLOXRYAAQ-ZWKOTPCHSA-N 50629679 CHEMBL5398483 Cholinesterase Equus caballus 22470 ChEMBL 10.1016/j.ejmech.2023.115414 10.7270/Q26W9GJT 37172474 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50629679 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50629679&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51565922 COc1ccc-2c(C[C@H]3N(C)CCc4cc5OCOc5c-2c34)c1 InChI=1S/C19H19NO3/c1-20-6-5-11-9-16-19(23-10-22-16)18-14-4-3-13(21-2)7-12(14)8-15(20)17(11)18/h3-4,7,9,15H,5-6,8,10H2,1-2H3/t15-/m1/s1 GXFOBPWUVXXUIF-OAHLLOKOSA-N 50629680 (-)-Isolaureline::CHEMBL510954 Cholinesterase Equus caballus 16580 ChEMBL 10.1016/j.ejmech.2023.115414 10.7270/Q26W9GJT 37172474 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50629680 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50629680&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51565923 COc1c2OCOc2c2-c3ccccc3C[C@H]3N(C)CCc1c23 InChI=1S/C19H19NO3/c1-20-8-7-13-15-14(20)9-11-5-3-4-6-12(11)16(15)18-19(17(13)21-2)23-10-22-18/h3-6,14H,7-10H2,1-2H3/t14-/m1/s1 NFEXDKYJEYMIMF-CQSZACIVSA-N 50629681 CHEMBL5414111 Cholinesterase Equus caballus 104200 ChEMBL 10.1016/j.ejmech.2023.115414 10.7270/Q26W9GJT 37172474 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50629681 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50629681&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51565924 CN1CCc2cc3OCOc3c3c4ccccc4cc1c23 InChI=1S/C18H15NO2/c1-19-7-6-12-9-15-18(21-10-20-15)17-13-5-3-2-4-11(13)8-14(19)16(12)17/h2-5,8-9H,6-7,10H2,1H3 YUWBTKIVDAWQHK-UHFFFAOYSA-N 50366292 Dehydroroemerine Cholinesterase Equus caballus 3340 ChEMBL 10.1016/j.ejmech.2023.115414 10.7270/Q26W9GJT 37172474 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50366292 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50366292&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 161899 160845394 ZINC95542577 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51565925 COc1cccc2c1cc1N(C)CCc3cc4OCOc4c2c13 InChI=1S/C19H17NO3/c1-20-7-6-11-8-16-19(23-10-22-16)18-12-4-3-5-15(21-2)13(12)9-14(20)17(11)18/h3-5,8-9H,6-7,10H2,1-2H3 WQXYOCWRQTXKCI-UHFFFAOYSA-N 50629676 CHEMBL5440844 Cholinesterase Equus caballus 3260 ChEMBL 10.1016/j.ejmech.2023.115414 10.7270/Q26W9GJT 37172474 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50629676 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50629676&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51565926 COc1ccc2c(c1)cc1N(C)CCc3cc4OCOc4c2c13 InChI=1S/C19H17NO3/c1-20-6-5-11-9-16-19(23-10-22-16)18-14-4-3-13(21-2)7-12(14)8-15(20)17(11)18/h3-4,7-9H,5-6,10H2,1-2H3 WQKWRKGCEATEEI-UHFFFAOYSA-N 50629675 CHEMBL5433445 Cholinesterase Equus caballus 20320 ChEMBL 10.1016/j.ejmech.2023.115414 10.7270/Q26W9GJT 37172474 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50629675 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50629675&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51565927 COc1cc2cc3N(C)CCc4cc5OCOc5c(c2cc1OC)c34 InChI=1S/C20H19NO4/c1-21-5-4-11-7-17-20(25-10-24-17)19-13-9-16(23-3)15(22-2)8-12(13)6-14(21)18(11)19/h6-9H,4-5,10H2,1-3H3 HIZKFQOZVOUKDP-UHFFFAOYSA-N 50629674 DEHYDRODICENTRINE::Dehydrodicentrine Cholinesterase Equus caballus 5570 ChEMBL 10.1016/j.ejmech.2023.115414 10.7270/Q26W9GJT 37172474 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50629674 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50629674&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51565928 COc1ccc2c(cc3N(C)CCc4cc5OCOc5c2c34)c1OC InChI=1S/C20H19NO4/c1-21-7-6-11-8-16-20(25-10-24-16)18-12-4-5-15(22-2)19(23-3)13(12)9-14(21)17(11)18/h4-5,8-9H,6-7,10H2,1-3H3 HCKFFNXOLCSPAI-UHFFFAOYSA-N 50629682 CHEMBL5437306 Cholinesterase Equus caballus 14110 ChEMBL 10.1016/j.ejmech.2023.115414 10.7270/Q26W9GJT 37172474 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50629682 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50629682&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51566388 [I-].C[N+](C)(C)CCOC(=O)CNC(=O)OCC1c2ccccc2-c2ccccc12 InChI=1S/C22H26N2O4.HI/c1-24(2,3)12-13-27-21(25)14-23-22(26)28-15-20-18-10-6-4-8-16(18)17-9-5-7-11-19(17)20;/h4-11,20H,12-15H2,1-3H3;1H XWOIZXKUFONRLA-UHFFFAOYSA-N 50629900 CHEMBL5437440 Cholinesterase Equus caballus 6700 ChEMBL 10.1016/j.bmcl.2023.129392 10.7270/Q2RN3D8P 37364726 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50629900 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50629900&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51566389 [I-].C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc12)C(=O)OCC[N+](C)(C)C InChI=1S/C23H28N2O4.HI/c1-16(22(26)28-14-13-25(2,3)4)24-23(27)29-15-21-19-11-7-5-9-17(19)18-10-6-8-12-20(18)21;/h5-12,16,21H,13-15H2,1-4H3;1H/t16-;/m0./s1 UDUISXUXPXLDDU-NTISSMGPSA-N 50629901 CHEMBL5409328 Cholinesterase Equus caballus 5100 ChEMBL 10.1016/j.bmcl.2023.129392 10.7270/Q2RN3D8P 37364726 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50629901 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50629901&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51566390 [I-].CC(C)C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc12)C(=O)OCC[N+](C)(C)C InChI=1S/C26H34N2O4.HI/c1-18(2)16-24(25(29)31-15-14-28(3,4)5)27-26(30)32-17-23-21-12-8-6-10-19(21)20-11-7-9-13-22(20)23;/h6-13,18,23-24H,14-17H2,1-5H3;1H/t24-;/m0./s1 CZSGOHYHAAFRQT-JIDHJSLPSA-N 50629902 CHEMBL5413592 Cholinesterase Equus caballus 700 ChEMBL 10.1016/j.bmcl.2023.129392 10.7270/Q2RN3D8P 37364726 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50629902 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50629902&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51566391 [I-].C[N+](C)(C)CCOC(=O)[C@H](Cc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc12 InChI=1S/C29H32N2O4.HI/c1-31(2,3)17-18-34-28(32)27(19-21-11-5-4-6-12-21)30-29(33)35-20-26-24-15-9-7-13-22(24)23-14-8-10-16-25(23)26;/h4-16,26-27H,17-20H2,1-3H3;1H/t27-;/m0./s1 RWFITUVOWOLVPA-YCBFMBTMSA-N 50629903 CHEMBL5422578 Cholinesterase Equus caballus 1000 ChEMBL 10.1016/j.bmcl.2023.129392 10.7270/Q2RN3D8P 37364726 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50629903 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50629903&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51566392 [I-].CC(C)(C)OC(=O)NCCCC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc12)C(=O)OCC[N+](C)(C)C InChI=1S/C31H43N3O6.HI/c1-31(2,3)40-29(36)32-18-12-11-17-27(28(35)38-20-19-34(4,5)6)33-30(37)39-21-26-24-15-9-7-13-22(24)23-14-8-10-16-25(23)26;/h7-10,13-16,26-27H,11-12,17-21H2,1-6H3,(H-,32,33,36,37);1H/t27-;/m0./s1 RRTXYJYGKMWMBZ-YCBFMBTMSA-N 50629904 CHEMBL5400946 Cholinesterase Equus caballus 500 ChEMBL 10.1016/j.bmcl.2023.129392 10.7270/Q2RN3D8P 37364726 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50629904 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50629904&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51566393 [I-].CC(C)(C)OC(=O)n1cc(C[C@H](NC(=O)OCC2c3ccccc3-c3ccccc23)C(=O)OCC[N+](C)(C)C)c2ccccc12 InChI=1S/C36H41N3O6.HI/c1-36(2,3)45-35(42)38-22-24(25-13-11-12-18-32(25)38)21-31(33(40)43-20-19-39(4,5)6)37-34(41)44-23-30-28-16-9-7-14-26(28)27-15-8-10-17-29(27)30;/h7-18,22,30-31H,19-21,23H2,1-6H3;1H/t31-;/m0./s1 AFUDYWDUMXPXIM-YNMZEGNTSA-N 50629905 CHEMBL5404369 Cholinesterase Equus caballus 400 ChEMBL 10.1016/j.bmcl.2023.129392 10.7270/Q2RN3D8P 37364726 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50629905 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50629905&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51566394 [I-].C[N+](C)(C)CCNC(=O)CNC(=O)OCC1c2ccccc2-c2ccccc12 InChI=1S/C22H27N3O3.HI/c1-25(2,3)13-12-23-21(26)14-24-22(27)28-15-20-18-10-6-4-8-16(18)17-9-5-7-11-19(17)20;/h4-11,20H,12-15H2,1-3H3,(H-,23,24,26,27);1H BHRWXLTWNNMPJM-UHFFFAOYSA-N 50629906 CHEMBL5401010 Cholinesterase Equus caballus 3700 ChEMBL 10.1016/j.bmcl.2023.129392 10.7270/Q2RN3D8P 37364726 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50629906 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50629906&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51566395 [I-].C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc12)C(=O)NCC[N+](C)(C)C InChI=1S/C23H29N3O3.HI/c1-16(22(27)24-13-14-26(2,3)4)25-23(28)29-15-21-19-11-7-5-9-17(19)18-10-6-8-12-20(18)21;/h5-12,16,21H,13-15H2,1-4H3,(H-,24,25,27,28);1H/t16-;/m0./s1 IERIWXSFDBXCKC-NTISSMGPSA-N 50629907 CHEMBL5439546 Cholinesterase Equus caballus 7500 ChEMBL 10.1016/j.bmcl.2023.129392 10.7270/Q2RN3D8P 37364726 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50629907 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50629907&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51566396 [I-].CC(C)C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc12)C(=O)NCC[N+](C)(C)C InChI=1S/C26H35N3O3.HI/c1-18(2)16-24(25(30)27-14-15-29(3,4)5)28-26(31)32-17-23-21-12-8-6-10-19(21)20-11-7-9-13-22(20)23;/h6-13,18,23-24H,14-17H2,1-5H3,(H-,27,28,30,31);1H/t24-;/m0./s1 ZGDYDHFBGKDALD-JIDHJSLPSA-N 50629908 CHEMBL5423632 Cholinesterase Equus caballus 1800 ChEMBL 10.1016/j.bmcl.2023.129392 10.7270/Q2RN3D8P 37364726 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50629908 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50629908&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51566397 [I-].C[N+](C)(C)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc12 InChI=1S/C29H33N3O3.HI/c1-32(2,3)18-17-30-28(33)27(19-21-11-5-4-6-12-21)31-29(34)35-20-26-24-15-9-7-13-22(24)23-14-8-10-16-25(23)26;/h4-16,26-27H,17-20H2,1-3H3,(H-,30,31,33,34);1H/t27-;/m0./s1 MSYRNGUSYSGMFM-YCBFMBTMSA-N 50629909 CHEMBL5420206 Cholinesterase Equus caballus 600 ChEMBL 10.1016/j.bmcl.2023.129392 10.7270/Q2RN3D8P 37364726 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50629909 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50629909&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51566398 [I-].CC(C)(C)OC(=O)NCCCC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc12)C(=O)NCC[N+](C)(C)C InChI=1S/C31H44N4O5.HI/c1-31(2,3)40-29(37)33-18-12-11-17-27(28(36)32-19-20-35(4,5)6)34-30(38)39-21-26-24-15-9-7-13-22(24)23-14-8-10-16-25(23)26;/h7-10,13-16,26-27H,11-12,17-21H2,1-6H3,(H2-,32,33,34,36,37,38);1H/t27-;/m0./s1 GJCMOZYBUXHHIC-YCBFMBTMSA-N 50629910 CHEMBL5422704 Cholinesterase Equus caballus 140 ChEMBL 10.1016/j.bmcl.2023.129392 10.7270/Q2RN3D8P 37364726 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50629910 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50629910&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51566399 [I-].CC(C)(C)OC(=O)n1cc(C[C@H](NC(=O)OCC2c3ccccc3-c3ccccc23)C(=O)NCC[N+](C)(C)C)c2ccccc12 InChI=1S/C36H42N4O5.HI/c1-36(2,3)45-35(43)39-22-24(25-13-11-12-18-32(25)39)21-31(33(41)37-19-20-40(4,5)6)38-34(42)44-23-30-28-16-9-7-14-26(28)27-15-8-10-17-29(27)30;/h7-18,22,30-31H,19-21,23H2,1-6H3,(H-,37,38,41,42);1H/t31-;/m0./s1 LTIHIDXOXOQOGS-YNMZEGNTSA-N 50629911 CHEMBL5414967 Cholinesterase Equus caballus 170 ChEMBL 10.1016/j.bmcl.2023.129392 10.7270/Q2RN3D8P 37364726 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50629911 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50629911&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51566400 CC(C)C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc12)C(O)=O InChI=1S/C21H23NO4/c1-13(2)11-19(20(23)24)22-21(25)26-12-18-16-9-5-3-7-14(16)15-8-4-6-10-17(15)18/h3-10,13,18-19H,11-12H2,1-2H3,(H,22,25)(H,23,24)/t19-/m0/s1 CBPJQFCAFFNICX-IBGZPJMESA-N 115093 (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methyl-pentanoic acid::(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methyl-valeric acid::(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoic acid::(2S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-methylpentanoic acid::Fmoc-L-leucine::MLS002695993::SMR001562137::cid_1549133 Cholinesterase Equus caballus 134000 ChEMBL 10.1016/j.bmcl.2023.129392 10.7270/Q2RN3D8P 37364726 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=115093 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=115093&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1549133 252664550 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51566401 OC(=O)[C@H](Cc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc12 InChI=1S/C24H21NO4/c26-23(27)22(14-16-8-2-1-3-9-16)25-24(28)29-15-21-19-12-6-4-10-17(19)18-11-5-7-13-20(18)21/h1-13,21-22H,14-15H2,(H,25,28)(H,26,27)/t22-/m0/s1 SJVFAHZPLIXNDH-QFIPXVFZSA-N 50467857 CHEMBL357583 Cholinesterase Equus caballus 320000 ChEMBL 10.1016/j.bmcl.2023.129392 10.7270/Q2RN3D8P 37364726 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50467857 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50467857&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 978331 433935122 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51566402 CC(C)(C)OC(=O)NCCCC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc12)C(O)=O InChI=1S/C26H32N2O6/c1-26(2,3)34-24(31)27-15-9-8-14-22(23(29)30)28-25(32)33-16-21-19-12-6-4-10-17(19)18-11-5-7-13-20(18)21/h4-7,10-13,21-22H,8-9,14-16H2,1-3H3,(H,27,31)(H,28,32)(H,29,30)/t22-/m0/s1 UMRUUWFGLGNQLI-QFIPXVFZSA-N 9850 (2S)-6-{[(tert-butoxy)carbonyl]amino}-2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}hexanoic acid::Lysine derivative 3 Cholinesterase Equus caballus 41000 ChEMBL 10.1016/j.bmcl.2023.129392 10.7270/Q2RN3D8P 37364726 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=9850 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=9850&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 2724628 46510512 ZINC04262049 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51566403 CC(C)(C)OC(=O)n1cc(C[C@H](NC(=O)OCC2c3ccccc3-c3ccccc23)C(O)=O)c2ccccc12 InChI=1S/C31H30N2O6/c1-31(2,3)39-30(37)33-17-19(20-10-8-9-15-27(20)33)16-26(28(34)35)32-29(36)38-18-25-23-13-6-4-11-21(23)22-12-5-7-14-24(22)25/h4-15,17,25-26H,16,18H2,1-3H3,(H,32,36)(H,34,35)/t26-/m0/s1 ADOHASQZJSJZBT-SANMLTNESA-N 50629912 CHEMBL5397715 Cholinesterase Equus caballus 23000 ChEMBL 10.1016/j.bmcl.2023.129392 10.7270/Q2RN3D8P 37364726 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50629912 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50629912&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51557798 CCOP(=O)(OCC)C(Nc1ccccc1)c1ccc(OCc2nc3ccccc3c(=O)n2-c2ccc(F)cc2)c(OC)c1 InChI=1S/C33H33FN3O6P/c1-4-42-44(39,43-5-2)32(35-25-11-7-6-8-12-25)23-15-20-29(30(21-23)40-3)41-22-31-36-28-14-10-9-13-27(28)33(38)37(31)26-18-16-24(34)17-19-26/h6-21,32,35H,4-5,22H2,1-3H3 NHTKCPNTIPXDDE-UHFFFAOYSA-N 50626959 CHEMBL5428540 Cholinesterase Equus caballus >100000 ChEMBL 10.1016/j.ejmech.2023.115288 10.7270/Q26T0S3M 37031527 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50626959 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50626959&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51557799 CCOP(=O)(OCC)C(Nc1ccc(F)cc1)c1ccc(OCc2nc3ccccc3c(=O)n2-c2ccc(F)cc2)c(OC)c1 InChI=1S/C33H32F2N3O6P/c1-4-43-45(40,44-5-2)32(36-25-15-11-23(34)12-16-25)22-10-19-29(30(20-22)41-3)42-21-31-37-28-9-7-6-8-27(28)33(39)38(31)26-17-13-24(35)14-18-26/h6-20,32,36H,4-5,21H2,1-3H3 WICDAAXKLHGTKM-UHFFFAOYSA-N 50626960 CHEMBL5416780 Cholinesterase Equus caballus 35365 ChEMBL 10.1016/j.ejmech.2023.115288 10.7270/Q26T0S3M 37031527 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50626960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50626960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51557800 CCOP(=O)(OCC)C(Nc1ccc(Cl)cc1)c1ccc(OCc2nc3ccccc3c(=O)n2-c2ccc(F)cc2)c(OC)c1 InChI=1S/C33H32ClFN3O6P/c1-4-43-45(40,44-5-2)32(36-25-15-11-23(34)12-16-25)22-10-19-29(30(20-22)41-3)42-21-31-37-28-9-7-6-8-27(28)33(39)38(31)26-17-13-24(35)14-18-26/h6-20,32,36H,4-5,21H2,1-3H3 KMCOEZSUHBOPCD-UHFFFAOYSA-N 50626961 CHEMBL5422865 Cholinesterase Equus caballus >100000 ChEMBL 10.1016/j.ejmech.2023.115288 10.7270/Q26T0S3M 37031527 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50626961 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50626961&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51557801 CCOP(=O)(OCC)C(Nc1ccccc1Br)c1ccc(OCc2nc3ccccc3c(=O)n2-c2ccc(F)cc2)c(OC)c1 InChI=1S/C33H32BrFN3O6P/c1-4-43-45(40,44-5-2)32(37-28-13-9-7-11-26(28)34)22-14-19-29(30(20-22)41-3)42-21-31-36-27-12-8-6-10-25(27)33(39)38(31)24-17-15-23(35)16-18-24/h6-20,32,37H,4-5,21H2,1-3H3 QRMZEMCBNNQZLW-UHFFFAOYSA-N 50626962 CHEMBL5415911 Cholinesterase Equus caballus >100000 ChEMBL 10.1016/j.ejmech.2023.115288 10.7270/Q26T0S3M 37031527 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50626962 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50626962&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51557802 CCOP(=O)(OCC)C(Nc1ccc(Br)cc1)c1ccc(OCc2nc3ccccc3c(=O)n2-c2ccc(F)cc2)c(OC)c1 InChI=1S/C33H32BrFN3O6P/c1-4-43-45(40,44-5-2)32(36-25-15-11-23(34)12-16-25)22-10-19-29(30(20-22)41-3)42-21-31-37-28-9-7-6-8-27(28)33(39)38(31)26-17-13-24(35)14-18-26/h6-20,32,36H,4-5,21H2,1-3H3 RSNKHJAXSGCUCQ-UHFFFAOYSA-N 50626963 CHEMBL5439155 Cholinesterase Equus caballus >100000 ChEMBL 10.1016/j.ejmech.2023.115288 10.7270/Q26T0S3M 37031527 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50626963 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50626963&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51557803 CCOP(=O)(OCC)C(Nc1ccccc1O)c1ccc(OCc2nc3ccccc3c(=O)n2-c2ccc(F)cc2)c(OC)c1 InChI=1S/C33H33FN3O7P/c1-4-43-45(40,44-5-2)32(36-27-12-8-9-13-28(27)38)22-14-19-29(30(20-22)41-3)42-21-31-35-26-11-7-6-10-25(26)33(39)37(31)24-17-15-23(34)16-18-24/h6-20,32,36,38H,4-5,21H2,1-3H3 GVZMYNYQZXKSKC-UHFFFAOYSA-N 50626964 CHEMBL5413480 Cholinesterase Equus caballus >100000 ChEMBL 10.1016/j.ejmech.2023.115288 10.7270/Q26T0S3M 37031527 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50626964 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50626964&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51557804 CCOP(=O)(OCC)C(Nc1cccc(O)c1)c1ccc(OCc2nc3ccccc3c(=O)n2-c2ccc(F)cc2)c(OC)c1 InChI=1S/C33H33FN3O7P/c1-4-43-45(40,44-5-2)32(35-24-9-8-10-26(38)20-24)22-13-18-29(30(19-22)41-3)42-21-31-36-28-12-7-6-11-27(28)33(39)37(31)25-16-14-23(34)15-17-25/h6-20,32,35,38H,4-5,21H2,1-3H3 KXTAITOAHXONFJ-UHFFFAOYSA-N 50626965 CHEMBL5426913 Cholinesterase Equus caballus >100000 ChEMBL 10.1016/j.ejmech.2023.115288 10.7270/Q26T0S3M 37031527 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50626965 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50626965&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51557805 CCOP(=O)(OCC)C(Nc1ccccc1C#N)c1ccc(OCc2nc3ccccc3c(=O)n2-c2ccc(F)cc2)c(OC)c1 InChI=1S/C34H32FN4O6P/c1-4-44-46(41,45-5-2)33(38-28-12-8-6-10-24(28)21-36)23-14-19-30(31(20-23)42-3)43-22-32-37-29-13-9-7-11-27(29)34(40)39(32)26-17-15-25(35)16-18-26/h6-20,33,38H,4-5,22H2,1-3H3 XORPGTGNAJHWCZ-UHFFFAOYSA-N 50626966 CHEMBL5407606 Cholinesterase Equus caballus 11025 ChEMBL 10.1016/j.ejmech.2023.115288 10.7270/Q26T0S3M 37031527 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50626966 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50626966&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51557806 CCOP(=O)(OCC)C(Nc1ccccc1C(F)(F)F)c1ccc(OCc2nc3ccccc3c(=O)n2-c2ccc(F)cc2)c(OC)c1 InChI=1S/C34H32F4N3O6P/c1-4-46-48(43,47-5-2)32(40-28-13-9-7-11-26(28)34(36,37)38)22-14-19-29(30(20-22)44-3)45-21-31-39-27-12-8-6-10-25(27)33(42)41(31)24-17-15-23(35)16-18-24/h6-20,32,40H,4-5,21H2,1-3H3 KXDQPAPDYNGFQI-UHFFFAOYSA-N 50626967 CHEMBL5424767 Cholinesterase Equus caballus >100000 ChEMBL 10.1016/j.ejmech.2023.115288 10.7270/Q26T0S3M 37031527 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50626967 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50626967&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51557807 CCOP(=O)(OCC)C(Nc1ccccc1C)c1ccc(OCc2nc3ccccc3c(=O)n2-c2ccc(F)cc2)c(OC)c1 InChI=1S/C34H35FN3O6P/c1-5-43-45(40,44-6-2)33(37-28-13-9-7-11-23(28)3)24-15-20-30(31(21-24)41-4)42-22-32-36-29-14-10-8-12-27(29)34(39)38(32)26-18-16-25(35)17-19-26/h7-21,33,37H,5-6,22H2,1-4H3 PNMOBYJSLJRIMZ-UHFFFAOYSA-N 50626968 CHEMBL5433166 Cholinesterase Equus caballus 33783 ChEMBL 10.1016/j.ejmech.2023.115288 10.7270/Q26T0S3M 37031527 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50626968 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50626968&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51557808 CCOP(=O)(OCC)C(Nc1ccc(C)cc1)c1ccc(OCc2nc3ccccc3c(=O)n2-c2ccc(F)cc2)c(OC)c1 InChI=1S/C34H35FN3O6P/c1-5-43-45(40,44-6-2)33(36-26-16-11-23(3)12-17-26)24-13-20-30(31(21-24)41-4)42-22-32-37-29-10-8-7-9-28(29)34(39)38(32)27-18-14-25(35)15-19-27/h7-21,33,36H,5-6,22H2,1-4H3 NVPMMBQJMQQEOB-UHFFFAOYSA-N 50626969 CHEMBL5407235 Cholinesterase Equus caballus >100000 ChEMBL 10.1016/j.ejmech.2023.115288 10.7270/Q26T0S3M 37031527 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50626969 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50626969&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51557809 CCOP(=O)(OCC)C(Nc1ccccc1CC)c1ccc(OCc2nc3ccccc3c(=O)n2-c2ccc(F)cc2)c(OC)c1 InChI=1S/C35H37FN3O6P/c1-5-24-12-8-10-14-29(24)38-34(46(41,44-6-2)45-7-3)25-16-21-31(32(22-25)42-4)43-23-33-37-30-15-11-9-13-28(30)35(40)39(33)27-19-17-26(36)18-20-27/h8-22,34,38H,5-7,23H2,1-4H3 HDBQWTYKMDHFEP-UHFFFAOYSA-N 50626970 CHEMBL5430999 Cholinesterase Equus caballus 29631 ChEMBL 10.1016/j.ejmech.2023.115288 10.7270/Q26T0S3M 37031527 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50626970 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50626970&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51557810 CCOP(=O)(OCC)C(Nc1ccccc1OC)c1ccc(OCc2nc3ccccc3c(=O)n2-c2ccc(F)cc2)c(OC)c1 InChI=1S/C34H35FN3O7P/c1-5-44-46(40,45-6-2)33(37-28-13-9-10-14-29(28)41-3)23-15-20-30(31(21-23)42-4)43-22-32-36-27-12-8-7-11-26(27)34(39)38(32)25-18-16-24(35)17-19-25/h7-21,33,37H,5-6,22H2,1-4H3 ZWUZQGWZVAEYAO-UHFFFAOYSA-N 50626971 CHEMBL5429003 Cholinesterase Equus caballus 10554 ChEMBL 10.1016/j.ejmech.2023.115288 10.7270/Q26T0S3M 37031527 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50626971 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50626971&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51557811 CCOP(=O)(OCC)C(Nc1ccc(OC)cc1)c1ccc(OCc2nc3ccccc3c(=O)n2-c2ccc(F)cc2)c(OC)c1 InChI=1S/C34H35FN3O7P/c1-5-44-46(40,45-6-2)33(36-25-14-18-27(41-3)19-15-25)23-11-20-30(31(21-23)42-4)43-22-32-37-29-10-8-7-9-28(29)34(39)38(32)26-16-12-24(35)13-17-26/h7-21,33,36H,5-6,22H2,1-4H3 NYUHIUQONFMOCM-UHFFFAOYSA-N 50626972 CHEMBL5405994 Cholinesterase Equus caballus >100000 ChEMBL 10.1016/j.ejmech.2023.115288 10.7270/Q26T0S3M 37031527 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50626972 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50626972&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51557812 CCOP(=O)(OCC)C(Nc1ccc(cc1)[N+]([O-])=O)c1ccc(OCc2nc3ccccc3c(=O)n2-c2ccc(F)cc2)c(OC)c1 InChI=1S/C33H32FN4O8P/c1-4-45-47(42,46-5-2)32(35-24-13-17-26(18-14-24)38(40)41)22-10-19-29(30(20-22)43-3)44-21-31-36-28-9-7-6-8-27(28)33(39)37(31)25-15-11-23(34)12-16-25/h6-20,32,35H,4-5,21H2,1-3H3 IGFAIZMGHCSJKW-UHFFFAOYSA-N 50626973 CHEMBL5421943 Cholinesterase Equus caballus >100000 ChEMBL 10.1016/j.ejmech.2023.115288 10.7270/Q26T0S3M 37031527 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50626973 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50626973&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51557813 CCOP(=O)(OCC)C(Nc1ccc(cc1)C(O)=O)c1ccc(OCc2nc3ccccc3c(=O)n2-c2ccc(F)cc2)c(OC)c1 InChI=1S/C34H33FN3O8P/c1-4-45-47(42,46-5-2)32(36-25-15-10-22(11-16-25)34(40)41)23-12-19-29(30(20-23)43-3)44-21-31-37-28-9-7-6-8-27(28)33(39)38(31)26-17-13-24(35)14-18-26/h6-20,32,36H,4-5,21H2,1-3H3,(H,40,41) SYAFXJONAPKFCV-UHFFFAOYSA-N 50626974 CHEMBL5433354 Cholinesterase Equus caballus 20246 ChEMBL 10.1016/j.ejmech.2023.115288 10.7270/Q26T0S3M 37031527 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50626974 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50626974&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51557814 CCOP(=O)(OCC)C(Nc1ccccc1C(C)=O)c1ccc(OCc2nc3ccccc3c(=O)n2-c2ccc(F)cc2)c(OC)c1 InChI=1S/C35H35FN3O7P/c1-5-45-47(42,46-6-2)34(38-29-13-9-7-11-27(29)23(3)40)24-15-20-31(32(21-24)43-4)44-22-33-37-30-14-10-8-12-28(30)35(41)39(33)26-18-16-25(36)17-19-26/h7-21,34,38H,5-6,22H2,1-4H3 DDQJAXGJMXUMJC-UHFFFAOYSA-N 50626975 CHEMBL5412970 Cholinesterase Equus caballus 12052 ChEMBL 10.1016/j.ejmech.2023.115288 10.7270/Q26T0S3M 37031527 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50626975 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50626975&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51557815 CCOP(=O)(OCC)C(Nc1cc(C)cc(C)c1)c1ccc(OCc2nc3ccccc3c(=O)n2-c2ccc(F)cc2)c(OC)c1 InChI=1S/C35H37FN3O6P/c1-6-44-46(41,45-7-2)34(37-27-19-23(3)18-24(4)20-27)25-12-17-31(32(21-25)42-5)43-22-33-38-30-11-9-8-10-29(30)35(40)39(33)28-15-13-26(36)14-16-28/h8-21,34,37H,6-7,22H2,1-5H3 DUQPGLVTIVRTDY-UHFFFAOYSA-N 50626976 CHEMBL5405968 Cholinesterase Equus caballus 26432 ChEMBL 10.1016/j.ejmech.2023.115288 10.7270/Q26T0S3M 37031527 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50626976 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50626976&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51557816 CCOP(=O)(OCC)C(Nc1cc(C)ccc1C)c1ccc(OCc2nc3ccccc3c(=O)n2-c2ccc(F)cc2)c(OC)c1 InChI=1S/C35H37FN3O6P/c1-6-44-46(41,45-7-2)34(38-30-20-23(3)12-13-24(30)4)25-14-19-31(32(21-25)42-5)43-22-33-37-29-11-9-8-10-28(29)35(40)39(33)27-17-15-26(36)16-18-27/h8-21,34,38H,6-7,22H2,1-5H3 CYDBJLDDUKNJJI-UHFFFAOYSA-N 50626977 CHEMBL5420040 Cholinesterase Equus caballus 18678 ChEMBL 10.1016/j.ejmech.2023.115288 10.7270/Q26T0S3M 37031527 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50626977 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50626977&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51557817 CCOP(=O)(OCC)C(Nc1c(C)cccc1C)c1ccc(OCc2nc3ccccc3c(=O)n2-c2ccc(F)cc2)c(OC)c1 InChI=1S/C35H37FN3O6P/c1-6-44-46(41,45-7-2)34(38-33-23(3)11-10-12-24(33)4)25-15-20-30(31(21-25)42-5)43-22-32-37-29-14-9-8-13-28(29)35(40)39(32)27-18-16-26(36)17-19-27/h8-21,34,38H,6-7,22H2,1-5H3 GOMKMYSERUHMOO-UHFFFAOYSA-N 50626978 CHEMBL5407691 Cholinesterase Equus caballus >100000 ChEMBL 10.1016/j.ejmech.2023.115288 10.7270/Q26T0S3M 37031527 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50626978 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50626978&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51557818 CCOP(=O)(OCC)C(Nc1cccc(Cl)c1Cl)c1ccc(OCc2nc3ccccc3c(=O)n2-c2ccc(F)cc2)c(OC)c1 InChI=1S/C33H31Cl2FN3O6P/c1-4-44-46(41,45-5-2)32(38-27-12-8-10-25(34)31(27)35)21-13-18-28(29(19-21)42-3)43-20-30-37-26-11-7-6-9-24(26)33(40)39(30)23-16-14-22(36)15-17-23/h6-19,32,38H,4-5,20H2,1-3H3 ZNTRQSRSBVJTIH-UHFFFAOYSA-N 50626979 CHEMBL5402496 Cholinesterase Equus caballus 23265 ChEMBL 10.1016/j.ejmech.2023.115288 10.7270/Q26T0S3M 37031527 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50626979 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50626979&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51557819 CCOP(=O)(OCC)C(Nc1nncs1)c1ccc(OCc2nc3ccccc3c(=O)n2-c2ccc(F)cc2)c(OC)c1 InChI=1S/C29H29FN5O6PS/c1-4-40-42(37,41-5-2)27(33-29-34-31-18-43-29)19-10-15-24(25(16-19)38-3)39-17-26-32-23-9-7-6-8-22(23)28(36)35(26)21-13-11-20(30)12-14-21/h6-16,18,27H,4-5,17H2,1-3H3,(H,33,34) ZVCIGFZJQSFSGN-UHFFFAOYSA-N 50626980 CHEMBL5424712 Cholinesterase Equus caballus >100000 ChEMBL 10.1016/j.ejmech.2023.115288 10.7270/Q26T0S3M 37031527 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50626980 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50626980&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51557820 COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1 ASUTZQLVASHGKV-JDFRZJQESA-N 10404 (1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol::CHEMBL659::GALANTAMINE HYDROBROMIDE::Galantamin::Galanthamine::Galanthamine, 12::Lycoremine::Nivalin::Nivaline::Razadyne::Reminyl::US11643395, Compound 10::US9586925, Galantamine::galantamine Cholinesterase Equus caballus 16076 ChEMBL 10.1016/j.ejmech.2023.115288 10.7270/Q26T0S3M 37031527 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=10404 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=10404&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search GNT 1W76,1QTI,1W6R,4EY6,2PH9,1DX6 9651 46511027 42944 CHEMBL659 DB00674 6693 C08526 ZINC00491073 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51555660 [Br-].COc1cc2CCN(C3Cc4ccccc4-c(c1OC)c23)C(=O)c1cc[n+](Cc2ccccc2)cc1 InChI=1S/C31H29N2O3.BrH/c1-35-27-19-24-14-17-33(26-18-23-10-6-7-11-25(23)29(28(24)26)30(27)36-2)31(34)22-12-15-32(16-13-22)20-21-8-4-3-5-9-21;/h3-13,15-16,19,26H,14,17-18,20H2,1-2H3;1H/q+1;/p-1 NUOZFMODYLYTKG-UHFFFAOYSA-M 50625930 CHEMBL5420759 Cholinesterase Equus caballus 1330 ChEMBL 10.1021/acsmedchemlett.3c00467 10.7270/Q2GH9PCR 38229749 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50625930 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50625930&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51555661 [Br-].COc1cc2CCN([C@H]3Cc4ccccc4-c(c1OC)c23)C(=O)c1cc[n+](Cc2ccccc2)cc1 InChI=1S/C31H29N2O3.BrH/c1-35-27-19-24-14-17-33(26-18-23-10-6-7-11-25(23)29(28(24)26)30(27)36-2)31(34)22-12-15-32(16-13-22)20-21-8-4-3-5-9-21;/h3-13,15-16,19,26H,14,17-18,20H2,1-2H3;1H/q+1;/p-1/t26-;/m0./s1 NUOZFMODYLYTKG-SNYZSRNZSA-M 50625931 CHEMBL5411326 Cholinesterase Equus caballus 4900 ChEMBL 10.1021/acsmedchemlett.3c00467 10.7270/Q2GH9PCR 38229749 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50625931 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50625931&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51555662 [Br-].COc1cc2CCN([C@@H]3Cc4ccccc4-c(c1OC)c23)C(=O)c1cc[n+](Cc2ccccc2)cc1 InChI=1S/C31H29N2O3.BrH/c1-35-27-19-24-14-17-33(26-18-23-10-6-7-11-25(23)29(28(24)26)30(27)36-2)31(34)22-12-15-32(16-13-22)20-21-8-4-3-5-9-21;/h3-13,15-16,19,26H,14,17-18,20H2,1-2H3;1H/q+1;/p-1/t26-;/m1./s1 NUOZFMODYLYTKG-UFTMZEDQSA-M 50625932 CHEMBL5401594 Cholinesterase Equus caballus 4950 ChEMBL 10.1021/acsmedchemlett.3c00467 10.7270/Q2GH9PCR 38229749 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50625932 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50625932&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51555663 [Br-].COc1cc2CCN(C3Cc4ccccc4-c(c1OC)c23)C(=O)c1cc[n+](Cc2ccccc2F)cc1 InChI=1S/C31H28FN2O3.BrH/c1-36-27-18-22-13-16-34(26-17-21-7-3-5-9-24(21)29(28(22)26)30(27)37-2)31(35)20-11-14-33(15-12-20)19-23-8-4-6-10-25(23)32;/h3-12,14-15,18,26H,13,16-17,19H2,1-2H3;1H/q+1;/p-1 AYYJRNQJKNYETR-UHFFFAOYSA-M 50625933 CHEMBL5413249 Cholinesterase Equus caballus 1370 ChEMBL 10.1021/acsmedchemlett.3c00467 10.7270/Q2GH9PCR 38229749 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50625933 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50625933&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51555664 [Br-].COc1cc2CCN(C3Cc4ccccc4-c(c1OC)c23)C(=O)c1cc[n+](Cc2cccc(F)c2)cc1 InChI=1S/C31H28FN2O3.BrH/c1-36-27-18-23-12-15-34(26-17-22-7-3-4-9-25(22)29(28(23)26)30(27)37-2)31(35)21-10-13-33(14-11-21)19-20-6-5-8-24(32)16-20;/h3-11,13-14,16,18,26H,12,15,17,19H2,1-2H3;1H/q+1;/p-1 MWHQJRHXUBAUSE-UHFFFAOYSA-M 50625934 CHEMBL5433803 Cholinesterase Equus caballus 1340 ChEMBL 10.1021/acsmedchemlett.3c00467 10.7270/Q2GH9PCR 38229749 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50625934 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50625934&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51555665 [Br-].COc1cc2CCN(C3Cc4ccccc4-c(c1OC)c23)C(=O)c1cc[n+](Cc2ccc(F)cc2)cc1 InChI=1S/C31H28FN2O3.BrH/c1-36-27-18-23-13-16-34(26-17-22-5-3-4-6-25(22)29(28(23)26)30(27)37-2)31(35)21-11-14-33(15-12-21)19-20-7-9-24(32)10-8-20;/h3-12,14-15,18,26H,13,16-17,19H2,1-2H3;1H/q+1;/p-1 DSKLHEFMNMPKDX-UHFFFAOYSA-M 50625935 CHEMBL5418957 Cholinesterase Equus caballus 4730 ChEMBL 10.1021/acsmedchemlett.3c00467 10.7270/Q2GH9PCR 38229749 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50625935 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50625935&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51555666 [Br-].COc1cc2CCN([C@H]3Cc4ccccc4-c(c1OC)c23)C(=O)c1cc[n+](Cc2ccc(F)cc2)cc1 InChI=1S/C31H28FN2O3.BrH/c1-36-27-18-23-13-16-34(26-17-22-5-3-4-6-25(22)29(28(23)26)30(27)37-2)31(35)21-11-14-33(15-12-21)19-20-7-9-24(32)10-8-20;/h3-12,14-15,18,26H,13,16-17,19H2,1-2H3;1H/q+1;/p-1/t26-;/m0./s1 DSKLHEFMNMPKDX-SNYZSRNZSA-M 50625936 CHEMBL5401023 Cholinesterase Equus caballus 8580 ChEMBL 10.1021/acsmedchemlett.3c00467 10.7270/Q2GH9PCR 38229749 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50625936 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50625936&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51555667 [Br-].COc1cc2CCN([C@@H]3Cc4ccccc4-c(c1OC)c23)C(=O)c1cc[n+](Cc2ccc(F)cc2)cc1 InChI=1S/C31H28FN2O3.BrH/c1-36-27-18-23-13-16-34(26-17-22-5-3-4-6-25(22)29(28(23)26)30(27)37-2)31(35)21-11-14-33(15-12-21)19-20-7-9-24(32)10-8-20;/h3-12,14-15,18,26H,13,16-17,19H2,1-2H3;1H/q+1;/p-1/t26-;/m1./s1 DSKLHEFMNMPKDX-UFTMZEDQSA-M 50625937 CHEMBL5435159 Cholinesterase Equus caballus 15390 ChEMBL 10.1021/acsmedchemlett.3c00467 10.7270/Q2GH9PCR 38229749 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50625937 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50625937&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51555668 [Br-].COc1cc2CCN(C3Cc4ccccc4-c(c1OC)c23)C(=O)c1cc[n+](Cc2cccc(F)c2F)cc1 InChI=1S/C31H27F2N2O3.BrH/c1-37-26-17-21-12-15-35(25-16-20-6-3-4-8-23(20)28(27(21)25)30(26)38-2)31(36)19-10-13-34(14-11-19)18-22-7-5-9-24(32)29(22)33;/h3-11,13-14,17,25H,12,15-16,18H2,1-2H3;1H/q+1;/p-1 SZYCXKSRERWKGH-UHFFFAOYSA-M 50625938 CHEMBL5421487 Cholinesterase Equus caballus 1540 ChEMBL 10.1021/acsmedchemlett.3c00467 10.7270/Q2GH9PCR 38229749 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50625938 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50625938&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51555669 [Br-].COc1cc2CCN(C3Cc4ccccc4-c(c1OC)c23)C(=O)c1cc[n+](Cc2c(F)cccc2F)cc1 InChI=1S/C31H27F2N2O3.BrH/c1-37-27-17-21-12-15-35(26-16-20-6-3-4-7-22(20)29(28(21)26)30(27)38-2)31(36)19-10-13-34(14-11-19)18-23-24(32)8-5-9-25(23)33;/h3-11,13-14,17,26H,12,15-16,18H2,1-2H3;1H/q+1;/p-1 PWQMIURPAOCPNR-UHFFFAOYSA-M 50625939 CHEMBL5405227 Cholinesterase Equus caballus 970 ChEMBL 10.1021/acsmedchemlett.3c00467 10.7270/Q2GH9PCR 38229749 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50625939 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50625939&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51555670 [Br-].COc1cc2CCN(C3Cc4ccccc4-c(c1OC)c23)C(=O)c1cc[n+](Cc2ccccc2Cl)cc1 InChI=1S/C31H28ClN2O3.BrH/c1-36-27-18-22-13-16-34(26-17-21-7-3-5-9-24(21)29(28(22)26)30(27)37-2)31(35)20-11-14-33(15-12-20)19-23-8-4-6-10-25(23)32;/h3-12,14-15,18,26H,13,16-17,19H2,1-2H3;1H/q+1;/p-1 NFRXZIOVKXQHSF-UHFFFAOYSA-M 50625940 CHEMBL5397094 Cholinesterase Equus caballus 710 ChEMBL 10.1021/acsmedchemlett.3c00467 10.7270/Q2GH9PCR 38229749 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50625940 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50625940&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51555671 [Br-].COc1cc2CCN([C@H]3Cc4ccccc4-c(c1OC)c23)C(=O)c1cc[n+](Cc2ccccc2Cl)cc1 InChI=1S/C31H28ClN2O3.BrH/c1-36-27-18-22-13-16-34(26-17-21-7-3-5-9-24(21)29(28(22)26)30(27)37-2)31(35)20-11-14-33(15-12-20)19-23-8-4-6-10-25(23)32;/h3-12,14-15,18,26H,13,16-17,19H2,1-2H3;1H/q+1;/p-1/t26-;/m0./s1 NFRXZIOVKXQHSF-SNYZSRNZSA-M 50625941 CHEMBL5435446 Cholinesterase Equus caballus 1820 ChEMBL 10.1021/acsmedchemlett.3c00467 10.7270/Q2GH9PCR 38229749 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50625941 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50625941&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51555672 [Br-].COc1cc2CCN([C@@H]3Cc4ccccc4-c(c1OC)c23)C(=O)c1cc[n+](Cc2ccccc2Cl)cc1 InChI=1S/C31H28ClN2O3.BrH/c1-36-27-18-22-13-16-34(26-17-21-7-3-5-9-24(21)29(28(22)26)30(27)37-2)31(35)20-11-14-33(15-12-20)19-23-8-4-6-10-25(23)32;/h3-12,14-15,18,26H,13,16-17,19H2,1-2H3;1H/q+1;/p-1/t26-;/m1./s1 NFRXZIOVKXQHSF-UFTMZEDQSA-M 50625942 CHEMBL5397579 Cholinesterase Equus caballus 2490 ChEMBL 10.1021/acsmedchemlett.3c00467 10.7270/Q2GH9PCR 38229749 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50625942 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50625942&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51555673 [Br-].COc1cc2CCN(C3Cc4ccccc4-c(c1OC)c23)C(=O)c1cc[n+](Cc2cccc(Cl)c2)cc1 InChI=1S/C31H28ClN2O3.BrH/c1-36-27-18-23-12-15-34(26-17-22-7-3-4-9-25(22)29(28(23)26)30(27)37-2)31(35)21-10-13-33(14-11-21)19-20-6-5-8-24(32)16-20;/h3-11,13-14,16,18,26H,12,15,17,19H2,1-2H3;1H/q+1;/p-1 FYYIMDBLXSOZEO-UHFFFAOYSA-M 50625943 CHEMBL5396980 Cholinesterase Equus caballus 960 ChEMBL 10.1021/acsmedchemlett.3c00467 10.7270/Q2GH9PCR 38229749 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50625943 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50625943&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51555674 [Br-].COc1cc2CCN(C(=O)c3cc[n+](Cc4ccccc4F)cc3)c3cc4ccccc4c(c1OC)c23 InChI=1S/C31H26FN2O3.BrH/c1-36-27-18-22-13-16-34(26-17-21-7-3-5-9-24(21)29(28(22)26)30(27)37-2)31(35)20-11-14-33(15-12-20)19-23-8-4-6-10-25(23)32;/h3-12,14-15,17-18H,13,16,19H2,1-2H3;1H/q+1;/p-1 WESSSYMJWIWRAO-UHFFFAOYSA-M 50625944 CHEMBL5415333 Cholinesterase Equus caballus 280 ChEMBL 10.1021/acsmedchemlett.3c00467 10.7270/Q2GH9PCR 38229749 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50625944 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50625944&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51555675 [Br-].COc1cc2CCN(C(=O)c3cc[n+](Cc4ccccc4Cl)cc3)c3cc4ccccc4c(c1OC)c23 InChI=1S/C31H26ClN2O3.BrH/c1-36-27-18-22-13-16-34(26-17-21-7-3-5-9-24(21)29(28(22)26)30(27)37-2)31(35)20-11-14-33(15-12-20)19-23-8-4-6-10-25(23)32;/h3-12,14-15,17-18H,13,16,19H2,1-2H3;1H/q+1;/p-1 IPKZCCKSINTNEJ-UHFFFAOYSA-M 50625945 CHEMBL5423996 Cholinesterase Equus caballus 440 ChEMBL 10.1021/acsmedchemlett.3c00467 10.7270/Q2GH9PCR 38229749 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50625945 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50625945&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51555676 COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3 ADEBPBSSDYVVLD-UHFFFAOYSA-N 8960 (+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-indan-1-one::2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one::Aricept::Aricept odt::CHEMBL1678::CHEMBL2337271::CHEMBL502::DONEPEZIL HYDROCHLORIDE::Donepezil::Donepzil::E2020::US8999994, Donepezil::US9346818, DPH::US9586925, Donepezil::US9663465, Donepezil Cholinesterase Equus caballus 16530 ChEMBL 10.1021/acsmedchemlett.3c00467 10.7270/Q2GH9PCR 38229749 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=8960 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=8960&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search E20 1EVE,4EY7,7E3H,6O4W 3152 46509735 53289 CHEMBL502CHEMBL1678CHEMBL2337271 DB00843 6599 ZINC00897251 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51535265 COc1cc(cc(OC)c1OC)-c1nc2ccc(NCC3CCN(Cc4ccccc4)CC3)cc2c(=O)[nH]1 InChI=1S/C30H34N4O4/c1-36-26-15-22(16-27(37-2)28(26)38-3)29-32-25-10-9-23(17-24(25)30(35)33-29)31-18-20-11-13-34(14-12-20)19-21-7-5-4-6-8-21/h4-10,15-17,20,31H,11-14,18-19H2,1-3H3,(H,32,33,35) GYLBFIZOOOVEFR-UHFFFAOYSA-N 50617586 CHEMBL5413198 Cholinesterase Equus caballus 11200 ChEMBL 10.1016/j.ejmech.2023.115346 10.7270/Q22J6H6X 37043994 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50617586 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50617586&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51535266 COc1cc(OC)c2c(c1)nc([nH]c2=O)-c1nc[nH]c1C InChI=1S/C14H14N4O3/c1-7-12(16-6-15-7)13-17-9-4-8(20-2)5-10(21-3)11(9)14(19)18-13/h4-6H,1-3H3,(H,15,16)(H,17,18,19) SPVMZHAADXBUNH-UHFFFAOYSA-N 50617587 CHEMBL5437310 Cholinesterase Equus caballus >20000 ChEMBL 10.1016/j.ejmech.2023.115346 10.7270/Q22J6H6X 37043994 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50617587 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50617587&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51535267 COc1cc(OC)c2c(c1)nc([nH]c2=O)-c1cn(Cc2ccccc2)cn1 InChI=1S/C20H18N4O3/c1-26-14-8-15-18(17(9-14)27-2)20(25)23-19(22-15)16-11-24(12-21-16)10-13-6-4-3-5-7-13/h3-9,11-12H,10H2,1-2H3,(H,22,23,25) CNGHHSLVDDSUMU-UHFFFAOYSA-N 50617588 CHEMBL5422203 Cholinesterase Equus caballus 830 ChEMBL 10.1016/j.ejmech.2023.115346 10.7270/Q22J6H6X 37043994 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50617588 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50617588&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51535268 COc1cc(OC)c2c(c1)nc([nH]c2=O)C1CCN(Cc2ccccc2)CC1 InChI=1S/C22H25N3O3/c1-27-17-12-18-20(19(13-17)28-2)22(26)24-21(23-18)16-8-10-25(11-9-16)14-15-6-4-3-5-7-15/h3-7,12-13,16H,8-11,14H2,1-2H3,(H,23,24,26) MSFIPWKDPOSQLF-UHFFFAOYSA-N 50617589 CHEMBL5419056 Cholinesterase Equus caballus 36900 ChEMBL 10.1016/j.ejmech.2023.115346 10.7270/Q22J6H6X 37043994 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50617589 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50617589&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51535269 [O-][N+](=O)c1ccc2nc([nH]c(=O)c2c1)C1CCN(Cc2ccccc2)CC1 InChI=1S/C20H20N4O3/c25-20-17-12-16(24(26)27)6-7-18(17)21-19(22-20)15-8-10-23(11-9-15)13-14-4-2-1-3-5-14/h1-7,12,15H,8-11,13H2,(H,21,22,25) QGIOXXTWYFDAQV-UHFFFAOYSA-N 50617590 CHEMBL5399530 Cholinesterase Equus caballus >20000 ChEMBL 10.1016/j.ejmech.2023.115346 10.7270/Q22J6H6X 37043994 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50617590 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50617590&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51535270 COc1cc(OC)c2c(c1)nc([nH]c2=O)-c1ccc(cc1)N1CCN(C)CC1 InChI=1S/C21H24N4O3/c1-24-8-10-25(11-9-24)15-6-4-14(5-7-15)20-22-17-12-16(27-2)13-18(28-3)19(17)21(26)23-20/h4-7,12-13H,8-11H2,1-3H3,(H,22,23,26) RVCUXKFESITCJF-UHFFFAOYSA-N 50617591 CHEMBL5404324 Cholinesterase Equus caballus >20000 ChEMBL 10.1016/j.ejmech.2023.115346 10.7270/Q22J6H6X 37043994 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50617591 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50617591&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51535271 CN1CCN(CC1)c1ccc(cc1)-c1nc2ccccc2c(=O)[nH]1 InChI=1S/C19H20N4O/c1-22-10-12-23(13-11-22)15-8-6-14(7-9-15)18-20-17-5-3-2-4-16(17)19(24)21-18/h2-9H,10-13H2,1H3,(H,20,21,24) VBYDQSJJOWUWKL-UHFFFAOYSA-N 50617592 CHEMBL5402063 Cholinesterase Equus caballus >20000 ChEMBL 10.1016/j.ejmech.2023.115346 10.7270/Q22J6H6X 37043994 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50617592 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50617592&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51535272 CN1CCN(CC1)c1ccc(cc1)-c1nc2ccc(Br)cc2c(=O)[nH]1 InChI=1S/C19H19BrN4O/c1-23-8-10-24(11-9-23)15-5-2-13(3-6-15)18-21-17-7-4-14(20)12-16(17)19(25)22-18/h2-7,12H,8-11H2,1H3,(H,21,22,25) SWBZSFORFWTXAC-UHFFFAOYSA-N 50617593 CHEMBL5438717 Cholinesterase Equus caballus >20000 ChEMBL 10.1016/j.ejmech.2023.115346 10.7270/Q22J6H6X 37043994 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50617593 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50617593&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51535273 CN1CCN(CC1)c1ccc(cc1)-c1nc2ccc(cc2c(=O)[nH]1)[N+]([O-])=O InChI=1S/C19H19N5O3/c1-22-8-10-23(11-9-22)14-4-2-13(3-5-14)18-20-17-7-6-15(24(26)27)12-16(17)19(25)21-18/h2-7,12H,8-11H2,1H3,(H,20,21,25) SUCVDAMLLCMLJI-UHFFFAOYSA-N 50617594 CHEMBL5425030 Cholinesterase Equus caballus >100000 ChEMBL 10.1016/j.ejmech.2023.115346 10.7270/Q22J6H6X 37043994 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50617594 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50617594&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908 51535275 COc1cc(OC)c2c(c1)nc([nH]c2=O)-c1cn(Cc2ccccc2)cn1 InChI=1S/C20H18N4O3/c1-26-14-8-15-18(17(9-14)27-2)20(25)23-19(22-15)16-11-24(12-21-16)10-13-6-4-3-5-7-13/h3-9,11-12H,10H2,1-2H3,(H,22,23,25) CNGHHSLVDDSUMU-UHFFFAOYSA-N 50617588 CHEMBL5422203 Cholinesterase Equus caballus 740 ChEMBL 10.1016/j.ejmech.2023.115346 10.7270/Q22J6H6X 37043994 n/a n/a http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50617588 http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=10127&target=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50617588&enzyme=Cholinesterase&column=ki&startPg=0&Increment=50&submit=Search 1 EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF 5NN0,4BBZ,2Y1K,2WIK,2WIJ,2WIF Cholinesterase CHLE_HORSE P81908